USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 748 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 MET N :NH3+ -156:sc= 0.0282 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0.0316 K(o=0.06,f=-2.6!) USER MOD Set 2.1: B 13 ASN : amide:sc=-0.00072 K(o=-0.00072,f=1.1) USER MOD Set 2.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 11 SER OG : rot -112:sc= 0.716 USER MOD Set 3.2: B 21 THR OG1 : rot 180:sc= 0.686 USER MOD Set 4.1: A 11 SER OG : rot -89:sc= 0.0857 USER MOD Set 4.2: A 21 THR OG1 : rot 180:sc= 0.0863 USER MOD Set 5.1: A 13 ASN : amide:sc=-0.00399 K(o=-0.0085,f=1.3) USER MOD Set 5.2: A 19 THR OG1 : rot 180:sc=-0.00449 USER MOD Single : A 1 MET CE :methyl -176:sc= -0.341 (180deg=-0.375) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.206 X(o=-0.21,f=-0.17) USER MOD Single : A 29 GLN : amide:sc= -0.418 K(o=-0.42,f=-3.4!) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -1 K(o=-1,f=-0.22) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -177:sc= -0.188 (180deg=-0.227) USER MOD Single : B 1 MET N :NH3+ 130:sc= 0.0448 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 130:sc= 0.235 USER MOD Single : B 7 LYS NZ :NH3+ -165:sc= -0.0213 (180deg=-0.23) USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.535 X(o=-0.53,f=-0.68) USER MOD Single : B 29 GLN : amide:sc= -1.62! C(o=-1.6!,f=-2.9!) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -0.454 X(o=-0.45,f=-0.06) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.382 -2.258 -6.851 1.00 0.00 N ATOM 2 CA MET A 1 22.338 -1.407 -7.452 1.00 0.00 C ATOM 3 C MET A 1 22.964 -0.362 -8.363 1.00 0.00 C ATOM 4 O MET A 1 24.032 0.159 -8.053 1.00 0.00 O ATOM 5 CB MET A 1 21.505 -0.741 -6.352 1.00 0.00 C ATOM 6 CG MET A 1 20.322 0.037 -6.922 1.00 0.00 C ATOM 7 SD MET A 1 19.037 0.414 -5.697 1.00 0.00 S ATOM 8 CE MET A 1 19.999 1.371 -4.497 1.00 0.00 C ATOM 0 H1 MET A 1 22.970 -3.174 -6.581 1.00 0.00 H new ATOM 0 H2 MET A 1 24.145 -2.411 -7.541 1.00 0.00 H new ATOM 0 H3 MET A 1 23.768 -1.790 -6.006 1.00 0.00 H new ATOM 0 HA MET A 1 21.679 -2.031 -8.055 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.140 -1.502 -5.663 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.138 -0.067 -5.776 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.686 0.970 -7.352 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.879 -0.538 -7.735 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.370 1.620 -3.642 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.852 0.781 -4.161 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.355 2.289 -4.965 1.00 0.00 H new ATOM 20 N LEU A 2 22.303 -0.056 -9.484 1.00 0.00 N ATOM 21 CA LEU A 2 22.748 0.959 -10.424 1.00 0.00 C ATOM 22 C LEU A 2 21.797 2.151 -10.345 1.00 0.00 C ATOM 23 O LEU A 2 20.722 2.141 -10.945 1.00 0.00 O ATOM 24 CB LEU A 2 22.778 0.384 -11.849 1.00 0.00 C ATOM 25 CG LEU A 2 23.831 1.035 -12.758 1.00 0.00 C ATOM 26 CD1 LEU A 2 23.373 1.029 -14.205 1.00 0.00 C ATOM 27 CD2 LEU A 2 24.192 2.469 -12.404 1.00 0.00 C ATOM 0 H LEU A 2 21.435 -0.515 -9.761 1.00 0.00 H new ATOM 0 HA LEU A 2 23.757 1.283 -10.170 1.00 0.00 H new ATOM 0 HB2 LEU A 2 22.971 -0.687 -11.794 1.00 0.00 H new ATOM 0 HB3 LEU A 2 21.794 0.508 -12.302 1.00 0.00 H new ATOM 0 HG LEU A 2 24.721 0.424 -12.605 1.00 0.00 H new ATOM 0 HD11 LEU A 2 24.135 1.495 -14.830 1.00 0.00 H new ATOM 0 HD12 LEU A 2 23.214 0.001 -14.532 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.440 1.586 -14.294 1.00 0.00 H new ATOM 0 HD21 LEU A 2 24.942 2.839 -13.103 1.00 0.00 H new ATOM 0 HD22 LEU A 2 23.301 3.094 -12.464 1.00 0.00 H new ATOM 0 HD23 LEU A 2 24.592 2.504 -11.391 1.00 0.00 H new ATOM 39 N ILE A 3 22.191 3.183 -9.602 1.00 0.00 N ATOM 40 CA ILE A 3 21.370 4.365 -9.428 1.00 0.00 C ATOM 41 C ILE A 3 21.573 5.304 -10.615 1.00 0.00 C ATOM 42 O ILE A 3 22.660 5.368 -11.186 1.00 0.00 O ATOM 43 CB ILE A 3 21.746 5.049 -8.106 1.00 0.00 C ATOM 44 CG1 ILE A 3 21.478 4.126 -6.908 1.00 0.00 C ATOM 45 CG2 ILE A 3 20.914 6.318 -7.913 1.00 0.00 C ATOM 46 CD1 ILE A 3 22.656 3.213 -6.579 1.00 0.00 C ATOM 0 H ILE A 3 23.083 3.218 -9.109 1.00 0.00 H new ATOM 0 HA ILE A 3 20.316 4.091 -9.388 1.00 0.00 H new ATOM 0 HB ILE A 3 22.808 5.288 -8.156 1.00 0.00 H new ATOM 0 HG12 ILE A 3 21.242 4.734 -6.034 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.600 3.515 -7.117 1.00 0.00 H new ATOM 0 HG21 ILE A 3 21.190 6.794 -6.972 1.00 0.00 H new ATOM 0 HG22 ILE A 3 21.103 7.006 -8.737 1.00 0.00 H new ATOM 0 HG23 ILE A 3 19.855 6.059 -7.892 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.403 2.587 -5.724 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.878 2.581 -7.439 1.00 0.00 H new ATOM 0 HD13 ILE A 3 23.530 3.819 -6.339 1.00 0.00 H new ATOM 58 N LEU A 4 20.521 6.036 -10.985 1.00 0.00 N ATOM 59 CA LEU A 4 20.571 7.065 -12.015 1.00 0.00 C ATOM 60 C LEU A 4 19.678 8.223 -11.562 1.00 0.00 C ATOM 61 O LEU A 4 18.846 8.048 -10.671 1.00 0.00 O ATOM 62 CB LEU A 4 20.042 6.515 -13.350 1.00 0.00 C ATOM 63 CG LEU A 4 20.865 5.368 -13.952 1.00 0.00 C ATOM 64 CD1 LEU A 4 20.134 4.827 -15.178 1.00 0.00 C ATOM 65 CD2 LEU A 4 22.235 5.831 -14.441 1.00 0.00 C ATOM 0 H LEU A 4 19.597 5.926 -10.568 1.00 0.00 H new ATOM 0 HA LEU A 4 21.600 7.394 -12.159 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.019 6.169 -13.203 1.00 0.00 H new ATOM 0 HB3 LEU A 4 20.002 7.331 -14.072 1.00 0.00 H new ATOM 0 HG LEU A 4 20.991 4.621 -13.168 1.00 0.00 H new ATOM 0 HD11 LEU A 4 20.710 4.011 -15.614 1.00 0.00 H new ATOM 0 HD12 LEU A 4 19.151 4.460 -14.883 1.00 0.00 H new ATOM 0 HD13 LEU A 4 20.018 5.623 -15.913 1.00 0.00 H new ATOM 0 HD21 LEU A 4 22.778 4.983 -14.858 1.00 0.00 H new ATOM 0 HD22 LEU A 4 22.108 6.594 -15.209 1.00 0.00 H new ATOM 0 HD23 LEU A 4 22.798 6.247 -13.606 1.00 0.00 H new ATOM 77 N THR A 5 19.838 9.405 -12.165 1.00 0.00 N ATOM 78 CA THR A 5 18.953 10.536 -11.909 1.00 0.00 C ATOM 79 C THR A 5 18.181 10.834 -13.185 1.00 0.00 C ATOM 80 O THR A 5 18.634 11.592 -14.042 1.00 0.00 O ATOM 81 CB THR A 5 19.718 11.757 -11.387 1.00 0.00 C ATOM 82 OG1 THR A 5 20.437 11.408 -10.225 1.00 0.00 O ATOM 83 CG2 THR A 5 18.757 12.883 -11.018 1.00 0.00 C ATOM 0 H THR A 5 20.579 9.600 -12.838 1.00 0.00 H new ATOM 0 HA THR A 5 18.250 10.280 -11.117 1.00 0.00 H new ATOM 0 HB THR A 5 20.392 12.090 -12.176 1.00 0.00 H new ATOM 0 HG1 