USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 608 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.136) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 160:sc= -0.94 USER MOD Single : A 14 SER OG : rot -70:sc= -0.0128 USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 21 MET CE :methyl -164:sc= -0.338 (180deg=-0.863) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -170:sc= -1.45 (180deg=-1.75) USER MOD Single : A 28 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 30 HIS : no HD1:sc= -0.0511 K(o=-0.051,f=-0.77) USER MOD Single : A 34 CYS SG : rot 60:sc= -4.66! USER MOD Single : A 35 HIS : no HE2:sc= -3.5! C(o=-3.5!,f=-10!) USER MOD Single : A 37 SER OG : rot -150:sc= -0.848 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 52 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.101) USER MOD Single : A 54 ASN : amide:sc= -0.908 X(o=-0.91,f=-0.93) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -36:sc= -0.42! USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -161:sc=-0.00961 (180deg=-0.235) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.179 3.933 19.380 1.00 0.00 N ATOM 2 CA MET A 1 -0.275 3.347 20.396 1.00 0.00 C ATOM 3 C MET A 1 0.090 1.919 20.008 1.00 0.00 C ATOM 4 O MET A 1 -0.773 1.109 19.733 1.00 0.00 O ATOM 5 CB MET A 1 -0.973 3.323 21.767 1.00 0.00 C ATOM 6 CG MET A 1 -0.014 3.862 22.830 1.00 0.00 C ATOM 7 SD MET A 1 0.707 5.498 22.545 1.00 0.00 S ATOM 8 CE MET A 1 0.173 6.254 24.101 1.00 0.00 C ATOM 0 H1 MET A 1 -1.423 4.907 19.652 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.703 3.941 18.455 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.047 3.363 19.318 1.00 0.00 H new ATOM 0 HA MET A 1 0.627 3.956 20.450 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.879 3.928 21.738 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.276 2.306 22.016 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.545 3.889 23.781 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.802 3.148 22.941 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.516 7.288 24.140 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.915 6.230 24.163 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.596 5.700 24.939 1.00 0.00 H new ATOM 17 N ALA A 2 1.366 1.636 19.990 1.00 0.00 N ATOM 18 CA ALA A 2 1.806 0.267 19.622 1.00 0.00 C ATOM 19 C ALA A 2 1.717 -0.672 20.815 1.00 0.00 C ATOM 20 O ALA A 2 2.302 -1.736 20.814 1.00 0.00 O ATOM 21 CB ALA A 2 3.271 0.337 19.159 1.00 0.00 C ATOM 0 H ALA A 2 2.115 2.292 20.213 1.00 0.00 H new ATOM 0 HA ALA A 2 1.159 -0.112 18.831 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.614 -0.660 18.884 1.00 0.00 H new ATOM 0 HB2 ALA A 2 3.349 0.998 18.296 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.890 0.723 19.969 1.00 0.00 H new ATOM 27 N LYS A 3 0.986 -0.260 21.815 1.00 0.00 N ATOM 28 CA LYS A 3 0.845 -1.115 23.021 1.00 0.00 C ATOM 29 C LYS A 3 2.210 -1.428 23.620 1.00 0.00 C ATOM 30 O LYS A 3 3.232 -1.074 23.066 1.00 0.00 O ATOM 31 CB LYS A 3 0.167 -2.441 22.619 1.00 0.00 C ATOM 32 CG LYS A 3 -1.020 -2.152 21.693 1.00 0.00 C ATOM 33 CD LYS A 3 -2.195 -1.649 22.531 1.00 0.00 C ATOM 34 CE LYS A 3 -3.455 -1.628 21.663 1.00 0.00 C ATOM 35 NZ LYS A 3 -3.986 -3.008 21.478 1.00 0.00 N ATOM 0 H LYS A 3 0.484 0.627 21.847 1.00 0.00 H new ATOM 0 HA LYS A 3 0.245 -0.583 23.760 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.884 -3.090 22.116 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.173 -2.971 23.508 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -0.743 -1.407 20.948 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -1.303 -3.054 21.151 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.345 -2.296 23.396 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.984 -0.650 22.913 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -4.214 -1.000 22.129 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -3.228 -1.187 20.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -4.959 -2.960 21.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -3.387 -3.522 20.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -3.983 -3.506 22.391 1.00 0.00 H new ATOM 49 N LYS A 4 2.203 -2.086 24.745 1.00 0.00 N ATOM 50 CA LYS A 4 3.488 -2.432 25.396 1.00 0.00 C ATOM 51 C LYS A 4 4.419 -1.220 25.442 1.00 0.00 C ATOM 52 O LYS A 4 3.975 -0.092 25.348 1.00 0.00 O ATOM 53 CB LYS A 4 4.151 -3.559 24.583 1.00 0.00 C ATOM 54 CG LYS A 4 3.798 -4.903 25.224 1.00 0.00 C ATOM 55 CD LYS A 4 3.693 -5.970 24.135 1.00 0.00 C ATOM 56 CE LYS A 4 3.298 -7.302 24.778 1.00 0.00 C ATOM 57 NZ LYS A 4 1.827 -7.516 24.673 1.00 0.00 N ATOM 0 H LYS A 4 1.365 -2.396 25.237 1.00 0.00 H new ATOM 0 HA LYS A 4 3.300 -2.754 26.420 1.00 0.00 H new ATOM 0 HB2 LYS A 4 3.806 -3.532 23.549 1.00 0.00 H new ATOM 0 HB3 LYS A 4 5.232 -3.423 24.562 1.00 0.00 H new ATOM 0 HG2 LYS A 4 4.560 -5.183 25.951 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.855 -4.825 25.764 1.00 0.00 H new ATOM 0 HD2 LYS A 4 2.952 -5.677 23.391 1.00 0.00 H new ATOM 0 HD3 LYS A 4 4.645 -6.071 23.614 1.00 0.00 H new ATOM 0 HE2 LYS A 4 3.826 -8.120 24.288 1.00 0.00 H new ATOM 0 HE3 LYS A 4 3.599 -7.310 25.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 1.576 -8.424 25.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 1.328 -6.745 25.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 1.549 -7.529 23.671 1.00 0.00 H new ATOM 71 N ASP A 5 5.694 -1.476 25.589 1.00 0.00 N ATOM 72 CA ASP A 5 6.661 -0.355 25.643 1.00 0.00 C ATOM 73 C ASP A 5 6.546 0.372 26.971 1.00 0.00 C ATOM 74 O ASP A 5 6.298 -0.236 27.995 1.00 0.00 O ATOM 75 CB ASP A 5 6.340 0.629 24.505 1.00 0.00 C ATOM 76 CG ASP A 5 7.648 1.125 23.885 1.00 0.00 C ATOM 77 OD1 ASP A 5 7.743 1.029 22.673 1.00 0.00 O ATOM 78 OD2 ASP A 5 8.479 1.572 24.660 1.00 0.00 O ATOM 0 H ASP A 5 6.099 -2.408 25.673 1.00 0.00 H new ATOM 0 HA ASP A 5 7.673 -0.746 25.537 1.00 0.00 H new ATOM 0 HB2 ASP A 5 5.727 0.140 23.748 1.00 0.00 H new ATOM 0 HB3 ASP A 5 5.763 1.471 24.888 1.00 0.00 H new ATOM 83 N VAL A 6 6.726 1.655 26.938 1.00 0.00 N ATOM 84 CA VAL A 6 6.629 2.433 28.197 1.00 0.00 C ATOM 85 C VAL A 6 5.188 2.571 28.627 1.00 0.00 C ATOM 86 O VAL A 6 4.287 2.458 27.818 1.00 0.00 O ATOM 87 CB VAL A 6 7.187 3.844 27.955 1.00 0.00 C ATOM 88 CG1 VAL A 6 8.703 3.828 28.129 1.00 0.00 C ATOM 89 CG2 VAL A 6 6.842 4.287 26.533 1.00 0.00 C ATOM 0 H VAL A 6 6.935 2.198 26.100 1.00 0.00 H new ATOM 0 HA VAL A 6 7.193 1.913 28.971 1.00 0.00 H new ATOM 0 HB VAL A 6 6.747 4.539 28.671 1.00 0.00 H new ATOM 0 HG11 VAL A 6 9.100 4.829 27.957 1.00 0.00 H new ATOM 0 HG12 VAL A 6 8.950 3.509 29.142 1.00 0.00 H new ATOM 0 HG13 VAL A 6 9.144 3.135 27.412 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.236 5.288 26.358 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.284 3.593 25.818 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.759 4.297 26.408 1.00 0.00 H new ATOM 99 N ILE A 7 4.989 2.808 29.898 1.00 0.00 N ATOM 100 CA ILE A 7 3.599 2.958 30.397 1.00 0.00 C ATOM 101 C ILE A 7 3.280 4.427 30.574 1.00 0.00 C ATOM 102 O ILE A 7 3.658 5.036 31.556 1.00 0.00 O ATOM 103 CB ILE A 7 3.482 2.253 31.749 1.00 0.00 C ATOM 104 CG1 ILE A 7 3.911 0.802 31.609 1.00 0.00 C ATOM 105 CG2 ILE A 7 2.011 2.286 32.195 1.00 0.00 C ATOM 106 CD1 ILE A 7 5.343 0.652 32.121 1.00 0.00 C ATOM 0 H ILE A 7 5.722 2.902 30.601 1.00 0.00 H new ATOM 0 HA ILE A 7 2.902 2.519 29.683 1.00 0.00 H new ATOM 0 HB ILE A 7 4.118 2.755 32.478 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.240 0.155 32.174 1.00 0.00 H new ATOM 0 HG13 ILE A 7 3.850 0.491 30.566 1.00 0.00 H new ATOM 0 HG21 ILE A 7 1.912 1.786 33.159 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.682 3.321 32.287 1.00 0.00 H new ATOM 0 HG23 ILE A 7 1.395 1.774 31.456 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.657 -0.387 32.023 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.007 1.288 31.536 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.387 0.948 33.169 1.00 0.00 H new ATOM 118 N GLU A 8 2.585 4.975 29.622 1.00 0.00 N ATOM 119 CA GLU A 8 2.231 6.405 29.715 1.00 0.00 C ATOM 120 C GLU A 8 0.969 6.591 30.532 1.00 0.00 C ATOM 121 O GLU A 8 -0.103 6.193 30.120 1.00 0.00 O ATOM 122 CB GLU A 8 1.997 6.937 28.295 1.00 0.00 C ATOM 123 CG GLU A 8 3.251 6.675 27.454 1.00 0.00 C ATOM 124 CD GLU A 8 3.042 7.219 26.039 1.00 0.00 C ATOM 125 OE1 GLU A 8 2.651 8.371 25.954 1.00 0.00 O ATOM 126 OE2 GLU A 8 3.286 6.450 25.123 1.00 0.00 O ATOM 0 H GLU A 8 2.250 4.493 28.788 1.00 0.00 H new ATOM 0 HA GLU A 8 3.041 6.947 30.203 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.133 6.447 27.846 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.779 8.004 28.324 1.00 0.00 H new ATOM 0 HG2 GLU A 8 4.116 7.152 27.914 1.00 0.00 H new ATOM 0 HG3 GLU A 8 3.459 5.606 27.417 1.00 0.00 H new ATOM 133 N LEU A 9 1.121 7.193 31.684 1.00 0.00 N ATOM 134 CA LEU A 9 -0.059 7.421 32.555 1.00 0.00 C ATOM 135 C LEU A 9 -0.014 8.815 33.156 1.00 0.00 C ATOM 136 O LEU A 9 1.049 9.362 33.380 1.00 0.00 O ATOM 137 CB LEU A 9 -0.033 6.384 33.690 1.00 0.00 C ATOM 138 CG LEU A 9 -0.596 5.056 33.172 1.00 0.00 C ATOM 139 CD1 LEU A 9 -0.519 4.006 34.283 1.00 0.00 C ATOM 140 CD2 LEU A 9 -2.059 5.250 32.765 1.00 0.00 C ATOM 0 H LEU A 9 2.009 7.533 32.053 1.00 0.00 H new ATOM 0 HA LEU A 9 -0.969 7.324 31.963 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.987 6.245 34.049 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -0.623 6.738 34.536 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.016 4.725 32.311 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.919 3.060 33.918 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.520 3.869 34.583 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -1.103 4.340 35.140 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -2.462 4.307 32.396 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -2.637 5.578 33.629 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.121 6.003 31.980 1.00 0.00 H new ATOM 152 N GLU A 10 -1.166 9.371 33.404 1.00 0.00 N ATOM 153 CA GLU A 10 -1.200 10.729 33.989 1.00 0.00 C ATOM 154 C GLU A 10 -1.222 10.665 35.501 1.00 0.00 C ATOM 155 O GLU A 10 -1.824 9.781 36.079 1.00 0.00 O ATOM 156 CB GLU A 10 -2.472 11.437 33.506 1.00 0.00 C ATOM 157 CG GLU A 10 -2.697 11.109 32.029 1.00 0.00 C ATOM 158 CD GLU A 10 -3.626 12.159 31.416 1.00 0.00 C ATOM 159 OE1 GLU A 10 -3.091 13.047 30.774 1.00 0.00 O ATOM 160 OE2 GLU A 10 -4.819 12.012 31.625 1.00 0.00 O ATOM 0 H GLU A 10 -2.076 8.944 33.227 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.308 11.271 33.675 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.329 11.115 34.097 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.377 12.514 33.642 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.745 11.094 31.498 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.134 10.116 31.927 1.00 0.00 H new ATOM 167 N GLY A 11 -0.565 11.607 36.123 1.00 0.00 N ATOM 168 CA GLY A 11 -0.540 11.612 37.604 1.00 0.00 C ATOM 169 C GLY A 11 -0.532 13.041 38.112 1.00 0.00 C ATOM 170 O GLY A 11 -0.990 13.942 37.434 1.00 0.00 O ATOM 0 H GLY A 11 -0.051 12.363 35.671 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.410 11.083 37.993 1.00 0.00 H new ATOM 0 HA3 GLY A 11 0.343 11.083 37.964 1.00 0.00 H new ATOM 174 N THR A 12 -0.018 13.227 39.294 1.00 0.00 N ATOM 175 CA THR A 12 0.022 14.592 39.850 1.00 0.00 C ATOM 176 C THR A 12 1.265 14.805 40.683 1.00 0.00 C ATOM 177 O THR A 12 1.587 14.011 41.543 1.00 0.00 O ATOM 178 CB THR A 12 -1.208 14.795 40.737 1.00 0.00 C ATOM 179 OG1 THR A 12 -2.316 14.446 39.930 1.00 0.00 O ATOM 180 CG2 THR A 12 -1.410 16.285 41.052 1.00 0.00 C ATOM 0 H THR A 12 0.371 12.496 39.889 1.00 0.00 H new ATOM 0 HA THR A 12 0.031 15.305 39.026 1.00 0.00 H new ATOM 0 HB THR A 12 -1.100 14.220 41.657 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.086 14.243 40.501 1.00 0.00 H new ATOM 0 HG21 THR A 12 -2.290 16.407 41.684 1.00 0.00 H new ATOM 0 HG22 THR A 12 -0.533 16.669 41.573 1.00 0.00 H new ATOM 0 HG23 THR A 12 -1.551 16.837 40.123 1.00 0.00 H new ATOM 188 N VAL A 13 1.944 15.883 40.416 1.00 0.00 N ATOM 189 CA VAL A 13 3.181 16.164 41.190 1.00 0.00 C ATOM 190 C VAL A 13 2.859 16.277 42.664 1.00 0.00 C ATOM 191 O VAL A 13 2.048 17.094 43.062 1.00 0.00 O ATOM 192 CB VAL A 13 3.769 17.491 40.712 1.00 0.00 C ATOM 193 CG1 VAL A 13 5.181 17.648 41.276 1.00 0.00 C ATOM 194 CG2 VAL A 13 3.833 17.481 39.194 1.00 0.00 C ATOM 0 H VAL A 13 1.700 16.573 39.705 1.00 0.00 H new ATOM 0 HA VAL A 13 3.892 15.352 41.039 1.00 0.00 H new ATOM 0 HB VAL A 13 3.146 18.319 41.052 1.00 0.00 H new ATOM 0 HG11 VAL A 13 5.605 18.593 40.938 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.141 17.637 42.365 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.805 16.825 40.928 1.00 0.00 H new ATOM 0 HG21 VAL A 13 4.251 18.424 38.841 1.00 0.00 H new ATOM 0 HG22 VAL A 13 4.464 16.657 38.862 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.829 17.355 38.788 1.00 0.00 H new ATOM 204 N SER A 14 3.510 15.464 43.456 1.00 0.00 N ATOM 205 CA SER A 14 3.252 15.502 44.916 1.00 0.00 C ATOM 206 C SER A 14 4.322 16.282 45.686 1.00 0.00 C ATOM 207 O SER A 14 4.031 16.869 46.710 1.00 0.00 O ATOM 208 CB SER A 14 3.243 14.058 45.431 1.00 0.00 C ATOM 209 OG SER A 14 2.495 13.347 44.456 1.00 0.00 O ATOM 0 H SER A 14 4.204 14.781 43.152 1.00 0.00 H new ATOM 0 HA SER A 14 2.299 16.006 45.076 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.254 13.662 45.524 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.781 13.989 46.416 1.00 0.00 H new ATOM 0 HG SER A 14 1.553 13.611 44.510 1.00 0.00 H new ATOM 215 N GLU A 15 5.536 16.282 45.197 1.00 0.00 N ATOM 216 CA GLU A 15 6.600 17.032 45.928 1.00 0.00 C ATOM 217 C GLU A 15 7.674 17.555 44.984 1.00 0.00 C ATOM 218 O GLU A 15 7.885 17.013 43.921 1.00 0.00 O ATOM 219 CB GLU A 15 7.257 16.070 46.933 1.00 0.00 C ATOM 220 CG GLU A 15 7.530 16.816 48.242 1.00 0.00 C ATOM 221 CD GLU A 15 8.324 15.910 49.186 1.00 0.00 C ATOM 222 OE1 GLU A 15 8.304 16.211 50.368 1.00 0.00 O ATOM 223 OE2 GLU A 15 8.904 14.967 48.672 1.00 0.00 O ATOM 0 H GLU A 15 5.832 15.807 44.344 1.00 0.00 H new ATOM 0 HA GLU A 15 6.142 17.887 46.426 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.605 15.216 47.117 1.00 0.00 H new ATOM 0 HB3 GLU A 15 8.188 15.678 46.523 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.088 17.731 48.043 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.590 17.111 48.708 1.00 0.00 H new ATOM 230 N ALA A 16 8.338 18.609 45.407 1.00 0.00 N ATOM 231 CA ALA A 16 9.411 19.203 44.564 1.00 0.00 C ATOM 232 C ALA A 16 10.781 18.910 45.160 1.00 0.00 C ATOM 233 O ALA A 16 11.042 19.243 46.300 1.00 0.00 O ATOM 234 CB ALA A 16 9.204 20.726 44.517 1.00 0.00 C ATOM 0 H ALA A 16 8.178 19.077 46.299 1.00 0.00 H new ATOM 0 HA ALA A 16 9.363 18.773 43.564 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.982 21.180 43.903 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.227 20.947 44.087 1.00 0.00 H new ATOM 0 HB3 ALA A 16 9.256 21.132 45.527 1.00 0.00 H new ATOM 240 N LEU A 17 11.633 18.291 44.369 1.00 0.00 N ATOM 241 CA LEU A 17 13.001 17.959 44.861 1.00 0.00 C ATOM 242 C LEU A 17 14.081 18.594 43.970 1.00 0.00 C ATOM 243 O LEU A 17 13.869 18.813 42.796 1.00 0.00 O ATOM 244 CB LEU A 17 13.162 16.434 44.811 1.00 0.00 C ATOM 245 CG LEU A 17 11.883 15.781 45.325 1.00 0.00 C ATOM 246 CD1 LEU A 17 11.949 14.284 45.058 1.00 0.00 C ATOM 247 CD2 LEU A 17 11.761 16.019 46.825 1.00 0.00 C ATOM 0 H LEU A 17 11.435 18.005 43.410 1.00 0.00 H new ATOM 0 HA LEU A 17 13.119 18.344 45.874 1.00 0.00 H new ATOM 0 HB2 LEU A 17 13.366 16.110 43.790 1.00 0.00 H new ATOM 0 HB3 LEU A 17 14.013 16.125 45.419 1.00 0.00 H new ATOM 0 HG LEU A 17 11.020 16.211 44.817 1.00 0.00 H new ATOM 0 HD11 LEU A 17 11.038 13.809 45.422 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.046 14.109 43.986 1.00 0.00 H new ATOM 0 HD13 LEU A 17 12.811 13.860 45.574 1.00 0.00 H new ATOM 0 HD21 LEU A 17 10.847 15.553 47.194 1.00 0.00 H new ATOM 0 HD22 LEU A 17 12.621 15.584 47.334 1.00 0.00 H new ATOM 0 HD23 LEU A 17 11.727 17.091 47.022 1.00 0.00 H new ATOM 259 N PRO A 18 15.229 18.892 44.554 1.00 0.00 N ATOM 260 CA PRO A 18 16.328 19.495 43.803 1.00 0.00 C ATOM 261 C PRO A 18 16.812 18.578 42.686 1.00 0.00 C ATOM 262 O PRO A 18 16.280 17.506 42.479 1.00 0.00 O ATOM 263 CB PRO A 18 17.460 19.685 44.839 1.00 0.00 C ATOM 264 CG PRO A 18 16.955 19.098 46.194 1.00 0.00 C ATOM 265 CD PRO A 18 15.496 18.665 45.987 1.00 0.00 C ATOM 0 HA PRO A 18 16.017 20.427 43.331 1.00 0.00 H new ATOM 0 HB2 PRO A 18 18.367 19.175 44.514 1.00 0.00 H new ATOM 0 HB3 PRO A 18 17.709 20.741 44.947 1.00 0.00 H new ATOM 0 HG2 PRO A 18 17.568 18.250 46.498 1.00 0.00 H new ATOM 0 HG3 PRO A 18 17.026 19.843 46.986 1.00 0.00 H new ATOM 0 HD2 PRO A 18 15.354 17.618 46.254 1.00 0.00 H new ATOM 0 HD3 PRO A 18 14.819 19.248 46.612 1.00 0.00 H new ATOM 273 N ASN A 19 17.809 19.032 41.982 1.00 0.00 N ATOM 274 CA ASN A 19 18.362 18.225 40.872 1.00 0.00 C ATOM 275 C ASN A 19 17.391 18.123 39.694 1.00 0.00 C ATOM 276 O ASN A 19 17.560 17.294 38.823 1.00 0.00 O ATOM 277 CB ASN A 19 18.662 16.813 41.399 1.00 0.00 C ATOM 278 CG ASN A 19 20.119 16.465 41.094 1.00 0.00 C ATOM 279 OD1 ASN A 19 20.556 16.515 39.962 1.00 0.00 O ATOM 280 ND2 ASN A 19 20.903 16.111 42.074 1.00 0.00 N ATOM 0 H ASN A 19 18.264 19.932 42.132 1.00 0.00 H new ATOM 0 HA ASN A 19 19.267 18.715 40.512 1.00 0.00 H new ATOM 0 HB2 ASN A 19 18.481 16.766 42.473 1.00 0.00 H new ATOM 0 HB3 ASN A 19 17.996 