THR A 5 20.926 12.191 -9.895 1.00 0.00 H new ATOM 0 HG21 THR A 5 19.323 13.739 -10.650 1.00 0.00 H new ATOM 0 HG22 THR A 5 18.186 13.177 -11.899 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.074 12.539 -10.241 1.00 0.00 H new ATOM 91 N ARG A 6 17.002 10.219 -13.292 1.00 0.00 N ATOM 92 CA ARG A 6 16.111 10.319 -14.439 1.00 0.00 C ATOM 93 C ARG A 6 15.506 11.714 -14.531 1.00 0.00 C ATOM 94 O ARG A 6 15.674 12.529 -13.628 1.00 0.00 O ATOM 95 CB ARG A 6 14.977 9.306 -14.246 1.00 0.00 C ATOM 96 CG ARG A 6 15.503 7.876 -14.106 1.00 0.00 C ATOM 97 CD ARG A 6 15.856 7.296 -15.473 1.00 0.00 C ATOM 98 NE ARG A 6 14.649 7.100 -16.284 1.00 0.00 N ATOM 99 CZ ARG A 6 13.762 6.120 -16.092 1.00 0.00 C ATOM 100 NH1 ARG A 6 13.931 5.220 -15.124 1.00 0.00 N ATOM 101 NH2 ARG A 6 12.690 6.032 -16.873 1.00 0.00 N ATOM 0 H ARG A 6 16.633 9.618 -12.555 1.00 0.00 H new ATOM 0 HA ARG A 6 16.673 10.120 -15.352 1.00 0.00 H new ATOM 0 HB2 ARG A 6 14.403 9.570 -13.358 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.295 9.360 -15.094 1.00 0.00 H new ATOM 0 HG2 ARG A 6 16.383 7.868 -13.463 1.00 0.00 H new ATOM 0 HG3 ARG A 6 14.751 7.252 -13.624 1.00 0.00 H new ATOM 0 HD2 ARG A 6 16.543 7.966 -15.991 1.00 0.00 H new ATOM 0 HD3 ARG A 6 16.373 6.345 -15.347 1.00 0.00 H new ATOM 0 HE ARG A 6 14.476 7.756 -17.045 1.00 0.00 H new ATOM 0 HH11 ARG A 6 14.748 5.273 -14.515 1.00 0.00 H new ATOM 0 HH12 ARG A 6 13.244 4.478 -14.992 1.00 0.00 H new ATOM 0 HH21 ARG A 6 12.545 6.713 -17.619 1.00 0.00 H new ATOM 0 HH22 ARG A 6 12.012 5.284 -16.727 1.00 0.00 H new ATOM 115 N LYS A 7 14.798 11.983 -15.630 1.00 0.00 N ATOM 116 CA LYS A 7 14.013 13.198 -15.795 1.00 0.00 C ATOM 117 C LYS A 7 12.653 12.800 -16.352 1.00 0.00 C ATOM 118 O LYS A 7 12.546 11.784 -17.034 1.00 0.00 O ATOM 119 CB LYS A 7 14.727 14.189 -16.721 1.00 0.00 C ATOM 120 CG LYS A 7 16.169 14.452 -16.279 1.00 0.00 C ATOM 121 CD LYS A 7 16.769 15.591 -17.107 1.00 0.00 C ATOM 122 CE LYS A 7 18.269 15.709 -16.838 1.00 0.00 C ATOM 123 NZ LYS A 7 18.861 16.837 -17.582 1.00 0.00 N ATOM 0 H LYS A 7 14.756 11.356 -16.434 1.00 0.00 H new ATOM 0 HA LYS A 7 13.888 13.701 -14.836 1.00 0.00 H new ATOM 0 HB2 LYS A 7 14.725 13.799 -17.739 1.00 0.00 H new ATOM 0 HB3 LYS A 7 14.176 15.129 -16.739 1.00 0.00 H new ATOM 0 HG2 LYS A 7 16.193 14.709 -15.220 1.00 0.00 H new ATOM 0 HG3 LYS A 7 16.766 13.548 -16.401 1.00 0.00 H new ATOM 0 HD2 LYS A 7 16.596 15.409 -18.168 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.273 16.530 -16.860 1.00 0.00 H new ATOM 0 HE2 LYS A 7 18.439 15.846 -15.770 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.766 14.782 -17.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 19.879 16.891 -17.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 18.719 16.693 -18.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.403 17.724 -17.291 1.00 0.00 H new ATOM 137 N VAL A 8 11.612 13.587 -16.071 1.00 0.00 N ATOM 138 CA VAL A 8 10.263 13.273 -16.527 1.00 0.00 C ATOM 139 C VAL A 8 10.240 13.123 -18.047 1.00 0.00 C ATOM 140 O VAL A 8 10.523 14.074 -18.775 1.00 0.00 O ATOM 141 CB VAL A 8 9.304 14.374 -16.067 1.00 0.00 C ATOM 142 CG1 VAL A 8 7.900 14.133 -16.619 1.00 0.00 C ATOM 143 CG2 VAL A 8 9.239 14.398 -14.538 1.00 0.00 C ATOM 0 H VAL A 8 11.682 14.448 -15.528 1.00 0.00 H new ATOM 0 HA VAL A 8 9.942 12.326 -16.094 1.00 0.00 H new ATOM 0 HB VAL A 8 9.675 15.328 -16.441 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.235 14.927 -16.280 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.933 14.128 -17.708 1.00 0.00 H new ATOM 0 HG13 VAL A 8 7.529 13.172 -16.263 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.555 15.183 -14.215 1.00 0.00 H new ATOM 0 HG22 VAL A 8 8.883 13.434 -14.174 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.233 14.594 -14.135 1.00 0.00 H new ATOM 153 N GLY A 9 9.901 11.918 -18.517 1.00 0.00 N ATOM 154 CA GLY A 9 9.799 11.596 -19.933 1.00 0.00 C ATOM 155 C GLY A 9 10.959 10.732 -20.431 1.00 0.00 C ATOM 156 O GLY A 9 10.915 10.249 -21.562 1.00 0.00 O ATOM 0 H GLY A 9 9.687 11.129 -17.908 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.859 11.074 -20.115 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.767 12.521 -20.510 1.00 0.00 H new ATOM 160 N GLU A 10 11.994 10.527 -19.611 1.00 0.00 N ATOM 161 CA GLU A 10 13.132 9.698 -19.991 1.00 0.00 C ATOM 162 C GLU A 10 12.827 8.216 -19.771 1.00 0.00 C ATOM 163 O GLU A 10 11.834 7.861 -19.137 1.00 0.00 O ATOM 164 CB GLU A 10 14.362 10.098 -19.173 1.00 0.00 C ATOM 165 CG GLU A 10 14.781 11.539 -19.469 1.00 0.00 C ATOM 166 CD GLU A 10 15.132 11.735 -20.944 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.014 10.994 -21.432 1.00 0.00 O ATOM 168 OE2 GLU A 10 14.516 12.623 -21.572 1.00 0.00 O ATOM 0 H GLU A 10 12.063 10.928 -18.676 1.00 0.00 H new ATOM 0 HA GLU A 10 13.331 9.855 -21.051 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.145 9.991 -18.110 1.00 0.00 H new ATOM 0 HB3 GLU A 10 15.187 9.423 -19.400 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.973 12.217 -19.194 1.00 0.00 H new ATOM 0 HG3 GLU A 10 15.641 11.802 -18.852 1.00 0.00 H new ATOM 175 N SER A 11 13.691 7.345 -20.299 1.00 0.00 N ATOM 176 CA SER A 11 13.507 5.907 -20.198 1.00 0.00 C ATOM 177 C SER A 11 14.821 5.197 -19.892 1.00 0.00 C ATOM 178 O SER A 11 15.899 5.769 -20.040 1.00 0.00 O ATOM 179 CB SER A 11 12.924 5.372 -21.509 1.00 0.00 C ATOM 180 OG SER A 11 11.652 5.940 -21.744 1.00 0.00 O ATOM 0 H SER A 11 14.532 7.622 -20.805 1.00 0.00 H new ATOM 0 HA SER A 11 12.818 5.709 -19.377 1.00 0.00 H new ATOM 0 HB2 SER A 11 13.594 5.607 -22.336 1.00 0.00 H new ATOM 0 HB3 SER A 11 12.843 4.286 -21.463 1.00 0.00 H new ATOM 0 HG SER A 11 10.963 5.386 -21.321 1.00 0.00 H new ATOM 186 N ILE A 12 14.705 3.939 -19.462 1.00 0.00 N ATOM 187 CA ILE A 12 15.815 3.033 -19.186 1.00 0.00 C ATOM 188 C ILE A 12 15.465 1.681 -19.802 1.00 0.00 C ATOM 189 O ILE A 12 14.307 1.439 -20.138 1.00 0.00 O ATOM 190 CB ILE A 12 16.024 2.929 -17.663 1.00 0.00 C ATOM 191 CG1 ILE A 12 16.448 4.273 -17.058 1.00 0.00 C ATOM 192 CG2 ILE A 12 17.046 1.861 -17.264 1.00 0.00 C ATOM 193 CD1 ILE A 12 17.812 4.774 -17.541 1.00 0.00 C ATOM 0 H ILE A 12 13.796 3.509 -19.290 1.00 0.00 H new ATOM 0 HA ILE A 12 16.748 3.396 -19.618 1.00 0.00 H new ATOM 0 HB ILE A 12 15.054 2.633 -17.263 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.693 5.021 -17.297 1.00 0.00 H new ATOM 0 HG13 ILE A 12 16.471 4.179 -15.972 1.00 0.00 H new ATOM 0 HG21 ILE A 12 17.146 1.840 -16.179 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.710 0.886 -17.616 1.00 0.00 H new ATOM 0 HG23 ILE A 12 18.011 2.096 -17.712 1.00 0.00 H new ATOM 0 HD11 ILE A 12 18.038 5.729 -17.067 1.00 0.00 H new ATOM 0 HD12 ILE A 12 18.581 4.047 -17.278 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.790 4.903 -18.623 1.00 0.00 H new ATOM 205 N ASN A 13 16.449 0.791 -19.957 1.00 0.00 N ATOM 206 CA ASN A 13 16.199 -0.524 -20.520 1.00 0.00 C ATOM 207 C ASN A 13 16.926 -1.590 -19.706 1.00 0.00 C ATOM 208 O ASN A 13 18.008 -1.336 -19.180 1.00 0.00 O ATOM 209 CB ASN A 13 16.655 -0.517 -21.979 1.00 0.00 C ATOM 210 CG ASN A 13 16.061 -1.687 -22.743 1.00 0.00 C ATOM 211 OD1 ASN A 13 16.684 -2.736 -22.885 1.00 0.00 O ATOM 212 ND2 ASN A 13 14.841 -1.504 -23.240 1.00 0.00 N ATOM 0 H ASN A 13 17.421 0.963 -19.699 1.00 0.00 H new ATOM 0 HA ASN A 13 15.136 -0.761 -20.483 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.357 0.419 -22.452 1.00 0.00 H new ATOM 0 HB3 ASN A 13 17.743 -0.564 -22.023 1.00 0.00 H new ATOM 0 HD21 ASN A 13 14.386 -2.252 -23.763 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.360 -0.616 -23.098 1.00 0.00 H new ATOM 219 N ILE A 14 16.326 -2.781 -19.606 1.00 0.00 N ATOM 220 CA ILE A 14 16.851 -3.874 -18.800 1.00 0.00 C ATOM 221 C ILE A 14 16.866 -5.154 -19.632 1.00 0.00 C ATOM 222 O ILE A 14 15.937 -5.416 -20.397 1.00 0.00 O ATOM 223 CB ILE A 14 15.986 -4.066 -17.545 1.00 0.00 C ATOM 224 CG1 ILE A 14 15.743 -2.761 -16.774 1.00 0.00 C ATOM 225 CG2 ILE A 14 16.611 -5.118 -16.624 1.00 0.00 C ATOM 226 CD1 ILE A 14 17.016 -2.193 -16.152 1.00 0.00 C ATOM 0 H ILE A 14 15.456 -3.009 -20.088 1.00 0.00 H new ATOM 0 HA ILE A 14 17.868 -3.637 -18.487 1.00 0.00 H new ATOM 0 HB ILE A 14 15.011 -4.412 -17.889 1.00 0.00 H new ATOM 0 HG12 ILE A 14 15.313 -2.021 -17.449 1.00 0.00 H new ATOM 0 HG13 ILE A 14 15.009 -2.940 -15.988 1.00 0.00 H new ATOM 0 HG21 ILE A 14 15.987 -5.243 -15.739 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.684 -6.068 -17.154 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.607 -4.793 -16.323 1.00 0.00 H new ATOM 0 HD11 ILE A 14 16.781 -1.271 -15.620 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.435 -2.918 -15.454 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.743 -1.984 -16.937 1.00 0.00 H new ATOM 238 N GLY A 15 17.930 -5.948 -19.476 1.00 0.00 N ATOM 239 CA GLY A 15 18.121 -7.175 -20.231 1.00 0.00 C ATOM 240 C GLY A 15 18.094 -6.883 -21.728 1.00 0.00 C ATOM 241 O GLY A 15 18.947 -6.156 -22.235 1.00 0.00 O ATOM 0 H GLY A 15 18.683 -5.750 -18.817 1.00 0.00 H new ATOM 0 HA2 GLY A 15 19.072 -7.633 -19.960 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.339 -7.891 -19.979 1.00 0.00 H new ATOM 245 N ASP A 16 17.112 -7.450 -22.430 1.00 0.00 N ATOM 246 CA ASP A 16 16.921 -7.222 -23.856 1.00 0.00 C ATOM 247 C ASP A 16 15.432 -7.203 -24.213 1.00 0.00 C ATOM 248 O ASP A 16 15.076 -7.109 -25.387 1.00 0.00 O ATOM 249 CB ASP A 16 17.666 -8.312 -24.630 1.00 0.00 C ATOM 250 CG ASP A 16 17.683 -8.044 -26.134 1.00 0.00 C ATOM 251 OD1 ASP A 16 18.106 -6.931 -26.519 1.00 0.00 O ATOM 252 OD2 ASP A 16 17.272 -8.955 -26.887 1.00 0.00 O ATOM 0 H ASP A 16 16.425 -8.083 -22.020 1.00 0.00 H new ATOM 0 HA ASP A 16 17.325 -6.247 -24.129 1.00 0.00 H new ATOM 0 HB2 ASP A 16 18.690 -8.380 -24.263 1.00 0.00 H new ATOM 0 HB3 ASP A 16 17.195 -9.276 -24.440 1.00 0.00 H new ATOM 257 N ASP A 17 14.552 -7.290 -23.209 1.00 0.00 N ATOM 258 CA ASP A 17 13.115 -7.399 -23.431 1.00 0.00 C ATOM 259 C ASP A 17 12.298 -6.519 -22.484 1.00 0.00 C ATOM 260 O ASP A 17 11.069 -6.545 -22.549 1.00 0.00 O ATOM 261 CB ASP A 17 12.690 -8.862 -23.279 1.00 0.00 C ATOM 262 CG ASP A 17 13.372 -9.763 -24.306 1.00 0.00 C ATOM 263 OD1 ASP A 17 12.894 -9.781 -25.464 1.00 0.00 O ATOM 264 OD2 ASP A 17 14.364 -10.426 -23.928 1.00 0.00 O ATOM 0 H ASP A 17 14.820 -7.286 -22.225 1.00 0.00 H new ATOM 0 HA ASP A 17 12.913 -7.045 -24.442 1.00 0.00 H new ATOM 0 HB2 ASP A 17 12.933 -9.208 -22.274 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.608 -8.939 -23.390 1.00 0.00 H new ATOM 269 N ILE A 18 12.945 -5.741 -21.606 1.00 0.00 N ATOM 270 CA ILE A 18 12.219 -4.910 -20.653 1.00 0.00 C ATOM 271 C ILE A 18 12.630 -3.451 -20.806 1.00 0.00 C ATOM 272 O ILE A 18 13.806 -3.150 -20.998 1.00 0.00 O ATOM 273 CB ILE A 18 12.465 -5.402 -19.218 1.00 0.00 C ATOM 274 CG1 ILE A 18 12.008 -6.853 -19.025 1.00 0.00 C ATOM 275 CG2 ILE A 18 11.705 -4.519 -18.226 1.00 0.00 C ATOM 276 CD1 ILE A 18 13.169 -7.822 -19.261 1.00 0.00 C ATOM 0 H ILE A 18 13.961 -5.674 -21.540 1.00 0.00 H new ATOM 0 HA ILE A 18 11.152 -4.988 -20.860 1.00 0.00 H new ATOM 0 HB ILE A 18 13.539 -5.347 -19.039 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.617 -6.985 -18.016 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.194 -7.078 -19.714 1.00 0.00 H new ATOM 0 HG21 ILE A 18 11.884 -4.874 -17.211 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.051 -3.489 -18.317 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.638 -4.564 -18.443 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.823 -8.846 -19.119 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.541 -7.703 -20.278 1.00 0.00 H new ATOM 0 HD13 ILE A 18 13.971 -7.609 -18.554 1.00 0.00 H new ATOM 288 N THR A 19 11.654 -2.544 -20.716 1.00 0.00 N ATOM 289 CA THR A 19 11.884 -1.112 -20.819 1.00 0.00 C ATOM 290 C THR A 19 11.155 -0.407 -19.682 1.00 0.00 C ATOM 291 O THR A 19 10.081 -0.841 -19.274 1.00 0.00 O ATOM 292 CB THR A 19 11.386 -0.602 -22.176 1.00 0.00 C ATOM 293 OG1 THR A 19 11.914 -1.394 -23.217 1.00 0.00 O ATOM 294 CG2 THR A 19 11.817 0.843 -22.412 1.00 0.00 C ATOM 0 H THR A 19 10.676 -2.791 -20.568 1.00 0.00 H new ATOM 0 HA THR A 19 12.951 -0.902 -20.743 1.00 0.00 H new ATOM 0 HB THR A 19 10.298 -0.660 -22.168 1.00 0.00 H new ATOM 0 HG1 THR A 19 11.588 -1.061 -24.079 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.450 1.178 -23.382 1.00 0.00 H new ATOM 0 HG22 THR A 19 11.404 1.478 -21.628 1.00 0.00 H new ATOM 0 HG23 THR A 19 12.905 0.906 -22.394 1.00 0.00 H new ATOM 302 N ILE A 20 11.741 0.678 -19.173 1.00 0.00 N ATOM 303 CA ILE A 20 11.188 1.425 -18.051 1.00 0.00 C ATOM 304 C