16.088 40.931 1.00 0.00 H new ATOM 0 HD21 ASN A 19 21.878 15.878 41.888 1.00 0.00 H new ATOM 0 HD22 ASN A 19 20.541 16.067 43.027 1.00 0.00 H new ATOM 287 N ALA A 20 16.396 18.966 39.686 1.00 0.00 N ATOM 288 CA ALA A 20 15.413 18.925 38.566 1.00 0.00 C ATOM 289 C ALA A 20 14.562 17.648 38.592 1.00 0.00 C ATOM 290 O ALA A 20 14.327 17.036 37.565 1.00 0.00 O ATOM 291 CB ALA A 20 16.200 18.965 37.243 1.00 0.00 C ATOM 0 H ALA A 20 16.221 19.675 40.398 1.00 0.00 H new ATOM 0 HA ALA A 20 14.739 19.776 38.665 1.00 0.00 H new ATOM 0 HB1 ALA A 20 15.504 18.936 36.405 1.00 0.00 H new ATOM 0 HB2 ALA A 20 16.787 19.883 37.196 1.00 0.00 H new ATOM 0 HB3 ALA A 20 16.867 18.105 37.190 1.00 0.00 H new ATOM 297 N MET A 21 14.104 17.279 39.759 1.00 0.00 N ATOM 298 CA MET A 21 13.279 16.065 39.869 1.00 0.00 C ATOM 299 C MET A 21 12.216 16.262 40.931 1.00 0.00 C ATOM 300 O MET A 21 12.393 17.032 41.847 1.00 0.00 O ATOM 301 CB MET A 21 14.183 14.887 40.279 1.00 0.00 C ATOM 302 CG MET A 21 15.546 15.032 39.600 1.00 0.00 C ATOM 303 SD MET A 21 16.721 13.669 39.793 1.00 0.00 S ATOM 304 CE MET A 21 16.311 13.260 41.507 1.00 0.00 C ATOM 0 H MET A 21 14.272 17.773 40.635 1.00 0.00 H new ATOM 0 HA MET A 21 12.800 15.861 38.911 1.00 0.00 H new ATOM 0 HB2 MET A 21 14.304 14.867 41.362 1.00 0.00 H new ATOM 0 HB3 MET A 21 13.720 13.942 39.993 1.00 0.00 H new ATOM 0 HG2 MET A 21 15.377 15.183 38.534 1.00 0.00 H new ATOM 0 HG3 MET A 21 16.017 15.939 39.979 1.00 0.00 H new ATOM 0 HE1 MET A 21 17.100 12.639 41.931 1.00 0.00 H new ATOM 0 HE2 MET A 21 16.220 14.178 42.088 1.00 0.00 H new ATOM 0 HE3 MET A 21 15.366 12.717 41.536 1.00 0.00 H new ATOM 314 N PHE A 22 11.129 15.581 40.782 1.00 0.00 N ATOM 315 CA PHE A 22 10.043 15.720 41.780 1.00 0.00 C ATOM 316 C PHE A 22 9.307 14.402 42.007 1.00 0.00 C ATOM 317 O PHE A 22 9.461 13.455 41.261 1.00 0.00 O ATOM 318 CB PHE A 22 9.028 16.771 41.288 1.00 0.00 C ATOM 319 CG PHE A 22 9.007 16.866 39.756 1.00 0.00 C ATOM 320 CD1 PHE A 22 9.214 15.753 38.954 1.00 0.00 C ATOM 321 CD2 PHE A 22 8.715 18.077 39.154 1.00 0.00 C ATOM 322 CE1 PHE A 22 9.122 15.859 37.581 1.00 0.00 C ATOM 323 CE2 PHE A 22 8.625 18.175 37.786 1.00 0.00 C ATOM 324 CZ PHE A 22 8.827 17.072 37.002 1.00 0.00 C ATOM 0 H PHE A 22 10.941 14.934 40.016 1.00 0.00 H new ATOM 0 HA PHE A 22 10.498 16.027 42.722 1.00 0.00 H new ATOM 0 HB2 PHE A 22 8.033 16.513 41.650 1.00 0.00 H new ATOM 0 HB3 PHE A 22 9.279 17.744 41.710 1.00 0.00 H new ATOM 0 HD1 PHE A 22 9.448 14.800 39.406 1.00 0.00 H new ATOM 0 HD2 PHE A 22 8.556 18.953 39.765 1.00 0.00 H new ATOM 0 HE1 PHE A 22 9.282 14.989 36.961 1.00 0.00 H new ATOM 0 HE2 PHE A 22 8.394 19.126 37.328 1.00 0.00 H new ATOM 0 HZ PHE A 22 8.755 17.153 35.927 1.00 0.00 H new ATOM 334 N LYS A 23 8.539 14.363 43.063 1.00 0.00 N ATOM 335 CA LYS A 23 7.777 13.133 43.375 1.00 0.00 C ATOM 336 C LYS A 23 6.372 13.256 42.817 1.00 0.00 C ATOM 337 O LYS A 23 5.667 14.196 43.131 1.00 0.00 O ATOM 338 CB LYS A 23 7.701 12.981 44.905 1.00 0.00 C ATOM 339 CG LYS A 23 7.565 11.496 45.269 1.00 0.00 C ATOM 340 CD LYS A 23 8.042 11.288 46.709 1.00 0.00 C ATOM 341 CE LYS A 23 6.991 11.846 47.672 1.00 0.00 C ATOM 342 NZ LYS A 23 7.499 11.820 49.073 1.00 0.00 N ATOM 0 H LYS A 23 8.410 15.133 43.719 1.00 0.00 H new ATOM 0 HA LYS A 23 8.268 12.266 42.933 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.596 13.399 45.367 1.00 0.00 H new ATOM 0 HB3 LYS A 23 6.850 13.541 45.294 1.00 0.00 H new ATOM 0 HG2 LYS A 23 6.528 11.177 45.167 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.155 10.886 44.585 1.00 0.00 H new ATOM 0 HD2 LYS A 23 8.203 10.227 46.902 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.998 11.789 46.864 1.00 0.00 H new ATOM 0 HE2 LYS A 23 6.737 12.868 47.390 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.075 11.259 47.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.773 12.202 49.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 7.719 10.840 49.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 8.360 12.399 49.141 1.00 0.00 H new ATOM 356 N VAL A 24 5.985 12.304 42.001 1.00 0.00 N ATOM 357 CA VAL A 24 4.624 12.351 41.407 1.00 0.00 C ATOM 358 C VAL A 24 3.813 11.152 41.823 1.00 0.00 C ATOM 359 O VAL A 24 4.324 10.053 41.904 1.00 0.00 O ATOM 360 CB VAL A 24 4.771 12.343 39.884 1.00 0.00 C ATOM 361 CG1 VAL A 24 3.386 12.370 39.241 1.00 0.00 C ATOM 362 CG2 VAL A 24 5.546 13.588 39.455 1.00 0.00 C ATOM 0 H VAL A 24 6.554 11.503 41.726 1.00 0.00 H new ATOM 0 HA VAL A 24 4.113 13.250 41.752 1.00 0.00 H new ATOM 0 HB VAL A 24 5.302 11.445 39.569 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.488 12.364 38.156 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.821 11.493 39.557 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.858 13.272 39.551 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.656 13.592 38.371 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.003 14.480 39.768 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.532 13.581 39.920 1.00 0.00 H new ATOM 372 N LYS A 25 2.555 11.390 42.076 1.00 0.00 N ATOM 373 CA LYS A 25 1.656 10.274 42.497 1.00 0.00 C ATOM 374 C LYS A 25 0.533 10.087 41.505 1.00 0.00 C ATOM 375 O LYS A 25 -0.320 10.938 41.354 1.00 0.00 O ATOM 376 CB LYS A 25 1.061 10.607 43.872 1.00 0.00 C ATOM 377 CG LYS A 25 -0.098 9.652 44.167 1.00 0.00 C ATOM 378 CD LYS A 25 -0.361 9.648 45.675 1.00 0.00 C ATOM 379 CE LYS A 25 -1.529 8.708 45.983 1.00 0.00 C ATOM 380 NZ LYS A 25 -1.025 7.359 46.369 1.00 0.00 N ATOM 0 H LYS A 25 2.110 12.306 42.010 1.00 0.00 H new ATOM 0 HA LYS A 25 2.237 9.353 42.544 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.826 10.518 44.643 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.710 11.639 43.889 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -0.992 9.966 43.629 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.144 8.646 43.823 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.532 9.325 46.210 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.591 10.657 46.018 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -2.133 9.122 46.790 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -2.177 8.625 45.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.820 6.690 46.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.333 7.032 45.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.570 7.413 47.302 1.00 0.00 H new ATOM 394 N LEU A 26 0.551 8.970 40.843 1.00 0.00 N ATOM 395 CA LEU A 26 -0.498 8.699 39.857 1.00 0.00 C ATOM 396 C LEU A 26 -1.834 8.519 40.529 1.00 0.00 C ATOM 397 O LEU A 26 -1.928 7.887 41.558 1.00 0.00 O ATOM 398 CB LEU A 26 -0.143 7.409 39.126 1.00 0.00 C ATOM 399 CG LEU A 26 1.306 7.494 38.690 1.00 0.00 C ATOM 400 CD1 LEU A 26 1.658 6.262 37.867 1.00 0.00 C ATOM 401 CD2 LEU A 26 1.495 8.738 37.837 1.00 0.00 C ATOM 0 H LEU A 26 1.253 8.237 40.949 1.00 0.00 H new ATOM 0 HA LEU A 26 -0.565 9.540 39.167 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.294 6.549 39.778 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.792 7.271 38.262 1.00 0.00 H new ATOM 0 HG LEU A 26 1.953 7.544 39.566 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.700 6.320 37.552 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.511 5.367 38.471 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.015 6.216 36.988 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.535 8.807 37.519 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.851 8.679 36.960 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.235 9.622 38.420 1.00 0.00 H new ATOM 413 N GLU A 27 -2.850 9.087 39.952 1.00 0.00 N ATOM 414 CA GLU A 27 -4.180 8.941 40.567 1.00 0.00 C ATOM 415 C GLU A 27 -4.430 7.476 40.872 1.00 0.00 C ATOM 416 O GLU A 27 -5.356 7.130 41.577 1.00 0.00 O ATOM 417 CB GLU A 27 -5.249 9.442 39.579 1.00 0.00 C ATOM 418 CG GLU A 27 -5.070 8.734 38.233 1.00 0.00 C ATOM 419 CD GLU A 27 -6.267 7.812 37.984 1.00 0.00 C ATOM 420 OE1 GLU A 27 -6.662 7.167 38.941 1.00 0.00 O ATOM 421 OE2 GLU A 27 -6.718 7.805 36.850 1.00 0.00 O ATOM 0 H GLU A 27 -2.814 9.637 39.094 1.00 0.00 H new ATOM 0 HA GLU A 27 -4.227 9.522 41.488 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.246 9.247 39.975 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.163 10.521 39.449 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -4.988 9.468 37.431 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.145 8.157 38.233 1.00 0.00 H new ATOM 428 N ASN A 28 -3.585 6.635 40.326 1.00 0.00 N ATOM 429 CA ASN A 28 -3.742 5.186 40.565 1.00 0.00 C ATOM 430 C ASN A 28 -3.340 4.836 41.994 1.00 0.00 C ATOM 431 O ASN A 28 -3.676 3.779 42.493 1.00 0.00 O ATOM 432 CB ASN A 28 -2.825 4.434 39.589 1.00 0.00 C ATOM 433 CG ASN A 28 -3.340 4.630 38.162 1.00 0.00 C ATOM 434 OD1 ASN A 28 -2.922 5.656 37.473 1.00 0.00 O flip ATOM 435 ND2 ASN A 28 -4.127 3.850 37.661 1.00 0.00 N flip ATOM 0 H ASN A 28 -2.800 6.898 39.730 1.00 0.00 H new ATOM 0 HA ASN A 28 -4.784 4.904 40.414 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.803 4.804 39.673 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.802 3.373 39.837 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.458 3.046 38.194 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -4.456 4.000 36.707 1.00 0.00 H new ATOM 442 N GLY A 29 -2.620 5.738 42.624 1.00 0.00 N ATOM 443 CA GLY A 29 -2.179 5.489 44.032 1.00 0.00 C ATOM 444 C GLY A 29 -0.674 5.185 44.118 1.00 0.00 C ATOM 445 O GLY A 29 -0.164 4.955 45.197 1.00 0.00 O ATOM 0 H GLY A 29 -2.322 6.628 42.226 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.408 6.362 44.644 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -2.742 4.653 44.446 1.00 0.00 H new ATOM 449 N HIS A 30 0.009 5.190 42.992 1.00 0.00 N ATOM 450 CA HIS A 30 1.480 4.897 43.033 1.00 0.00 C ATOM 451 C HIS A 30 2.327 6.157 42.943 1.00 0.00 C ATOM 452 O HIS A 30 2.063 7.035 42.144 1.00 0.00 O ATOM 453 CB HIS A 30 1.816 3.995 41.849 1.00 0.00 C ATOM 454 CG HIS A 30 0.788 2.882 41.793 1.00 0.00 C ATOM 455 ND1 HIS A 30 -0.211 2.877 41.055 1.00 0.00 N ATOM 456 CD2 HIS A 30 0.711 1.720 42.530 1.00 0.00 C ATOM 457 CE1 HIS A 30 -0.917 1.849 41.237 1.00 0.00 C ATOM 458 NE2 HIS A 30 -0.409 1.039 42.166 1.00 0.00 N ATOM 0 H HIS A 30 -0.379 5.380 42.068 1.00 0.00 H new ATOM 0 HA HIS A 30 1.705 4.419 43.986 1.00 0.00 H new ATOM 0 HB2 HIS A 30 1.807 4.567 40.921 1.00 0.00 H new ATOM 0 HB3 HIS A 30 2.818 3.581 41.959 1.00 0.00 H new ATOM 0 HD2 HIS A 30 1.424 1.402 43.276 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -1.832 1.647 40.700 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.765 0.148 42.511 1.00 0.00 H new ATOM 466 N GLU A 31 3.344 6.208 43.777 1.00 0.00 N ATOM 467 CA GLU A 31 4.246 7.378 43.788 1.00 0.00 C ATOM 468 C GLU A 31 5.602 7.003 43.218 1.00 0.00 C ATOM 469 O GLU A 31 6.176 6.001 43.598 1.00 0.00 O ATOM 470 CB GLU A 31 4.426 7.838 45.242 1.00 0.00 C ATOM 471 CG GLU A 31 5.154 6.744 46.025 1.00 0.00 C ATOM 472 CD GLU A 31 4.891 6.931 47.521 1.00 0.00 C ATOM 473 OE1 GLU A 31 5.719 7.579 48.139 1.00 0.00 O ATOM 474 OE2 GLU A 31 3.877 6.414 47.961 1.00 0.00 O ATOM 0 H GLU A 31 3.578 5.478 44.450 1.00 0.00 H new ATOM 0 HA GLU A 31 3.815 8.174 43.181 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.996 8.767 45.275 1.00 0.00 H new ATOM 0 HB3 GLU A 31 3.456 8.043 45.695 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.810 5.761 45.704 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.224 6.788 45.824 1.00 0.00 H new ATOM 481 N ILE A 32 6.100 7.817 42.316 1.00 0.00 N ATOM 482 CA ILE A 32 7.420 7.516 41.711 1.00 0.00 C ATOM 483 C ILE A 32 8.227 8.781 41.510 1.00 0.00 C ATOM 484 O ILE A 32 7.702 9.874 41.580 1.00 0.00 O ATOM 485 CB ILE A 32 7.195 6.876 40.360 1.00 0.00 C ATOM 486 CG1 ILE A 32 6.292 5.656 40.499 1.00 0.00 C ATOM 487 CG2 ILE A 32 8.553 6.422 39.800 1.00 0.00 C ATOM 488 CD1 ILE A 32 4.828 6.106 40.479 1.00 0.00 C ATOM 0 H ILE A 32 5.648 8.667 41.980 1.00 0.00 H new ATOM 0 HA ILE A 32 7.967 6.851 42.379 1.00 0.00 H new ATOM 0 HB ILE A 32 6.723 7.598 39.694 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.480 4.955 39.686 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.511 5.131 41.429 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.407 5.958 38.825 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.211 7.285 39.697 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.005 5.701 40.481 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.179 5.236 40.578 1.00 0.00 H new ATOM 0 HD12 ILE A 32 4.646 6.791 41.307 1.00 0.00 H new ATOM 0 HD13 ILE A 32 4.616 6.612 39.537 1.00 0.00 H new ATOM 500 N LEU A 33 9.496 8.615 41.263 1.00 0.00 N ATOM 501 CA LEU A 33 10.348 9.792 41.054 1.00 0.00 C ATOM 502 C LEU A 33 10.346 10.158 39.583 1.00 0.00 C ATOM 503 O LEU A 33 10.485 9.294 38.738 1.00 0.00 O ATOM 504 CB LEU A 33 11.778 9.442 41.492 1.00 0.00 C ATOM 505 CG LEU A 33 11.862 9.488 43.023 1.00 0.00 C ATOM 506 CD1 LEU A 33 10.732 8.641 43.617 1.00 0.00 C ATOM 507 CD2 LEU A 33 13.208 8.917 43.472 1.00 0.00 C ATOM 0 H LEU A 33 9.969 7.713 41.199 1.00 0.00 H new ATOM 0 HA LEU A 33 9.974 10.635 41.635 1.00 0.00 H new ATOM 0 HB2 LEU A 33 12.049 8.450 41.131 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.487 10.145 41.056 1.00 0.00 H new ATOM 0 HG LEU A 33 11.767 10.519 43.364 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.788 8.671 44.705 1.00 0.00 H new ATOM 0 HD12 LEU A 33 9.770 9.038 43.292 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.832 7.610 43.277 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.272 8.948 44.560 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.297 7.885 43.132 1.00 0.00 H new ATOM 0 HD23 LEU A 33 14.016 9.511 43.044 1.00 0.00 H new ATOM 519 N CYS A 34 10.188 11.430 39.296 1.00 0.00 N ATOM 520 CA CYS A 34 10.173 11.859 37.873 1.00 0.00 C ATOM 521 C CYS A 34 11.137 12.994 37.606 1.00 0.00 C ATOM 522 O CYS A 34 11.390 13.822 38.459 1.00 0.00 O ATOM 523 CB CYS A 34 8.765 12.343 37.534 1.00 0.00 C ATOM 524 SG CYS A 34 7.411 11.154 37.703 1.00 0.00 S ATOM 0 H CYS A 34 10.071 12.176 39.981 1.00 0.00 H new ATOM 0 HA CYS A 34 10.473 11.008 37.262 1.00 0.00 H new ATOM 0 HB2 CYS A 34 8.542 13.200 38.169 1.00 0.00 H new ATOM 0 HB3 CYS A 34 8.771 12.702 36.505 1.00 0.00 H new ATOM 0 HG CYS A 34 7.347 10.741 38.934 1.00 0.00 H new ATOM 530 N HIS A 35 11.662 12.998 36.406 1.00 0.00 N ATOM 531 CA HIS A 35 12.622 14.060 36.011 1.00 0.00 C ATOM 532 C HIS A 35 12.010 14.903 34.901 1.00 0.00 C ATOM 533 O HIS A 35 11.156 14.437 34.174 1.00 0.00 O ATOM 534 CB HIS A 35 13.906 13.385 35.487 1.00 0.00 C ATOM 535 CG HIS A 35 14.963 14.453 35.193 1.00 0.00 C ATOM 536 ND1 HIS A 35 14.894 15.292 34.272 1.00 0.00 N ATOM 537 CD2 HIS A 35 16.158 14.712 35.838 1.00 0.00 C ATOM 538 CE1 HIS A 35 15.906 16.055 34.260 1.00 0.00 C ATOM 539 NE2 HIS A 35 16.775 15.760 35.228 1.00 0.00 N ATOM 0 H HIS A 35 11.463 12.306 35.684 1.00 0.00 H new ATOM 0 HA HIS A 35 12.852 14.697 36.865 1.00 0.00 H new ATOM 0 HB2 HIS A 35 14.284 12.678 36.225 1.00 0.00 H new ATOM 0 HB3 HIS A 35 13.687 12.816 34.583 1.00 0.00 H new ATOM 0 HD1 HIS A 35 14.120 15.356 33.611 1.00 0.00 H new ATOM 0 HD2 HIS A 35 16.541 14.169 36.690 1.00 0.00 H new ATOM 0 HE1 HIS A 35 16.049 16.853 33.547 1.00 0.00 H new ATOM 547 N ILE A 36 12.450 16.123 34.783 1.00 0.00 N ATOM 548 CA ILE A 36 11.890 16.990 33.721 1.00 0.00 C ATOM 549 C ILE A 36 12.680 16.893 32.430 1.00 0.00 C ATOM 550 O ILE A 36 13.855 16.587 32.434 1.00 0.00 O ATOM 551 CB ILE A 36 11.926 18.427 34.216 1.00 0.00 C ATOM 552 CG1 ILE A 36 10.820 18.619 35.229 1.00 0.00 C ATOM 553 CG2 ILE A 36 11.679 19.370 33.028 1.00 0.00 C ATOM 554 CD1 ILE A 36 11.035 19.941 35.974 1.00 0.00 C ATOM 0 H ILE A 36 13.166 16.551 35.371 1.00 0.00 H new ATOM 0 HA ILE A 36 10.872 16.664 33.510 1.00 0.00 H new ATOM 0 HB ILE A 36 12.894 18.643 34.669 1.00 0.00 H new ATOM 0 HG12 ILE A 36 9.851 18.624 34.729 1.00 0.00 H new ATOM 0 HG13 ILE A 36 10.810 17.789 35.935 1.00 0.00 H new ATOM 0 HG21 ILE A 36 11.703 20.404 33.373 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.455 19.220 32.277 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.704 19.156 32.590 1.00 0.00 H new ATOM 0 HD11 ILE A 36 10.238 20.081 36.705 1.00 0.00 H new ATOM 0 HD12 ILE A 36 11.997 19.918 36.486 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.023 20.766 35.262 1.00 0.00 H new ATOM 566 N SER A 37 12.009 17.153 31.338 1.00 0.00 N ATOM 567 CA SER A 37 12.691 17.087 30.033 1.00 0.00 C ATOM 568 C SER A 37 13.435 18.386 29.771 1.00 0.00 C ATOM 569 O SER A 37 12.865 19.456 29.837 1.00 0.00 O ATOM 570 CB SER A 37 11.633 16.879 28.937 1.00 0.00 C ATOM 571 OG SER A 37 11.344 15.488 28.994 1.00 0.00 O ATOM 0 H SER A 37 11.022 17.406 31.304 1.00 0.00 H new ATOM 0 HA SER A 37 13.404 16.263 30.033 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.742 17.479 29.124 1.00 0.00 H new ATOM 0 HB3 SER A 37 12.012 17.168 27.957 1.00 0.00 H new ATOM 0 HG SER A 37 11.084 15.171 28.104 1.00 0.00 H new ATOM 577 N GLY A 38 14.694 18.273 29.479 1.00 0.00 N ATOM 578 CA GLY A 38 15.496 19.498 29.211 1.00 0.00 C ATOM 579 C GLY A 38 14.817 20.391 28.167 1.00 0.00 C ATOM 580 O GLY A 38 15.196 21.536 27.988 1.00 0.00 O ATOM 0 H GLY A 38 15.204 17.392 29.414 1.00 0.00 H new ATOM 0 HA2 GLY A 38 15.632 20.056 30.137 1.00 0.00 H new ATOM 0 HA3 GLY A 38 16.489 19.216 28.861 1.00 0.00 H new ATOM 584 N LYS A 39 13.822 19.869 27.505 1.00 0.00 N ATOM 585 CA LYS A 39 13.137 20.692 26.484 1.00 0.00 C ATOM 586 C LYS A 39 12.135 21.635 27.120 1.00 0.00 C ATOM 587 O LYS A 39 12.277 22.842 27.034 1.00 0.00 O ATOM 588 CB LYS A 39 12.397 19.757 25.509 1.00 0.00 C ATOM 589 CG LYS A 39 13.254 18.509 25.237 1.00 0.00 C ATOM 590 CD LYS A 39 14.434 18.888 24.338 1.00 0.00 C ATOM 591 CE LYS A 39 13.942 19.037 22.895 1.00 0.00 C ATOM 592 NZ LYS A 39 14.614 18.043 22.012 1.00 0.00 N ATOM 0 H LYS A 39 13.462 18.923 27.627 1.00 0.00 H new ATOM 0 HA LYS A 39 13.884 21.288 25.959 1.00 0.00 H new ATOM 0 HB2 LYS A 39 11.435 19.465 25.930 1.00 0.00 H new ATOM 0 HB3 LYS A 39 12.191 20.279 24.575 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.617 18.092 26.176 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.651 17.738 24.758 1.00 0.00 H new ATOM 0 HD2 LYS A 39 14.882 19.821 24.680 1.00 0.00 H new ATOM 0 HD3 LYS A 39 15.209 18.123 24.393 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.862 18.896 22.856 1.00 0.00 H new ATOM 0 HE3 LYS A 39 14.145 20.046 22.