ILE A 20 11.069 2.894 -18.451 1.00 0.00 C ATOM 305 O ILE A 20 11.877 3.382 -19.238 1.00 0.00 O ATOM 306 CB ILE A 20 12.101 1.276 -16.823 1.00 0.00 C ATOM 307 CG1 ILE A 20 12.544 -0.173 -16.566 1.00 0.00 C ATOM 308 CG2 ILE A 20 11.409 1.833 -15.577 1.00 0.00 C ATOM 309 CD1 ILE A 20 11.391 -1.109 -16.209 1.00 0.00 C ATOM 0 H ILE A 20 12.616 1.062 -19.531 1.00 0.00 H new ATOM 0 HA ILE A 20 10.202 1.037 -17.794 1.00 0.00 H new ATOM 0 HB ILE A 20 13.002 1.849 -17.040 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.048 -0.553 -17.454 1.00 0.00 H new ATOM 0 HG13 ILE A 20 13.274 -0.183 -15.756 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.067 1.721 -14.715 1.00 0.00 H new ATOM 0 HG22 ILE A 20 11.184 2.889 -15.727 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.483 1.286 -15.400 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.777 -2.114 -16.041 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.900 -0.753 -15.303 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.672 -1.129 -17.028 1.00 0.00 H new ATOM 321 N THR A 21 10.069 3.600 -17.917 1.00 0.00 N ATOM 322 CA THR A 21 9.850 5.006 -18.237 1.00 0.00 C ATOM 323 C THR A 21 9.388 5.754 -16.988 1.00 0.00 C ATOM 324 O THR A 21 8.833 5.146 -16.075 1.00 0.00 O ATOM 325 CB THR A 21 8.804 5.110 -19.355 1.00 0.00 C ATOM 326 OG1 THR A 21 9.198 4.316 -20.454 1.00 0.00 O ATOM 327 CG2 THR A 21 8.644 6.546 -19.854 1.00 0.00 C ATOM 0 H THR A 21 9.395 3.213 -17.256 1.00 0.00 H new ATOM 0 HA THR A 21 10.780 5.459 -18.581 1.00 0.00 H new ATOM 0 HB THR A 21 7.857 4.768 -18.939 1.00 0.00 H new ATOM 0 HG1 THR A 21 8.527 4.385 -21.165 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.894 6.575 -20.645 1.00 0.00 H new ATOM 0 HG22 THR A 21 8.327 7.184 -19.030 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.597 6.904 -20.244 1.00 0.00 H new ATOM 335 N ILE A 22 9.615 7.069 -16.945 1.00 0.00 N ATOM 336 CA ILE A 22 9.142 7.923 -15.861 1.00 0.00 C ATOM 337 C ILE A 22 8.108 8.892 -16.429 1.00 0.00 C ATOM 338 O ILE A 22 8.452 9.859 -17.106 1.00 0.00 O ATOM 339 CB ILE A 22 10.323 8.612 -15.156 1.00 0.00 C ATOM 340 CG1 ILE A 22 9.860 9.711 -14.194 1.00 0.00 C ATOM 341 CG2 ILE A 22 11.305 9.238 -16.144 1.00 0.00 C ATOM 342 CD1 ILE A 22 8.986 9.146 -13.077 1.00 0.00 C ATOM 0 H ILE A 22 10.135 7.570 -17.666 1.00 0.00 H new ATOM 0 HA ILE A 22 8.652 7.335 -15.085 1.00 0.00 H new ATOM 0 HB ILE A 22 10.821 7.819 -14.599 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.729 10.207 -13.762 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.303 10.468 -14.746 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.120 9.711 -15.596 1.00 0.00 H new ATOM 0 HG22 ILE A 22 11.708 8.464 -16.797 1.00 0.00 H new ATOM 0 HG23 ILE A 22 10.789 9.987 -16.745 1.00 0.00 H new ATOM 0 HD11 ILE A 22 8.676 9.954 -12.414 1.00 0.00 H new ATOM 0 HD12 ILE A 22 8.104 8.673 -13.509 1.00 0.00 H new ATOM 0 HD13 ILE A 22 9.553 8.408 -12.510 1.00 0.00 H new ATOM 354 N LEU A 23 6.828 8.626 -16.152 1.00 0.00 N ATOM 355 CA LEU A 23 5.738 9.390 -16.738 1.00 0.00 C ATOM 356 C LEU A 23 5.619 10.749 -16.057 1.00 0.00 C ATOM 357 O LEU A 23 5.162 11.711 -16.674 1.00 0.00 O ATOM 358 CB LEU A 23 4.420 8.622 -16.602 1.00 0.00 C ATOM 359 CG LEU A 23 4.529 7.153 -17.025 1.00 0.00 C ATOM 360 CD1 LEU A 23 3.126 6.557 -17.082 1.00 0.00 C ATOM 361 CD2 LEU A 23 5.177 6.997 -18.399 1.00 0.00 C ATOM 0 H LEU A 23 6.527 7.883 -15.522 1.00 0.00 H new ATOM 0 HA LEU A 23 5.951 9.543 -17.796 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.084 8.671 -15.566 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.658 9.112 -17.208 1.00 0.00 H new ATOM 0 HG LEU A 23 5.154 6.639 -16.295 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.187 5.511 -17.382 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.661 6.626 -16.099 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.526 7.108 -17.806 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.233 5.939 -18.657 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.579 7.521 -19.145 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.182 7.419 -18.377 1.00 0.00 H new ATOM 373 N GLY A 24 6.030 10.829 -14.788 1.00 0.00 N ATOM 374 CA GLY A 24 6.086 12.099 -14.082 1.00 0.00 C ATOM 375 C GLY A 24 6.039 11.923 -12.571 1.00 0.00 C ATOM 376 O GLY A 24 5.777 10.832 -12.066 1.00 0.00 O ATOM 0 H GLY A 24 6.327 10.026 -14.234 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.001 12.624 -14.356 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.252 12.725 -14.399 1.00 0.00 H new ATOM 380 N VAL A 25 6.297 13.014 -11.849 1.00 0.00 N ATOM 381 CA VAL A 25 6.246 13.016 -10.394 1.00 0.00 C ATOM 382 C VAL A 25 4.803 13.139 -9.919 1.00 0.00 C ATOM 383 O VAL A 25 3.909 13.488 -10.691 1.00 0.00 O ATOM 384 CB VAL A 25 7.094 14.161 -9.834 1.00 0.00 C ATOM 385 CG1 VAL A 25 8.557 13.953 -10.225 1.00 0.00 C ATOM 386 CG2 VAL A 25 6.625 15.524 -10.351 1.00 0.00 C ATOM 0 H VAL A 25 6.546 13.915 -12.258 1.00 0.00 H new ATOM 0 HA VAL A 25 6.654 12.074 -10.027 1.00 0.00 H new ATOM 0 HB VAL A 25 6.984 14.154 -8.750 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.160 14.769 -9.826 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.912 13.006 -9.817 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.644 13.935 -11.311 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.253 16.309 -9.930 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.698 15.545 -11.438 1.00 0.00 H new ATOM 0 HG23 VAL A 25 5.589 15.689 -10.054 1.00 0.00 H new ATOM 396 N SER A 26 4.583 12.848 -8.637 1.00 0.00 N ATOM 397 CA SER A 26 3.272 12.896 -8.005 1.00 0.00 C ATOM 398 C SER A 26 3.421 13.321 -6.544 1.00 0.00 C ATOM 399 O SER A 26 2.669 12.874 -5.679 1.00 0.00 O ATOM 400 CB SER A 26 2.598 11.526 -8.123 1.00 0.00 C ATOM 401 OG SER A 26 2.404 11.183 -9.480 1.00 0.00 O ATOM 0 H SER A 26 5.328 12.567 -7.999 1.00 0.00 H new ATOM 0 HA SER A 26 2.642 13.630 -8.507 1.00 0.00 H new ATOM 0 HB2 SER A 26 3.212 10.769 -7.635 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.639 11.541 -7.605 1.00 0.00 H new ATOM 0 HG SER A 26 1.974 10.304 -9.537 1.00 0.00 H new ATOM 407 N GLY A 27 4.400 14.190 -6.268 1.00 0.00 N ATOM 408 CA GLY A 27 4.679 14.691 -4.930 1.00 0.00 C ATOM 409 C GLY A 27 5.365 13.619 -4.094 1.00 0.00 C ATOM 410 O GLY A 27 6.509 13.255 -4.363 1.00 0.00 O ATOM 0 H GLY A 27 5.025 14.566 -6.981 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.314 15.575 -4.991 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.750 14.998 -4.449 1.00 0.00 H new ATOM 414 N GLN A 28 4.664 13.110 -3.078 1.00 0.00 N ATOM 415 CA GLN A 28 5.159 12.022 -2.249 1.00 0.00 C ATOM 416 C GLN A 28 5.209 10.717 -3.050 1.00 0.00 C ATOM 417 O GLN A 28 5.729 9.709 -2.576 1.00 0.00 O ATOM 418 CB GLN A 28 4.233 11.883 -1.035 1.00 0.00 C ATOM 419 CG GLN A 28 4.842 11.038 0.087 1.00 0.00 C ATOM 420 CD GLN A 28 6.095 11.688 0.667 1.00 0.00 C ATOM 421 OE1 GLN A 28 7.160 11.078 0.700 1.00 0.00 O ATOM 422 NE2 GLN A 28 5.978 12.930 1.128 1.00 0.00 N ATOM 0 H GLN A 28 3.738 13.444 -2.811 1.00 0.00 H new ATOM 0 HA GLN A 28 6.173 12.238 -1.914 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.998 12.875 -0.649 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.292 11.433 -1.352 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.105 10.898 0.878 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.090 10.048 -0.296 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.078 13.407 1.085 1.00 0.00 H new ATOM 0 HE22 GLN A 28 6.789 13.405 1.525 1.00 0.00 H new ATOM 431 N GLN A 29 4.666 10.733 -4.272 1.00 0.00 N ATOM 432 CA GLN A 29 4.642 9.574 -5.148 1.00 0.00 C ATOM 433 C GLN A 29 5.334 9.890 -6.469 1.00 0.00 C ATOM 434 O GLN A 29 5.699 11.035 -6.731 1.00 0.00 O ATOM 435 CB GLN A 29 3.194 9.162 -5.418 1.00 0.00 C ATOM 436 CG GLN A 29 2.415 8.785 -4.159 1.00 0.00 C ATOM 437 CD GLN A 29 0.967 8.480 -4.506 1.00 0.00 C ATOM 438 OE1 GLN A 29 0.476 7.378 -4.274 1.00 0.00 O ATOM 439 NE2 GLN A 29 0.266 9.457 -5.068 1.00 0.00 N ATOM 0 H GLN A 29 4.229 11.561 -4.677 1.00 0.00 H new ATOM 0 HA GLN A 29 5.171 8.756 -4.659 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.680 9.982 -5.920 1.00 0.00 H new ATOM 0 HB3 GLN A 29 3.189 8.315 -6.104 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.873 7.917 -3.686 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.459 9.601 -3.438 1.00 0.00 H new ATOM 0 HE21 GLN A 29 0.704 10.361 -5.247 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.710 9.304 -5.321 1.00 0.00 H new ATOM 448 N VAL A 30 5.513 8.863 -7.303 1.00 0.00 N ATOM 449 CA VAL A 30 6.102 8.987 -8.627 1.00 0.00 C ATOM 450 C VAL A 30 5.423 7.999 -9.570 1.00 0.00 C ATOM 451 O VAL A 30 5.387 6.801 -9.285 1.00 0.00 O ATOM 452 CB VAL A 30 7.607 8.698 -8.557 1.00 0.00 C ATOM 453 CG1 VAL A 30 8.229 8.887 -9.938 1.00 0.00 C ATOM 454 CG2 VAL A 30 8.317 9.647 -7.591 1.00 0.00 C ATOM 0 H VAL A 30 5.246 7.907 -7.067 1.00 0.00 H new ATOM 0 HA VAL A 30 5.958 10.001 -8.999 1.00 0.00 H new ATOM 0 HB VAL A 30 7.727 7.673 -8.207 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.298 8.681 -9.887 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.761 8.202 -10.645 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.072 9.913 -10.270 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.381 9.413 -7.567 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.179 10.676 -7.924 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.897 9.530 -6.592 1.00 0.00 H new ATOM 464 N ARG A 31 4.884 8.489 -10.693 1.00 0.00 N ATOM 465 CA ARG A 31 4.267 7.627 -11.688 1.00 0.00 C ATOM 466 C ARG A 31 5.322 7.094 -12.648 1.00 0.00 C ATOM 467 O ARG A 31 5.785 7.809 -13.540 1.00 0.00 O ATOM 468 CB ARG A 31 3.146 8.350 -12.435 1.00 0.00 C ATOM 469 CG ARG A 31 2.466 7.359 -13.382 1.00 0.00 C ATOM 470 CD ARG A 31 1.115 7.894 -13.856 1.00 0.00 C ATOM 471 NE ARG A 31 0.165 7.924 -12.737 1.00 0.00 N ATOM 472 CZ ARG A 31 -1.166 8.002 -12.833 1.00 0.00 C ATOM 473 NH1 ARG A 31 -1.781 8.074 -14.011 1.00 0.00 N ATOM 474 NH2 ARG A 31 -1.897 8.008 -11.721 1.00 0.00 N ATOM 0 H ARG A 31 4.867 9.481 -10.929 1.00 0.00 H new ATOM 0 HA ARG A 31 3.813 6.780 -11.174 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.421 8.755 -11.728 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.549 9.193 -12.996 1.00 0.00 H new ATOM 0 HG2 ARG A 31 3.109 7.172 -14.242 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.326 6.404 -12.875 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.236 8.896 -14.268 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.726 7.265 -14.657 1.00 0.00 H new ATOM 0 HE ARG A 31 0.558 7.881 -11.797 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.235 8.071 -14.872 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.798 8.133 -14.052 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.441 7.954 -10.810 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.914 8.067 -11.779 1.00 0.00 H new ATOM 488 N ILE A 32 5.690 5.828 -12.443 1.00 0.00 N ATOM 489 CA ILE A 32 6.674 5.111 -13.242 1.00 0.00 C ATOM 490 C ILE A 32 5.939 4.093 -14.113 1.00 0.00 C ATOM 491 O ILE A 32 4.838 3.663 -13.776 1.00 0.00 O ATOM 492 CB ILE A 32 7.672 4.422 -12.295 1.00 0.00 C ATOM 493 CG1 ILE A 32 8.332 5.466 -11.384 1.00 0.00 C ATOM 494 CG2 ILE A 32 8.750 3.666 -13.078 1.00 0.00 C ATOM 495 CD1 ILE A 32 9.226 4.826 -10.321 1.00 0.00 C ATOM 0 H ILE A 32 5.297 5.260 -11.692 1.00 0.00 H new ATOM 0 HA ILE A 32 7.228 5.789 -13.890 1.00 0.00 H new ATOM 0 HB ILE A 32 7.121 3.702 -11.690 1.00 0.00 H new ATOM 0 HG12 ILE A 32 8.925 6.151 -11.990 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.559 6.060 -10.896 1.00 0.00 H new ATOM 0 HG21 ILE A 32 9.440 3.190 -12.381 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.281 2.904 -13.701 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.298 4.365 -13.710 1.00 0.00 H new ATOM 0 HD11 ILE A 32 9.670 5.605 -9.702 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.629 4.162 -9.696 1.00 0.00 H new ATOM 0 HD13 ILE A 32 10.017 4.254 -10.807 1.00 0.00 H new ATOM 507 N GLY A 33 6.548 3.704 -15.235 1.00 0.00 N ATOM 508 CA GLY A 33 5.995 2.698 -16.125 1.00 0.00 C ATOM 509 C GLY A 33 6.995 1.566 -16.307 1.00 0.00 C ATOM 510 O GLY A 33 8.192 1.811 -16.446 1.00 0.00 O ATOM 0 H GLY A 33 7.442 4.083 -15.547 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.063 2.310 -15.715 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.757 3.144 -17.091 1.00 0.00 H new ATOM 514 N ILE A 34 6.500 0.326 -16.304 1.00 0.00 N ATOM 515 CA ILE A 34 7.320 -0.866 -16.451 1.00 0.00 C ATOM 516 C ILE A 34 6.755 -1.686 -17.606 1.00 0.00 C ATOM 517 O ILE A 34 5.598 -2.101 -17.560 1.00 0.00 O ATOM 518 