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 14.270 18.156 21.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 15.642 18.196 22.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 14.399 17.082 22.345 1.00 0.00 H new ATOM 606 N LEU A 40 11.144 21.089 27.750 1.00 0.00 N ATOM 607 CA LEU A 40 10.153 21.966 28.380 1.00 0.00 C ATOM 608 C LEU A 40 10.862 22.841 29.384 1.00 0.00 C ATOM 609 O LEU A 40 10.357 23.864 29.801 1.00 0.00 O ATOM 610 CB LEU A 40 9.057 21.094 29.050 1.00 0.00 C ATOM 611 CG LEU A 40 9.392 20.817 30.514 1.00 0.00 C ATOM 612 CD1 LEU A 40 8.637 21.818 31.393 1.00 0.00 C ATOM 613 CD2 LEU A 40 8.927 19.402 30.865 1.00 0.00 C ATOM 0 H LEU A 40 10.984 20.087 27.852 1.00 0.00 H new ATOM 0 HA LEU A 40 9.667 22.606 27.644 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.094 21.601 28.984 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.959 20.151 28.512 1.00 0.00 H new ATOM 0 HG LEU A 40 10.465 20.912 30.678 1.00 0.00 H new ATOM 0 HD11 LEU A 40 8.869 21.629 32.441 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.939 22.832 31.131 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.565 21.706 31.233 1.00 0.00 H new ATOM 0 HD21 LEU A 40 9.160 19.191 31.909 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.851 19.324 30.711 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.438 18.682 30.226 1.00 0.00 H new ATOM 625 N ARG A 41 12.041 22.408 29.760 1.00 0.00 N ATOM 626 CA ARG A 41 12.820 23.186 30.732 1.00 0.00 C ATOM 627 C ARG A 41 13.327 24.442 30.060 1.00 0.00 C ATOM 628 O ARG A 41 13.333 25.509 30.643 1.00 0.00 O ATOM 629 CB ARG A 41 14.019 22.342 31.197 1.00 0.00 C ATOM 630 CG ARG A 41 14.079 22.364 32.726 1.00 0.00 C ATOM 631 CD ARG A 41 15.508 22.066 33.180 1.00 0.00 C ATOM 632 NE ARG A 41 16.419 23.114 32.637 1.00 0.00 N ATOM 633 CZ ARG A 41 16.885 24.034 33.437 1.00 0.00 C ATOM 634 NH1 ARG A 41 16.137 24.451 34.422 1.00 0.00 N ATOM 635 NH2 ARG A 41 18.082 24.509 33.225 1.00 0.00 N ATOM 0 H ARG A 41 12.484 21.551 29.429 1.00 0.00 H new ATOM 0 HA ARG A 41 12.198 23.450 31.588 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.920 21.317 30.839 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.944 22.738 30.778 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.762 23.338 33.100 1.00 0.00 H new ATOM 0 HG3 ARG A 41 13.392 21.625 33.139 1.00 0.00 H new ATOM 0 HD2 ARG A 41 15.561 22.048 34.269 1.00 0.00 H new ATOM 0 HD3 ARG A 41 15.816 21.081 32.830 1.00 0.00 H new ATOM 0 HE ARG A 41 16.676 23.112 31.650 1.00 0.00 H new ATOM 0 HH11 ARG A 41 15.205 24.058 34.556 1.00 0.00 H new ATOM 0 HH12 ARG A 41 16.484 25.169 35.057 1.00 0.00 H new ATOM 0 HH21 ARG A 41 18.638 24.161 32.444 1.00 0.00 H new ATOM 0 HH22 ARG A 41 18.462 25.228 33.840 1.00 0.00 H new ATOM 649 N MET A 42 13.753 24.294 28.831 1.00 0.00 N ATOM 650 CA MET A 42 14.261 25.464 28.101 1.00 0.00 C ATOM 651 C MET A 42 13.159 26.501 27.954 1.00 0.00 C ATOM 652 O MET A 42 13.410 27.688 28.003 1.00 0.00 O ATOM 653 CB MET A 42 14.711 25.017 26.701 1.00 0.00 C ATOM 654 CG MET A 42 16.173 24.572 26.764 1.00 0.00 C ATOM 655 SD MET A 42 17.360 25.726 27.492 1.00 0.00 S ATOM 656 CE MET A 42 18.777 24.604 27.524 1.00 0.00 C ATOM 0 H MET A 42 13.766 23.414 28.315 1.00 0.00 H new ATOM 0 HA MET A 42 15.096 25.899 28.650 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.084 24.199 26.348 1.00 0.00 H new ATOM 0 HB3 MET A 42 14.597 25.835 25.990 1.00 0.00 H new ATOM 0 HG2 MET A 42 16.218 23.641 27.329 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.501 24.346 25.749 1.00 0.00 H new ATOM 0 HE1 MET A 42 19.640 25.120 27.945 1.00 0.00 H new ATOM 0 HE2 MET A 42 18.539 23.735 28.137 1.00 0.00 H new ATOM 0 HE3 MET A 42 19.008 24.280 26.509 1.00 0.00 H new ATOM 666 N ASN A 43 11.945 26.032 27.773 1.00 0.00 N ATOM 667 CA ASN A 43 10.821 26.987 27.624 1.00 0.00 C ATOM 668 C ASN A 43 10.716 27.877 28.861 1.00 0.00 C ATOM 669 O ASN A 43 9.862 28.737 28.942 1.00 0.00 O ATOM 670 CB ASN A 43 9.517 26.184 27.469 1.00 0.00 C ATOM 671 CG ASN A 43 9.429 25.637 26.040 1.00 0.00 C ATOM 672 OD1 ASN A 43 9.740 24.491 25.784 1.00 0.00 O ATOM 673 ND2 ASN A 43 9.013 26.423 25.085 1.00 0.00 N ATOM 0 H ASN A 43 11.695 25.044 27.724 1.00 0.00 H new ATOM 0 HA ASN A 43 10.991 27.616 26.750 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.493 25.364 28.187 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.657 26.819 27.682 1.00 0.00 H new ATOM 0 HD21 ASN A 43 8.950 26.074 24.129 1.00 0.00 H new ATOM 0 HD22 ASN A 43 8.751 27.386 25.295 1.00 0.00 H new ATOM 680 N PHE A 44 11.596 27.647 29.801 1.00 0.00 N ATOM 681 CA PHE A 44 11.580 28.459 31.044 1.00 0.00 C ATOM 682 C PHE A 44 10.214 28.413 31.718 1.00 0.00 C ATOM 683 O PHE A 44 9.696 29.429 32.141 1.00 0.00 O ATOM 684 CB PHE A 44 11.904 29.914 30.680 1.00 0.00 C ATOM 685 CG PHE A 44 12.591 30.587 31.870 1.00 0.00 C ATOM 686 CD1 PHE A 44 13.901 30.275 32.193 1.00 0.00 C ATOM 687 CD2 PHE A 44 11.911 31.511 32.644 1.00 0.00 C ATOM 688 CE1 PHE A 44 14.518 30.879 33.270 1.00 0.00 C ATOM 689 CE2 PHE A 44 12.531 32.112 33.720 1.00 0.00 C ATOM 690 CZ PHE A 44 13.833 31.795 34.032 1.00 0.00 C ATOM 0 H PHE A 44 12.322 26.932 29.758 1.00 0.00 H new ATOM 0 HA PHE A 44 12.318 28.053 31.736 1.00 0.00 H new ATOM 0 HB2 PHE A 44 12.552 29.947 29.804 1.00 0.00 H new ATOM 0 HB3 PHE A 44 10.990 30.449 30.421 1.00 0.00 H new ATOM 0 HD1 PHE A 44 14.443 29.555 31.599 1.00 0.00 H new ATOM 0 HD2 PHE A 44 10.889 31.763 32.404 1.00 0.00 H new ATOM 0 HE1 PHE A 44 15.540 30.631 33.514 1.00 0.00 H new ATOM 0 HE2 PHE A 44 11.993 32.833 34.318 1.00 0.00 H new ATOM 0 HZ PHE A 44 14.316 32.266 34.875 1.00 0.00 H new ATOM 700 N ILE A 45 9.656 27.233 31.809 1.00 0.00 N ATOM 701 CA ILE A 45 8.330 27.097 32.448 1.00 0.00 C ATOM 702 C ILE A 45 8.463 26.641 33.895 1.00 0.00 C ATOM 703 O ILE A 45 9.459 26.056 34.276 1.00 0.00 O ATOM 704 CB ILE A 45 7.531 26.044 31.690 1.00 0.00 C ATOM 705 CG1 ILE A 45 7.555 26.347 30.197 1.00 0.00 C ATOM 706 CG2 ILE A 45 6.075 26.091 32.184 1.00 0.00 C ATOM 707 CD1 ILE A 45 6.529 27.437 29.883 1.00 0.00 C ATOM 0 H ILE A 45 10.067 26.364 31.467 1.00 0.00 H new ATOM 0 HA ILE A 45 7.833 28.067 32.426 1.00 0.00 H new ATOM 0 HB ILE A 45 7.966 25.059 31.863 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.551 26.672 29.897 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.329 25.445 29.628 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.486 25.343 31.652 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.047 25.882 33.253 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.659 27.081 31.997 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.545 27.655 28.815 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.535 27.094 30.168 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.775 28.340 30.441 1.00 0.00 H new ATOM 719 N ARG A 46 7.457 26.915 34.678 1.00 0.00 N ATOM 720 CA ARG A 46 7.510 26.504 36.096 1.00 0.00 C ATOM 721 C ARG A 46 6.113 26.222 36.630 1.00 0.00 C ATOM 722 O ARG A 46 5.387 27.128 36.993 1.00 0.00 O ATOM 723 CB ARG A 46 8.141 27.640 36.914 1.00 0.00 C ATOM 724 CG ARG A 46 9.517 27.191 37.402 1.00 0.00 C ATOM 725 CD ARG A 46 10.301 28.412 37.876 1.00 0.00 C ATOM 726 NE ARG A 46 9.647 28.961 39.094 1.00 0.00 N ATOM 727 CZ ARG A 46 10.388 29.365 40.085 1.00 0.00 C ATOM 728 NH1 ARG A 46 10.810 30.598 40.094 1.00 0.00 N ATOM 729 NH2 ARG A 46 10.684 28.521 41.036 1.00 0.00 N ATOM 0 H ARG A 46 6.608 27.403 34.394 1.00 0.00 H new ATOM 0 HA ARG A 46 8.104 25.594 36.179 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.232 28.539 36.304 1.00 0.00 H new ATOM 0 HB3 ARG A 46 7.504 27.893 37.762 1.00 0.00 H new ATOM 0 HG2 ARG A 46 9.412 26.473 38.215 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.055 26.687 36.599 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.333 28.136 38.094 1.00 0.00 H new ATOM 0 HD3 ARG A 46 10.332 29.168 37.091 1.00 0.00 H new ATOM 0 HE ARG A 46 8.630 29.020 39.152 1.00 0.00 H new ATOM 0 HH11 ARG A 46 10.559 31.229 39.333 1.00 0.00 H new ATOM 0 HH12 ARG A 46 11.392 30.932 40.862 1.00 0.00 H new ATOM 0 HH21 ARG A 46 10.336 27.563 40.994 1.00 0.00 H new ATOM 0 HH22 ARG A 46 11.263 28.819 41.821 1.00 0.00 H new ATOM 743 N ILE A 47 5.761 24.966 36.672 1.00 0.00 N ATOM 744 CA ILE A 47 4.418 24.601 37.180 1.00 0.00 C ATOM 745 C ILE A 47 4.447 24.427 38.698 1.00 0.00 C ATOM 746 O ILE A 47 5.451 24.035 39.259 1.00 0.00 O ATOM 747 CB ILE A 47 3.999 23.275 36.524 1.00 0.00 C ATOM 748 CG1 ILE A 47 2.476 23.145 36.536 1.00 0.00 C ATOM 749 CG2 ILE A 47 4.599 22.114 37.341 1.00 0.00 C ATOM 750 CD1 ILE A 47 2.027 22.286 35.348 1.00 0.00 C ATOM 0 H ILE A 47 6.345 24.184 36.377 1.00 0.00 H new ATOM 0 HA ILE A 47 3.710 25.393 36.937 1.00 0.00 H new ATOM 0 HB ILE A 47 4.356 23.249 35.494 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.146 22.692 37.471 1.00 0.00 H new ATOM 0 HG13 ILE A 47 2.016 24.131 36.480 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.311 21.165 36.889 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.686 22.198 37.349 1.00 0.00 H new ATOM 0 HG23 ILE A 47 4.225 22.157 38.364 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.941 22.193 35.356 1.00 0.00 H new ATOM 0 HD12 ILE A 47 2.344 22.757 34.418 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.477 21.296 35.424 1.00 0.00 H new ATOM 762 N LEU A 48 3.345 24.722 39.334 1.00 0.00 N ATOM 763 CA LEU A 48 3.295 24.578 40.814 1.00 0.00 C ATOM 764 C LEU A 48 2.982 23.139 41.220 1.00 0.00 C ATOM 765 O LEU A 48 2.102 22.514 40.665 1.00 0.00 O ATOM 766 CB LEU A 48 2.175 25.488 41.349 1.00 0.00 C ATOM 767 CG LEU A 48 2.449 26.933 40.928 1.00 0.00 C ATOM 768 CD1 LEU A 48 2.205 27.075 39.426 1.00 0.00 C ATOM 769 CD2 LEU A 48 1.495 27.864 41.683 1.00 0.00 C ATOM 0 H LEU A 48 2.486 25.053 38.896 1.00 0.00 H new ATOM 0 HA LEU A 48 4.266 24.852 41.226 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.210 25.162 40.961 1.00 0.00 H new ATOM 0 HB3 LEU A 48 2.122 25.418 42.435 1.00 0.00 H new ATOM 0 HG LEU A 48 3.482 27.195 41.159 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.399 28.103 39.121 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.872 26.404 38.884 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.170 26.819 39.200 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.684 28.896 41.388 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.465 27.601 41.443 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.656 27.758 42.756 1.00 0.00 H new ATOM 781 N GLU A 49 3.708 22.644 42.189 1.00 0.00 N ATOM 782 CA GLU A 49 3.471 21.262 42.644 1.00 0.00 C ATOM 783 C GLU A 49 1.985 20.989 42.795 1.00 0.00 C ATOM 784 O GLU A 49 1.205 21.891 43.031 1.00 0.00 O ATOM 785 CB GLU A 49 4.151 21.073 44.008 1.00 0.00 C ATOM 786 CG GLU A 49 5.535 21.724 43.973 1.00 0.00 C ATOM 787 CD GLU A 49 6.150 21.535 42.584 1.00 0.00 C ATOM 788 OE1 GLU A 49 6.319 22.547 41.925 1.00 0.00 O ATOM 789 OE2 GLU A 49 6.415 20.388 42.261 1.00 0.00 O ATOM 0 H GLU A 49 4.451 23.144 42.678 1.00 0.00 H new ATOM 0 HA GLU A 49 3.879 20.572 41.906 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.545 21.521 44.795 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.241 20.012 44.239 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.456 22.786 44.206 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.178 21.278 44.732 1.00 0.00 H new ATOM 796 N GLY A 50 1.613 19.749 42.657 1.00 0.00 N ATOM 797 CA GLY A 50 0.176 19.404 42.790 1.00 0.00 C ATOM 798 C GLY A 50 -0.487 19.438 41.420 1.00 0.00 C ATOM 799 O GLY A 50 -1.579 18.936 41.241 1.00 0.00 O ATOM 0 H GLY A 50 2.237 18.967 42.460 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.069 18.414 43.232 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.317 20.108 43.461 1.00 0.00 H new ATOM 803 N ASP A 51 0.188 20.038 40.475 1.00 0.00 N ATOM 804 CA ASP A 51 -0.380 20.115 39.117 1.00 0.00 C ATOM 805 C ASP A 51 -0.320 18.753 38.450 1.00 0.00 C ATOM 806 O ASP A 51 0.527 17.943 38.771 1.00 0.00 O ATOM 807 CB ASP A 51 0.447 21.112 38.294 1.00 0.00 C ATOM 808 CG ASP A 51 -0.342 21.517 37.046 1.00 0.00 C ATOM 809 OD1 ASP A 51 -0.292 20.750 36.099 1.00 0.00 O ATOM 810 OD2 ASP A 51 -0.949 22.574 37.110 1.00 0.00 O ATOM 0 H ASP A 51 1.103 20.473 40.593 1.00 0.00 H new ATOM 0 HA ASP A 51 -1.419 20.438 39.176 1.00 0.00 H new ATOM 0 HB2 ASP A 51 0.678 21.992 38.894 1.00 0.00 H new ATOM 0 HB3 ASP A 51 1.398 20.663 38.007 1.00 0.00 H new ATOM 815 N LYS A 52 -1.215 18.517 37.541 1.00 0.00 N ATOM 816 CA LYS A 52 -1.215 17.226 36.862 1.00 0.00 C ATOM 817 C LYS A 52 -0.251 17.202 35.715 1.00 0.00 C ATOM 818 O LYS A 52 -0.039 18.191 35.042 1.00 0.00 O ATOM 819 CB LYS A 52 -2.633 16.938 36.352 1.00 0.00 C ATOM 820 CG LYS A 52 -3.456 16.309 37.481 1.00 0.00 C ATOM 821 CD LYS A 52 -3.916 17.407 38.441 1.00 0.00 C ATOM 822 CE LYS A 52 -4.883 16.808 39.464 1.00 0.00 C ATOM 823 NZ LYS A 52 -6.218 16.576 38.846 1.00 0.00 N ATOM 0 H LYS A 52 -1.942 19.170 37.247 1.00 0.00 H new ATOM 0 HA LYS A 52 -0.900 16.461 37.572 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.105 17.860 36.012 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.595 16.265 35.495 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -4.318 15.785 37.070 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.858 15.570 38.015 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.057 17.846 38.948 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -4.404 18.209 37.888 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -4.483 15.868 39.844 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -4.982 17.480 40.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -6.920 16.398 39.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -6.498 17.416 38.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -6.169 15.752 38.213 1.00 0.00 H new ATOM 837 N VAL A 53 0.310 16.054 35.507 1.00 0.00 N ATOM 838 CA VAL A 53 1.277 15.907 34.416 1.00 0.00 C ATOM 839 C VAL A 53 1.275 14.491 33.860 1.00 0.00 C ATOM 840 O VAL A 53 0.753 13.581 34.477 1.00 0.00 O ATOM 841 CB VAL A 53 2.641 16.158 35.034 1.00 0.00 C ATOM 842 CG1 VAL A 53 2.661 17.539 35.668 1.00 0.00 C ATOM 843 CG2 VAL A 53 2.886 15.112 36.126 1.00 0.00 C ATOM 0 H VAL A 53 0.135 15.210 36.053 1.00 0.00 H new ATOM 0 HA VAL A 53 1.032 16.593 33.605 1.00 0.00 H new ATOM 0 HB VAL A 53 3.412 16.094 34.266 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.639 17.721 36.112 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.463 18.292 34.906 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.895 17.595 36.442 1.00 0.00 H new ATOM 0 HG21 VAL A 53 3.863 15.281 36.579 1.00 0.00 H new ATOM 0 HG22 VAL A 53 2.113 15.195 36.890 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.857 14.115 35.688 1.00 0.00 H new ATOM 853 N ASN A 54 1.858 14.326 32.700 1.00 0.00 N ATOM 854 CA ASN A 54 1.898 12.977 32.102 1.00 0.00 C ATOM 855 C ASN A 54 3.183 12.307 32.540 1.00 0.00 C ATOM 856 O ASN A 54 4.260 12.810 32.282 1.00 0.00 O ATOM 857 CB ASN A 54 1.866 13.099 30.569 1.00 0.00 C ATOM 858 CG ASN A 54 0.509 12.613 30.052 1.00 0.00 C ATOM 859 OD1 ASN A 54 -0.526 12.920 30.609 1.00 0.00 O ATOM 860 ND2 ASN A 54 0.471 11.855 28.988 1.00 0.00 N ATOM 0 H ASN A 54 2.301 15.064 32.153 1.00 0.00 H new ATOM 0 HA ASN A 54 1.040 12.387 32.426 1.00 0.00 H new ATOM 0 HB2 ASN A 54 2.032 14.134 30.271 1.00 0.00 H new ATOM 0 HB3 ASN A 54 2.669 12.508 30.129 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -0.425 11.524 28.629 1.00 0.00 H new ATOM 0 HD22 ASN A 54 1.337 11.594 28.516 1.00 0.00 H new ATOM 867 N VAL A 55 3.053 11.179 33.192 1.00 0.00 N ATOM 868 CA VAL A 55 4.256 10.464 33.662 1.00 0.00 C ATOM 869 C VAL A 55 4.570 9.241 32.822 1.00 0.00 C ATOM 870 O VAL A 55 3.751 8.356 32.671 1.00 0.00 O ATOM 871 CB VAL A 55 3.993 9.998 35.099 1.00 0.00 C ATOM 872 CG1 VAL A 55 5.332 9.754 35.798 1.00 0.00 C ATOM 873 CG2 VAL A 55 3.216 11.080 35.852 1.00 0.00 C ATOM 0 H VAL A 55 2.164 10.731 33.414 1.00 0.00 H new ATOM 0 HA VAL A 55 5.104 11.145 33.591 1.00 0.00 H new ATOM 0 HB VAL A 55 3.410 9.077 35.086 1.00 0.00 H new ATOM 0 HG11 VAL A 55 5.153 9.422 36.821 1.00 0.00 H new ATOM 0 HG12 VAL A 55 5.889 8.987 35.260 1.00 0.00 H new ATOM 0 HG13 VAL A 55 5.909 10.679 35.812 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.029 10.749 36.874 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.799 12.001 35.870 1.00 0.00 H new ATOM 0 HG23 VAL A 55 2.266 11.262 35.350 1.00 0.00 H new ATOM 883 N GLU A 56 5.767 9.217 32.300 1.00 0.00 N ATOM 884 CA GLU A 56 6.187 8.071 31.465 1.00 0.00 C ATOM 885 C GLU A 56 7.084 7.156 32.282 1.00 0.00 C ATOM 886 O GLU A 56 8.175 7.536 32.659 1.00 0.00 O ATOM 887 CB GLU A 56 6.985 8.608 30.265 1.00 