CB ILE A 34 7.331 -1.682 -15.149 1.00 0.00 C ATOM 519 CG1 ILE A 34 7.894 -0.891 -13.957 1.00 0.00 C ATOM 520 CG2 ILE A 34 8.205 -2.922 -15.355 1.00 0.00 C ATOM 521 CD1 ILE A 34 6.814 -0.084 -13.230 1.00 0.00 C ATOM 0 H ILE A 34 5.506 0.125 -16.198 1.00 0.00 H new ATOM 0 HA ILE A 34 8.352 -0.589 -16.664 1.00 0.00 H new ATOM 0 HB ILE A 34 6.298 -1.944 -14.920 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.362 -1.581 -13.255 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.674 -0.215 -14.308 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.222 -3.511 -14.438 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.796 -3.525 -16.166 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.220 -2.614 -15.608 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.263 0.456 -12.397 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.363 0.627 -13.922 1.00 0.00 H new ATOM 0 HD13 ILE A 34 6.047 -0.760 -12.853 1.00 0.00 H new ATOM 533 N ASN A 35 7.565 -1.921 -18.640 1.00 0.00 N ATOM 534 CA ASN A 35 7.115 -2.622 -19.830 1.00 0.00 C ATOM 535 C ASN A 35 7.958 -3.863 -20.083 1.00 0.00 C ATOM 536 O ASN A 35 9.132 -3.774 -20.436 1.00 0.00 O ATOM 537 CB ASN A 35 7.148 -1.672 -21.022 1.00 0.00 C ATOM 538 CG ASN A 35 6.442 -2.281 -22.225 1.00 0.00 C ATOM 539 OD1 ASN A 35 5.241 -2.531 -22.181 1.00 0.00 O ATOM 540 ND2 ASN A 35 7.178 -2.523 -23.305 1.00 0.00 N ATOM 0 H ASN A 35 8.542 -1.631 -18.671 1.00 0.00 H new ATOM 0 HA ASN A 35 6.089 -2.958 -19.681 1.00 0.00 H new ATOM 0 HB2 ASN A 35 6.670 -0.730 -20.754 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.182 -1.443 -21.280 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.747 -2.930 -24.135 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.174 -2.302 -23.304 1.00 0.00 H new ATOM 547 N ALA A 36 7.331 -5.022 -19.898 1.00 0.00 N ATOM 548 CA ALA A 36 7.938 -6.329 -20.083 1.00 0.00 C ATOM 549 C ALA A 36 6.901 -7.258 -20.710 1.00 0.00 C ATOM 550 O ALA A 36 5.704 -6.985 -20.618 1.00 0.00 O ATOM 551 CB ALA A 36 8.381 -6.851 -18.716 1.00 0.00 C ATOM 0 H ALA A 36 6.355 -5.074 -19.606 1.00 0.00 H new ATOM 0 HA ALA A 36 8.806 -6.275 -20.740 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.840 -7.833 -18.833 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.104 -6.162 -18.280 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.515 -6.931 -18.059 1.00 0.00 H new ATOM 557 N PRO A 37 7.325 -8.356 -21.350 1.00 0.00 N ATOM 558 CA PRO A 37 6.404 -9.329 -21.900 1.00 0.00 C ATOM 559 C PRO A 37 5.702 -10.040 -20.749 1.00 0.00 C ATOM 560 O PRO A 37 6.231 -10.096 -19.639 1.00 0.00 O ATOM 561 CB PRO A 37 7.274 -10.282 -22.719 1.00 0.00 C ATOM 562 CG PRO A 37 8.634 -10.202 -22.027 1.00 0.00 C ATOM 563 CD PRO A 37 8.702 -8.741 -21.587 1.00 0.00 C ATOM 0 HA PRO A 37 5.626 -8.892 -22.526 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.877 -11.297 -22.709 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.335 -9.974 -23.763 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.697 -10.884 -21.179 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.449 -10.459 -22.704 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.304 -8.628 -20.685 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.159 -8.118 -22.356 1.00 0.00 H new ATOM 571 N LYS A 38 4.511 -10.589 -20.995 1.00 0.00 N ATOM 572 CA LYS A 38 3.764 -11.263 -19.941 1.00 0.00 C ATOM 573 C LYS A 38 4.436 -12.580 -19.540 1.00 0.00 C ATOM 574 O LYS A 38 3.957 -13.286 -18.655 1.00 0.00 O ATOM 575 CB LYS A 38 2.306 -11.426 -20.376 1.00 0.00 C ATOM 576 CG LYS A 38 1.400 -11.512 -19.147 1.00 0.00 C ATOM 577 CD LYS A 38 -0.063 -11.352 -19.562 1.00 0.00 C ATOM 578 CE LYS A 38 -0.958 -11.475 -18.330 1.00 0.00 C ATOM 579 NZ LYS A 38 -2.381 -11.312 -18.687 1.00 0.00 N ATOM 0 H LYS A 38 4.050 -10.579 -21.905 1.00 0.00 H new ATOM 0 HA LYS A 38 3.766 -10.653 -19.038 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.008 -10.583 -21.000 1.00 0.00 H new ATOM 0 HB3 LYS A 38 2.197 -12.325 -20.982 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.542 -12.470 -18.647 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.670 -10.736 -18.431 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -0.213 -10.383 -20.039 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.329 -12.113 -20.296 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.807 -12.448 -17.863 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.676 -10.721 -17.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.966 -11.400 -17.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.527 -10.374 -19.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -2.654 -12.047 -19.370 1.00 0.00 H new ATOM 593 N ASP A 39 5.555 -12.908 -20.198 1.00 0.00 N ATOM 594 CA ASP A 39 6.387 -14.056 -19.875 1.00 0.00 C ATOM 595 C ASP A 39 7.079 -13.872 -18.525 1.00 0.00 C ATOM 596 O ASP A 39 7.587 -14.835 -17.954 1.00 0.00 O ATOM 597 CB ASP A 39 7.454 -14.198 -20.961 1.00 0.00 C ATOM 598 CG ASP A 39 8.223 -15.512 -20.830 1.00 0.00 C ATOM 599 OD1 ASP A 39 7.572 -16.575 -20.938 1.00 0.00 O ATOM 600 OD2 ASP A 39 9.454 -15.442 -20.623 1.00 0.00 O ATOM 0 H ASP A 39 5.908 -12.365 -20.986 1.00 0.00 H new ATOM 0 HA ASP A 39 5.758 -14.945 -19.822 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.983 -14.149 -21.943 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.150 -13.361 -20.899 1.00 0.00 H new ATOM 605 N VAL A 40 7.102 -12.636 -18.015 1.00 0.00 N ATOM 606 CA VAL A 40 7.745 -12.309 -16.750 1.00 0.00 C ATOM 607 C VAL A 40 6.778 -11.522 -15.871 1.00 0.00 C ATOM 608 O VAL A 40 5.775 -10.998 -16.356 1.00 0.00 O ATOM 609 CB VAL A 40 9.045 -11.530 -16.995 1.00 0.00 C ATOM 610 CG1 VAL A 40 9.949 -12.273 -17.982 1.00 0.00 C ATOM 611 CG2 VAL A 40 8.779 -10.143 -17.576 1.00 0.00 C ATOM 0 H VAL A 40 6.671 -11.834 -18.475 1.00 0.00 H new ATOM 0 HA VAL A 40 8.008 -13.229 -16.229 1.00 0.00 H new ATOM 0 HB VAL A 40 9.528 -11.435 -16.023 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.864 -11.701 -18.139 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.199 -13.254 -17.578 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.429 -12.394 -18.932 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.726 -9.627 -17.734 1.00 0.00 H new ATOM 0 HG22 VAL A 40 8.257 -10.241 -18.528 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.164 -9.570 -16.882 1.00 0.00 H new ATOM 621 N ALA A 41 7.076 -11.437 -14.574 1.00 0.00 N ATOM 622 CA ALA A 41 6.195 -10.768 -13.632 1.00 0.00 C ATOM 623 C ALA A 41 6.695 -9.361 -13.312 1.00 0.00 C ATOM 624 O ALA A 41 7.872 -9.054 -13.492 1.00 0.00 O ATOM 625 CB ALA A 41 6.105 -11.609 -12.361 1.00 0.00 C ATOM 0 H ALA A 41 7.922 -11.825 -14.157 1.00 0.00 H new ATOM 0 HA ALA A 41 5.205 -10.666 -14.077 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.446 -11.117 -11.645 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.706 -12.594 -12.604 1.00 0.00 H new ATOM 0 HB3 ALA A 41 7.098 -11.717 -11.925 1.00 0.00 H new ATOM 631 N VAL A 42 5.783 -8.511 -12.833 1.00 0.00 N ATOM 632 CA VAL A 42 6.090 -7.168 -12.362 1.00 0.00 C ATOM 633 C VAL A 42 5.059 -6.777 -11.310 1.00 0.00 C ATOM 634 O VAL A 42 3.871 -6.662 -11.604 1.00 0.00 O ATOM 635 CB VAL A 42 6.152 -6.164 -13.529 1.00 0.00 C ATOM 636 CG1 VAL A 42 5.137 -6.479 -14.624 1.00 0.00 C ATOM 637 CG2 VAL A 42 5.921 -4.727 -13.056 1.00 0.00 C ATOM 0 H VAL A 42 4.793 -8.746 -12.763 1.00 0.00 H new ATOM 0 HA VAL A 42 7.080 -7.151 -11.906 1.00 0.00 H new ATOM 0 HB VAL A 42 7.158 -6.259 -13.939 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.222 -5.742 -15.422 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.332 -7.473 -15.026 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.130 -6.447 -14.207 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.973 -4.050 -13.909 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.938 -4.651 -12.591 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.688 -4.455 -12.330 1.00 0.00 H new ATOM 647 N HIS A 43 5.521 -6.575 -10.074 1.00 0.00 N ATOM 648 CA HIS A 43 4.667 -6.197 -8.956 1.00 0.00 C ATOM 649 C HIS A 43 5.385 -5.197 -8.054 1.00 0.00 C ATOM 650 O HIS A 43 6.604 -5.055 -8.124 1.00 0.00 O ATOM 651 CB HIS A 43 4.292 -7.444 -8.146 1.00 0.00 C ATOM 652 CG HIS A 43 3.486 -8.457 -8.917 1.00 0.00 C ATOM 653 ND1 HIS A 43 2.132 -8.677 -8.799 1.00 0.00 N ATOM 654 CD2 HIS A 43 3.971 -9.325 -9.857 1.00 0.00 C ATOM 655 CE1 HIS A 43 1.808 -9.645 -9.674 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.894 -10.076 -10.337 1.00 0.00 N ATOM 0 H HIS A 43 6.505 -6.671 -9.824 1.00 0.00 H new ATOM 0 HA HIS A 43 3.762 -5.732 -9.348 1.00 0.00 H new ATOM 0 HB2 HIS A 43 5.205 -7.919 -7.786 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.725 -7.137 -7.267 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.000 -9.414 -10.171 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.808 -10.025 -9.824 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.926 -10.806 -11.049 1.00 0.00 H new ATOM 664 N ARG A 44 4.625 -4.499 -7.204 1.00 0.00 N ATOM 665 CA ARG A 44 5.180 -3.563 -6.234 1.00 0.00 C ATOM 666 C ARG A 44 5.638 -4.310 -4.980 1.00 0.00 C ATOM 667 O ARG A 44 5.318 -5.483 -4.800 1.00 0.00 O ATOM 668 CB ARG A 44 4.131 -2.498 -5.902 1.00 0.00 C ATOM 669 CG ARG A 44 2.896 -3.162 -5.296 1.00 0.00 C ATOM 670 CD ARG A 44 1.806 -2.154 -4.971 1.00 0.00 C ATOM 671 NE ARG A 44 1.067 -1.739 -6.159 1.00 0.00 N ATOM 672 CZ ARG A 44 0.103 -0.819 -6.135 1.00 0.00 C ATOM 673 NH1 ARG A 44 -0.216 -0.188 -5.006 1.00 0.00 N ATOM 674 NH2 ARG A 44 -0.545 -0.533 -7.258 1.00 0.00 N ATOM 0 H ARG A 44 3.608 -4.570 -7.173 1.00 0.00 H new ATOM 0 HA ARG A 44 6.054 -3.067 -6.657 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.545 -1.772 -5.203 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.856 -1.951 -6.804 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.506 -3.905 -5.992 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.180 -3.694 -4.388 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.115 -2.589 -4.249 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.252 -1.279 -4.498 1.00 0.00 H new ATOM 0 HE ARG A 44 1.300 -2.174 -7.052 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.280 -0.406 -4.142 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.956 0.513 -5.006 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.303 -1.015 -8.124 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.285 0.169 -7.255 1.00 0.00 H new ATOM 688 N GLU A 45 6.389 -3.633 -4.109 1.00 0.00 N ATOM 689 CA GLU A 45 6.942 -4.242 -2.903 1.00 0.00 C ATOM 690 C GLU A 45 5.853 -4.673 -1.918 1.00 0.00 C ATOM 691 O GLU A 45 6.013 -5.675 -1.221 1.00 0.00 O ATOM 692 CB GLU A 45 7.892 -3.232 -2.256 1.00 0.00 C ATOM 693 CG GLU A 45 8.564 -3.805 -1.007 1.00 0.00 C ATOM 694 CD GLU A 45 9.596 -2.831 -0.441 1.00 0.00 C ATOM 695 OE1 GLU A 45 9.254 -1.635 -0.304 1.00 0.00 O ATOM 696 OE2 GLU A 45 10.723 -3.290 -0.149 1.00 0.00 O ATOM 0 H GLU A 45 6.629 -2.648 -4.222 1.00 0.00 H new ATOM 0 HA GLU A 45 7.478 -5.150 -3.177 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.655 -2.937 -2.977 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.339 -2.331 -1.991 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.809 -4.020 -0.251 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.048 -4.750 -1.252 1.00 0.00 H new ATOM 703 N GLU A 46 4.745 -3.929 -1.850 1.00 0.00 N ATOM 704 CA GLU A 46 3.648 -4.220 -0.932 1.00 0.00 C ATOM 705 C GLU A 46 2.675 -5.262 -1.497 1.00 0.00 C ATOM 706 O GLU A 46 1.656 -5.556 -0.875 1.00 0.00 O ATOM 707 CB GLU A 46 2.923 -2.916 -0.573 1.00 0.00 C ATOM 708 CG GLU A 46 2.322 -2.253 -1.814 1.00 0.00 C ATOM 709 CD GLU A 46 1.576 -0.954 -1.504 1.00 0.00 C ATOM 710 OE1 GLU A 46 1.493 -0.589 -0.310 1.00 0.00 O ATOM 711 OE2 GLU A 46 1.090 -0.335 -2.478 1.00 0.00 O ATOM 0 H GLU A 46 4.587 -3.107 -2.433 1.00 0.00 H new ATOM 0 HA GLU A 46 4.069 -4.658 -0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.133 -3.124 0.149 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.621 -2.230 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.119 -2.045 -2.528 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.637 -2.951 -2.295 1.00 0.00 H new ATOM 718 N ILE A 47 2.983 -5.821 -2.673 1.00 0.00 N ATOM 719 CA ILE A 47 2.138 -6.794 -3.363 1.00 0.00 C ATOM 720 C ILE A 47 2.943 -8.045 -3.712 1.00 0.00 C ATOM 721 O ILE A 47 2.367 -9.115 -3.895 1.00 0.00 O ATOM 722 CB ILE A 47 1.567 -6.118 -4.613 1.00 0.00 C ATOM 723 CG1 ILE A 47 0.487 -5.097 -4.232 1.00 0.00 C ATOM 724 CG2 ILE A 47 0.994 -7.069 -5.655 1.00 0.00 C ATOM 725 CD1 ILE A 47 -0.830 -5.736 -3.796 1.00 0.00 C ATOM 0 H ILE A 47 3.842 -5.604 -3.178 1.00 0.00 H new ATOM 0 HA