0.00 C ATOM 888 CG GLU A 56 7.658 7.440 29.537 1.00 0.00 C ATOM 889 CD GLU A 56 8.175 7.920 28.179 1.00 0.00 C ATOM 890 OE1 GLU A 56 8.346 7.061 27.331 1.00 0.00 O ATOM 891 OE2 GLU A 56 8.368 9.121 28.066 1.00 0.00 O ATOM 0 H GLU A 56 6.469 9.947 32.420 1.00 0.00 H new ATOM 0 HA GLU A 56 5.312 7.518 31.124 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.323 9.142 29.584 1.00 0.00 H new ATOM 0 HB3 GLU A 56 7.737 9.321 30.604 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.481 7.050 30.135 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.948 6.624 29.401 1.00 0.00 H new ATOM 898 N LEU A 57 6.610 5.974 32.555 1.00 0.00 N ATOM 899 CA LEU A 57 7.438 5.034 33.352 1.00 0.00 C ATOM 900 C LEU A 57 8.360 4.230 32.449 1.00 0.00 C ATOM 901 O LEU A 57 7.928 3.693 31.438 1.00 0.00 O ATOM 902 CB LEU A 57 6.507 4.068 34.096 1.00 0.00 C ATOM 903 CG LEU A 57 5.534 4.873 34.957 1.00 0.00 C ATOM 904 CD1 LEU A 57 4.185 4.151 35.000 1.00 0.00 C ATOM 905 CD2 LEU A 57 6.093 4.984 36.378 1.00 0.00 C ATOM 0 H LEU A 57 5.697 5.623 32.265 1.00 0.00 H new ATOM 0 HA LEU A 57 8.045 5.605 34.054 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.958 3.452 33.384 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.090 3.391 34.720 1.00 0.00 H new ATOM 0 HG LEU A 57 5.404 5.869 34.534 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.487 4.721 35.613 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.789 4.059 33.989 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.317 3.158 35.429 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.403 5.557 36.997 1.00 0.00 H new ATOM 0 HD22 LEU A 57 6.215 3.986 36.800 1.00 0.00 H new ATOM 0 HD23 LEU A 57 7.059 5.487 36.351 1.00 0.00 H new ATOM 917 N SER A 58 9.615 4.153 32.831 1.00 0.00 N ATOM 918 CA SER A 58 10.582 3.385 32.002 1.00 0.00 C ATOM 919 C SER A 58 10.568 1.882 32.366 1.00 0.00 C ATOM 920 O SER A 58 10.818 1.523 33.499 1.00 0.00 O ATOM 921 CB SER A 58 11.991 3.935 32.283 1.00 0.00 C ATOM 922 OG SER A 58 12.757 3.505 31.168 1.00 0.00 O ATOM 0 H SER A 58 10.001 4.585 33.671 1.00 0.00 H new ATOM 0 HA SER A 58 10.306 3.490 30.953 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.985 5.022 32.368 1.00 0.00 H new ATOM 0 HB3 SER A 58 12.393 3.544 33.218 1.00 0.00 H new ATOM 0 HG SER A 58 13.681 3.818 31.265 1.00 0.00 H new ATOM 928 N PRO A 59 10.276 1.018 31.387 1.00 0.00 N ATOM 929 CA PRO A 59 10.241 -0.422 31.637 1.00 0.00 C ATOM 930 C PRO A 59 11.606 -0.931 32.077 1.00 0.00 C ATOM 931 O PRO A 59 11.746 -2.061 32.504 1.00 0.00 O ATOM 932 CB PRO A 59 9.869 -1.056 30.282 1.00 0.00 C ATOM 933 CG PRO A 59 9.678 0.105 29.260 1.00 0.00 C ATOM 934 CD PRO A 59 9.970 1.418 30.005 1.00 0.00 C ATOM 0 HA PRO A 59 9.534 -0.671 32.428 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.653 -1.736 29.948 1.00 0.00 H new ATOM 0 HB3 PRO A 59 8.955 -1.643 30.371 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.352 -0.014 28.412 1.00 0.00 H new ATOM 0 HG3 PRO A 59 8.663 0.105 28.863 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.809 1.949 29.554 1.00 0.00 H new ATOM 0 HD3 PRO A 59 9.112 2.090 29.970 1.00 0.00 H new ATOM 942 N TYR A 60 12.588 -0.080 31.968 1.00 0.00 N ATOM 943 CA TYR A 60 13.933 -0.465 32.362 1.00 0.00 C ATOM 944 C TYR A 60 14.159 -0.034 33.784 1.00 0.00 C ATOM 945 O TYR A 60 15.067 -0.490 34.451 1.00 0.00 O ATOM 946 CB TYR A 60 14.931 0.261 31.448 1.00 0.00 C ATOM 947 CG TYR A 60 16.142 -0.638 31.199 1.00 0.00 C ATOM 948 CD1 TYR A 60 16.229 -1.393 30.048 1.00 0.00 C ATOM 949 CD2 TYR A 60 17.168 -0.700 32.118 1.00 0.00 C ATOM 950 CE1 TYR A 60 17.326 -2.199 29.820 1.00 0.00 C ATOM 951 CE2 TYR A 60 18.264 -1.505 31.891 1.00 0.00 C ATOM 952 CZ TYR A 60 18.352 -2.261 30.740 1.00 0.00 C ATOM 953 OH TYR A 60 19.447 -3.069 30.515 1.00 0.00 O ATOM 0 H TYR A 60 12.495 0.873 31.616 1.00 0.00 H new ATOM 0 HA TYR A 60 14.065 -1.544 32.278 1.00 0.00 H new ATOM 0 HB2 TYR A 60 14.454 0.517 30.502 1.00 0.00 H new ATOM 0 HB3 TYR A 60 15.248 1.197 31.909 1.00 0.00 H new ATOM 0 HD1 TYR A 60 15.433 -1.353 29.320 1.00 0.00 H new ATOM 0 HD2 TYR A 60 17.113 -0.113 33.023 1.00 0.00 H new ATOM 0 HE1 TYR A 60 17.382 -2.785 28.915 1.00 0.00 H new ATOM 0 HE2 TYR A 60 19.060 -1.544 32.620 1.00 0.00 H new ATOM 0 HH TYR A 60 20.072 -2.989 31.265 1.00 0.00 H new ATOM 963 N ASP A 61 13.309 0.852 34.220 1.00 0.00 N ATOM 964 CA ASP A 61 13.412 1.358 35.588 1.00 0.00 C ATOM 965 C ASP A 61 12.022 1.575 36.167 1.00 0.00 C ATOM 966 O ASP A 61 11.509 2.676 36.163 1.00 0.00 O ATOM 967 CB ASP A 61 14.161 2.697 35.554 1.00 0.00 C ATOM 968 CG ASP A 61 15.403 2.553 34.671 1.00 0.00 C ATOM 969 OD1 ASP A 61 16.186 1.669 34.979 1.00 0.00 O ATOM 970 OD2 ASP A 61 15.497 3.335 33.740 1.00 0.00 O ATOM 0 H ASP A 61 12.544 1.243 33.670 1.00 0.00 H new ATOM 0 HA ASP A 61 13.946 0.638 36.209 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.512 3.481 35.165 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.449 2.993 36.563 1.00 0.00 H new ATOM 975 N LEU A 62 11.434 0.516 36.654 1.00 0.00 N ATOM 976 CA LEU A 62 10.077 0.638 37.235 1.00 0.00 C ATOM 977 C LEU A 62 10.122 1.381 38.550 1.00 0.00 C ATOM 978 O LEU A 62 9.254 1.229 39.387 1.00 0.00 O ATOM 979 CB LEU A 62 9.516 -0.770 37.463 1.00 0.00 C ATOM 980 CG LEU A 62 9.491 -1.513 36.125 1.00 0.00 C ATOM 981 CD1 LEU A 62 9.286 -3.004 36.379 1.00 0.00 C ATOM 982 CD2 LEU A 62 8.335 -0.982 35.274 1.00 0.00 C ATOM 0 H LEU A 62 11.836 -0.421 36.673 1.00 0.00 H new ATOM 0 HA LEU A 62 9.441 1.196 36.548 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.131 -1.310 38.183 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.511 -0.713 37.882 1.00 0.00 H new ATOM 0 HG LEU A 62 10.434 -1.357 35.602 1.00 0.00 H new ATOM 0 HD11 LEU A 62 9.268 -3.536 35.428 1.00 0.00 H new ATOM 0 HD12 LEU A 62 10.103 -3.384 36.992 1.00 0.00 H new ATOM 0 HD13 LEU A 62 8.340 -3.158 36.899 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.314 -1.509 34.320 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.393 -1.143 35.799 1.00 0.00 H new ATOM 0 HD23 LEU A 62 8.474 0.084 35.097 1.00 0.00 H new ATOM 994 N THR A 63 11.142 2.172 38.697 1.00 0.00 N ATOM 995 CA THR A 63 11.305 2.963 39.945 1.00 0.00 C ATOM 996 C THR A 63 11.393 4.449 39.625 1.00 0.00 C ATOM 997 O THR A 63 11.391 5.278 40.514 1.00 0.00 O ATOM 998 CB THR A 63 12.602 2.529 40.626 1.00 0.00 C ATOM 999 OG1 THR A 63 12.380 1.194 41.033 1.00 0.00 O ATOM 1000 CG2 THR A 63 12.818 3.302 41.935 1.00 0.00 C ATOM 0 H THR A 63 11.876 2.306 38.002 1.00 0.00 H new ATOM 0 HA THR A 63 10.447 2.791 40.595 1.00 0.00 H new ATOM 0 HB THR A 63 13.444 2.682 39.950 1.00 0.00 H new ATOM 0 HG1 THR A 63 13.182 0.851 41.480 1.00 0.00 H new ATOM 0 HG21 THR A 63 13.748 2.975 42.401 1.00 0.00 H new ATOM 0 HG22 THR A 63 12.874 4.370 41.722 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.986 3.110 42.612 1.00 0.00 H new ATOM 1008 N ARG A 64 11.464 4.756 38.349 1.00 0.00 N ATOM 1009 CA ARG A 64 11.553 6.182 37.937 1.00 0.00 C ATOM 1010 C ARG A 64 10.706 6.459 36.691 1.00 0.00 C ATOM 1011 O ARG A 64 10.483 5.582 35.865 1.00 0.00 O ATOM 1012 CB ARG A 64 13.018 6.493 37.588 1.00 0.00 C ATOM 1013 CG ARG A 64 13.792 6.826 38.865 1.00 0.00 C ATOM 1014 CD ARG A 64 15.116 6.060 38.857 1.00 0.00 C ATOM 1015 NE ARG A 64 15.769 6.244 37.529 1.00 0.00 N ATOM 1016 CZ ARG A 64 16.784 5.492 37.205 1.00 0.00 C ATOM 1017 NH1 ARG A 64 16.645 4.627 36.238 1.00 0.00 N ATOM 1018 NH2 ARG A 64 17.904 5.629 37.860 1.00 0.00 N ATOM 0 H ARG A 64 11.464 4.080 37.585 1.00 0.00 H new ATOM 0 HA ARG A 64 11.188 6.801 38.757 1.00 0.00 H new ATOM 0 HB2 ARG A 64 13.472 5.638 37.088 1.00 0.00 H new ATOM 0 HB3 ARG A 64 13.066 7.331 36.893 1.00 0.00 H new ATOM 0 HG2 ARG A 64 13.978 7.898 38.924 1.00 0.00 H new ATOM 0 HG3 ARG A 64 13.205 6.555 39.743 1.00 0.00 H new ATOM 0 HD2 ARG A 64 15.767 6.424 39.652 1.00 0.00 H new ATOM 0 HD3 ARG A 64 14.941 5.001 39.048 1.00 0.00 H new ATOM 0 HE ARG A 64 15.425 6.952 36.880 1.00 0.00 H new ATOM 0 HH11 ARG A 64 15.753 4.547 35.749 1.00 0.00 H new ATOM 0 HH12 ARG A 64 17.428 4.030 35.971 1.00 0.00 H new ATOM 0 HH21 ARG A 64 17.975 6.315 38.611 1.00 0.00 H new ATOM 0 HH22 ARG A 64 18.709 5.050 37.621 1.00 0.00 H new ATOM 1032 N GLY A 65 10.258 7.678 36.582 1.00 0.00 N ATOM 1033 CA GLY A 65 9.421 8.071 35.409 1.00 0.00 C ATOM 1034 C GLY A 65 9.878 9.447 34.920 1.00 0.00 C ATOM 1035 O GLY A 65 10.922 9.920 35.316 1.00 0.00 O ATOM 0 H GLY A 65 10.435 8.423 37.256 1.00 0.00 H new ATOM 0 HA2 GLY A 65 9.519 7.335 34.611 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.368 8.100 35.689 1.00 0.00 H new ATOM 1039 N ARG A 66 9.109 10.067 34.068 1.00 0.00 N ATOM 1040 CA ARG A 66 9.546 11.408 33.589 1.00 0.00 C ATOM 1041 C ARG A 66 8.389 12.269 33.102 1.00 0.00 C ATOM 1042 O ARG A 66 7.562 11.835 32.326 1.00 0.00 O ATOM 1043 CB ARG A 66 10.514 11.232 32.400 1.00 0.00 C ATOM 1044 CG ARG A 66 11.805 10.555 32.861 1.00 0.00 C ATOM 1045 CD ARG A 66 12.831 10.615 31.722 1.00 0.00 C ATOM 1046 NE ARG A 66 13.569 9.319 31.660 1.00 0.00 N ATOM 1047 CZ ARG A 66 13.287 8.464 30.713 1.00 0.00 C ATOM 1048 NH1 ARG A 66 13.818 8.633 29.531 1.00 0.00 N ATOM 1049 NH2 ARG A 66 12.487 7.469 30.979 1.00 0.00 N ATOM 0 H ARG A 66 8.227 9.719 33.693 1.00 0.00 H new ATOM 0 HA ARG A 66 10.017 11.904 34.438 1.00 0.00 H new ATOM 0 HB2 ARG A 66 10.040 10.634 31.622 1.00 0.00 H new ATOM 0 HB3 ARG A 66 10.742 12.203 31.961 1.00 0.00 H new ATOM 0 HG2 ARG A 66 12.196 11.054 33.748 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.609 9.519 33.138 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.329 10.808 30.774 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.528 11.437 31.887 1.00 0.00 H new ATOM 0 HE ARG A 66 14.287 9.103 32.351 1.00 0.00 H new ATOM 0 HH11 ARG A 66 14.441 9.422 29.360 1.00 0.00 H new ATOM 0 HH12 ARG A 66 13.609 7.976 28.779 1.00 0.00 H new ATOM 0 HH21 ARG A 66 12.092 7.368 31.914 1.00 0.00 H new ATOM 0 HH22 ARG A 66 12.256 6.792 30.252 1.00 0.00 H new ATOM 1063 N ILE A 67 8.367 13.483 33.578 1.00 0.00 N ATOM 1064 CA ILE A 67 7.302 14.416 33.178 1.00 0.00 C ATOM 1065 C ILE A 67 7.790 15.224 31.998 1.00 0.00 C ATOM 1066 O ILE A 67 8.698 16.022 32.134 1.00 0.00 O ATOM 1067 CB ILE A 67 7.028 15.354 34.346 1.00 0.00 C ATOM 1068 CG1 ILE A 67 5.910 14.787 35.175 1.00 0.00 C ATOM 1069 CG2 ILE A 67 6.580 16.735 33.813 1.00 0.00 C ATOM 1070 CD1 ILE A 67 6.401 13.561 35.915 1.00 0.00 C ATOM 0 H ILE A 67 9.052 13.863 34.232 1.00 0.00 H new ATOM 0 HA ILE A 67 6.395 13.875 32.908 1.00 0.00 H new ATOM 0 HB ILE A 67 7.935 15.461 34.941 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.554 15.534 35.884 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.066 14.526 34.537 1.00 0.00 H new ATOM 0 HG21 ILE A 67 6.385 17.403 34.652 1.00 0.00 H new ATOM 0 HG22 ILE A 67 7.368 17.157 33.189 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.671 16.620 33.222 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.590 13.150 36.516 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.736 12.812 35.197 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.231 13.837 36.565 1.00 0.00 H new ATOM 1082 N THR A 68 7.197 14.998 30.865 1.00 0.00 N ATOM 1083 CA THR A 68 7.618 15.747 29.658 1.00 0.00 C ATOM 1084 C THR A 68 6.437 16.424 28.983 1.00 0.00 C ATOM 1085 O THR A 68 6.571 16.977 27.909 1.00 0.00 O ATOM 1086 CB THR A 68 8.233 14.742 28.677 1.00 0.00 C ATOM 1087 OG1 THR A 68 7.135 14.051 28.115 1.00 0.00 O ATOM 1088 CG2 THR A 68 9.028 13.658 29.430 1.00 0.00 C ATOM 0 H THR A 68 6.441 14.328 30.723 1.00 0.00 H new ATOM 0 HA THR A 68 8.330 16.519 29.949 1.00 0.00 H new ATOM 0 HB THR A 68 8.875 15.263 27.967 1.00 0.00 H new ATOM 0 HG1 THR A 68 6.441 13.931 28.796 1.00 0.00 H new ATOM 0 HG21 THR A 68 9.455 12.956 28.714 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.830 14.126 30.002 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.363 13.124 30.108 1.00 0.00 H new ATOM 1096 N TRP A 69 5.300 16.379 29.616 1.00 0.00 N ATOM 1097 CA TRP A 69 4.118 17.019 29.004 1.00 0.00 C ATOM 1098 C TRP A 69 3.039 17.318 30.041 1.00 0.00 C ATOM 1099 O TRP A 69 2.436 16.419 30.587 1.00 0.00 O ATOM 1100 CB TRP A 69 3.548 16.029 27.975 1.00 0.00 C ATOM 1101 CG TRP A 69 4.100 14.621 28.275 1.00 0.00 C ATOM 1102 CD1 TRP A 69 4.305 14.147 29.498 1.00 0.00 C ATOM 1103 CD2 TRP A 69 4.440 13.737 27.365 1.00 0.00 C ATOM 1104 NE1 TRP A 69 4.795 12.915 29.287 1.00 0.00 N ATOM 1105 CE2 TRP A 69 4.913 12.575 27.954 1.00 0.00 C ATOM 1106 CE3 TRP A 69 4.386 13.831 25.986 1.00 0.00 C ATOM 1107 CZ2 TRP A 69 5.327 11.519 27.170 1.00 0.00 C ATOM 1108 CZ3 TRP A 69 4.801 12.770 25.205 1.00 0.00 C ATOM 1109 CH2 TRP A 69 5.272 11.616 25.798 1.00 0.00 C ATOM 0 H TRP A 69 5.144 15.931 30.519 1.00 0.00 H new ATOM 0 HA TRP A 69 4.415 17.964 28.549 1.00 0.00 H new ATOM 0 HB2 TRP A 69 2.459 16.024 28.020 1.00 0.00 H new ATOM 0 HB3 TRP A 69 3.824 16.334 26.966 1.00 0.00 H new ATOM 0 HD1 TRP A 69 4.121 14.638 30.442 1.00 0.00 H new ATOM 0 HE1 TRP A 69 5.057 12.285 30.045 1.00 0.00 H new ATOM 0 HE3 TRP A 69 4.019 14.734 25.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 5.695 10.615 27.633 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.757 12.843 24.128 1.00 0.00 H new ATOM 0 HH2 TRP A 69 5.598 10.789 25.185 1.00 0.00 H new ATOM 1120 N ARG A 70 2.813 18.580 30.293 1.00 0.00 N ATOM 1121 CA ARG A 70 1.786 18.946 31.277 1.00 0.00 C ATOM 1122 C ARG A 70 0.387 18.732 30.700 1.00 0.00 C ATOM 1123 O ARG A 70 0.150 18.990 29.537 1.00 0.00 O ATOM 1124 CB ARG A 70 1.956 20.433 31.629 1.00 0.00 C ATOM 1125 CG ARG A 70 3.447 20.768 31.684 1.00 0.00 C ATOM 1126 CD ARG A 70 4.136 19.809 32.655 1.00 0.00 C ATOM 1127 NE ARG A 70 5.566 20.198 32.784 1.00 0.00 N ATOM 1128 CZ ARG A 70 5.931 20.975 33.765 1.00 0.00 C ATOM 1129 NH1 ARG A 70 6.202 20.441 34.924 1.00 0.00 N ATOM 1130 NH2 ARG A 70 6.008 22.261 33.556 1.00 0.00 N ATOM 0 H ARG A 70 3.300 19.362 29.855 1.00 0.00 H new ATOM 0 HA ARG A 70 1.900 18.321 32.163 1.00 0.00 H new ATOM 0 HB2 ARG A 70 1.458 21.055 30.885 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.487 20.648 32.589 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.889 20.681 30.692 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.590 21.799 32.008 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.647 19.843 33.629 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.055 18.784 32.293 1.00 0.00 H new ATOM 0 HE ARG A 70 6.254 19.860 32.111 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.127 19.432 35.051 1.00 0.00 H new ATOM 0 HH12 ARG A 70 6.489 21.033 35.704 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.784 22.643 32.637 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.292 22.884 34.312 1.00 0.00 H new ATOM 1144 N LYS A 71 -0.518 18.264 31.521 1.00 0.00 N ATOM 1145 CA LYS A 71 -1.896 18.032 31.027 1.00 0.00 C ATOM 1146 C LYS A 71 -2.743 19.295 31.151 1.00 0.00 C ATOM 1147 O LYS A 71 -2.383 20.221 31.849 1.00 0.00 O ATOM 1148 CB LYS A 71 -2.539 16.924 31.876 1.00 0.00 C ATOM 1149 CG LYS A 71 -3.873 16.512 31.239 1.00 0.00 C ATOM 1150 CD LYS A 71 -5.025 17.151 32.021 1.00 0.00 C ATOM 1151 CE LYS A 71 -5.240 16.372 33.320 1.00 0.00 C ATOM 1152 NZ LYS A 71 -6.577 16.679 33.900 1.00 0.00 N ATOM 0 H LYS A 71 -0.359 18.036 32.502 1.00 0.00 H new ATOM 0 HA LYS A 71 -1.848 17.746 29.976 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -1.872 16.064 31.940 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.702 17.277 32.894 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -3.905 16.830 30.197 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -3.972 15.427 31.245 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -4.797 18.194 32.241 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -5.936 17.143 31.422 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.158 15.302 33.127 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -4.459 16.627 34.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -6.705 16.141 34.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.642 17.697 34.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.319 16.413 33.221 1.00 0.00 H new ATOM 1166 N LYS A 72 -3.857 19.307 30.467 1.00 0.00 N ATOM 1167 CA LYS A 72 -4.741 20.497 30.531 1.00 0.00 C ATOM 1168 C LYS A 72 -6.079 20.208 29.857 1.00 0.00 C ATOM 1169 O LYS A 72 -7.079 20.469 30.506 1.00 0.00 O ATOM 1170 CB LYS A 72 -4.054 21.661 29.793 1.00 0.00 C ATOM 1171 CG LYS A 72 -5.086 22.758 29.502 1.00 0.00 C ATOM 1172 CD LYS A 72 -4.463 24.126 29.792 1.00 0.00 C ATOM 1173 CE LYS A 72 -3.324 24.383 28.804 1.00 0.00 C ATOM 1174 NZ LYS A 72 -2.014 24.373 29.511 1.00 0.00 N ATOM 0 H LYS A 72 -4.187 18.547 29.872 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.920 20.752 31.576 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -3.242 22.062 30.399 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.612 21.306 28.862 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.407 22.705 28.462 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -5.973 22.611 30.118 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -5.218 24.908 29.706 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -4.087 24.158 30.815 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -3.330 23.621 28.025 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.471 25.344 28.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.300 24.853 28.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.107 24.869 30.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.719 23.390 29.681 1.00 0.00 H new TER 1188 LYS A 72