ILE A 47 1.318 -7.117 -2.722 1.00 0.00 H new ATOM 0 HB ILE A 47 2.426 -5.632 -5.075 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.862 -4.468 -3.424 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.300 -4.443 -5.084 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.615 -6.496 -6.501 1.00 0.00 H new ATOM 0 HG22 ILE A 47 1.775 -7.747 -5.997 1.00 0.00 H new ATOM 0 HG23 ILE A 47 0.181 -7.645 -5.214 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.547 -4.955 -3.542 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.227 -6.342 -4.610 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.657 -6.368 -2.925 1.00 0.00 H new ATOM 737 N TYR A 48 4.271 -7.925 -3.802 1.00 0.00 N ATOM 738 CA TYR A 48 5.135 -9.076 -3.996 1.00 0.00 C ATOM 739 C TYR A 48 5.081 -9.966 -2.758 1.00 0.00 C ATOM 740 O TYR A 48 4.843 -11.166 -2.869 1.00 0.00 O ATOM 741 CB TYR A 48 6.568 -8.606 -4.250 1.00 0.00 C ATOM 742 CG TYR A 48 7.593 -9.716 -4.131 1.00 0.00 C ATOM 743 CD1 TYR A 48 7.385 -10.942 -4.782 1.00 0.00 C ATOM 744 CD2 TYR A 48 8.749 -9.517 -3.361 1.00 0.00 C ATOM 745 CE1 TYR A 48 8.319 -11.978 -4.647 1.00 0.00 C ATOM 746 CE2 TYR A 48 9.691 -10.546 -3.229 1.00 0.00 C ATOM 747 CZ TYR A 48 9.478 -11.784 -3.869 1.00 0.00 C ATOM 748 OH TYR A 48 10.390 -12.790 -3.738 1.00 0.00 O ATOM 0 H TYR A 48 4.766 -7.035 -3.742 1.00 0.00 H new ATOM 0 HA TYR A 48 4.795 -9.648 -4.859 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.629 -8.170 -5.247 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.815 -7.816 -3.541 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.503 -11.087 -5.388 1.00 0.00 H new ATOM 0 HD2 TYR A 48 8.913 -8.569 -2.869 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.151 -12.925 -5.139 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.581 -10.391 -2.637 1.00 0.00 H new ATOM 0 HH TYR A 48 11.129 -12.489 -3.170 1.00 0.00 H new ATOM 846 N MET B 1 2.054 -2.116 -21.205 1.00 0.00 N ATOM 847 CA MET B 1 2.848 -1.550 -20.100 1.00 0.00 C ATOM 848 C MET B 1 2.063 -1.605 -18.795 1.00 0.00 C ATOM 849 O MET B 1 0.838 -1.511 -18.818 1.00 0.00 O ATOM 850 CB MET B 1 3.261 -0.112 -20.429 1.00 0.00 C ATOM 851 CG MET B 1 4.188 0.461 -19.358 1.00 0.00 C ATOM 852 SD MET B 1 5.175 1.886 -19.892 1.00 0.00 S ATOM 853 CE MET B 1 3.857 3.021 -20.397 1.00 0.00 C ATOM 0 H1 MET B 1 2.055 -1.455 -22.008 1.00 0.00 H new ATOM 0 H2 MET B 1 2.469 -3.022 -21.502 1.00 0.00 H new ATOM 0 H3 MET B 1 1.076 -2.271 -20.886 1.00 0.00 H new ATOM 0 HA MET B 1 3.751 -2.147 -19.975 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.762 -0.088 -21.397 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.372 0.513 -20.515 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.588 0.754 -18.497 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.863 -0.326 -19.023 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.297 3.932 -20.804 1.00 0.00 H new ATOM 0 HE2 MET B 1 3.239 2.545 -21.159 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.241 3.270 -19.533 1.00 0.00 H new ATOM 865 N LEU B 2 2.763 -1.759 -17.666 1.00 0.00 N ATOM 866 CA LEU B 2 2.145 -1.778 -16.349 1.00 0.00 C ATOM 867 C LEU B 2 2.575 -0.525 -15.585 1.00 0.00 C ATOM 868 O LEU B 2 3.669 -0.473 -15.025 1.00 0.00 O ATOM 869 CB LEU B 2 2.548 -3.057 -15.599 1.00 0.00 C ATOM 870 CG LEU B 2 1.502 -3.550 -14.588 1.00 0.00 C ATOM 871 CD1 LEU B 2 2.181 -4.242 -13.416 1.00 0.00 C ATOM 872 CD2 LEU B 2 0.584 -2.476 -14.024 1.00 0.00 C ATOM 0 H LEU B 2 3.776 -1.874 -17.647 1.00 0.00 H new ATOM 0 HA LEU B 2 1.059 -1.778 -16.442 1.00 0.00 H new ATOM 0 HB2 LEU B 2 2.735 -3.847 -16.326 1.00 0.00 H new ATOM 0 HB3 LEU B 2 3.487 -2.877 -15.075 1.00 0.00 H new ATOM 0 HG LEU B 2 0.877 -4.232 -15.164 1.00 0.00 H new ATOM 0 HD11 LEU B 2 1.426 -4.585 -12.709 1.00 0.00 H new ATOM 0 HD12 LEU B 2 2.753 -5.096 -13.779 1.00 0.00 H new ATOM 0 HD13 LEU B 2 2.852 -3.541 -12.919 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -0.116 -2.928 -13.321 1.00 0.00 H new ATOM 0 HD22 LEU B 2 1.179 -1.722 -13.509 1.00 0.00 H new ATOM 0 HD23 LEU B 2 0.030 -2.007 -14.837 1.00 0.00 H new ATOM 884 N ILE B 3 1.710 0.489 -15.568 1.00 0.00 N ATOM 885 CA ILE B 3 1.991 1.756 -14.915 1.00 0.00 C ATOM 886 C ILE B 3 1.643 1.648 -13.434 1.00 0.00 C ATOM 887 O ILE B 3 0.705 0.945 -13.065 1.00 0.00 O ATOM 888 CB ILE B 3 1.169 2.866 -15.587 1.00 0.00 C ATOM 889 CG1 ILE B 3 1.597 3.075 -17.046 1.00 0.00 C ATOM 890 CG2 ILE B 3 1.368 4.195 -14.852 1.00 0.00 C ATOM 891 CD1 ILE B 3 0.943 2.087 -18.010 1.00 0.00 C ATOM 0 H ILE B 3 0.792 0.449 -16.010 1.00 0.00 H new ATOM 0 HA ILE B 3 3.049 2.000 -15.008 1.00 0.00 H new ATOM 0 HB ILE B 3 0.125 2.555 -15.550 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.345 4.091 -17.350 1.00 0.00 H new ATOM 0 HG13 ILE B 3 2.680 2.980 -17.118 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.779 4.972 -15.340 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.044 4.090 -13.817 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.423 4.470 -14.876 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.286 2.287 -19.025 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.216 1.070 -17.729 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -0.140 2.198 -17.965 1.00 0.00 H new ATOM 903 N LEU B 4 2.401 2.348 -12.584 1.00 0.00 N ATOM 904 CA LEU B 4 2.159 2.410 -11.151 1.00 0.00 C ATOM 905 C LEU B 4 2.495 3.816 -10.657 1.00 0.00 C ATOM 906 O LEU B 4 3.142 4.583 -11.367 1.00 0.00 O ATOM 907 CB LEU B 4 3.039 1.384 -10.425 1.00 0.00 C ATOM 908 CG LEU B 4 2.720 -0.069 -10.794 1.00 0.00 C ATOM 909 CD1 LEU B 4 3.743 -0.989 -10.136 1.00 0.00 C ATOM 910 CD2 LEU B 4 1.341 -0.483 -10.287 1.00 0.00 C ATOM 0 H LEU B 4 3.210 2.893 -12.883 1.00 0.00 H new ATOM 0 HA LEU B 4 1.113 2.182 -10.945 1.00 0.00 H new ATOM 0 HB2 LEU B 4 4.085 1.587 -10.655 1.00 0.00 H new ATOM 0 HB3 LEU B 4 2.919 1.512 -9.349 1.00 0.00 H new ATOM 0 HG LEU B 4 2.746 -0.149 -11.881 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.521 -2.024 -10.395 1.00 0.00 H new ATOM 0 HD12 LEU B 4 4.742 -0.733 -10.488 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.698 -0.868 -9.054 1.00 0.00 H new ATOM 0 HD21 LEU B 4 1.147 -1.519 -10.566 1.00 0.00 H new ATOM 0 HD22 LEU B 4 1.308 -0.387 -9.202 1.00 0.00 H new ATOM 0 HD23 LEU B 4 0.582 0.161 -10.731 1.00 0.00 H new ATOM 922 N THR B 5 2.057 4.158 -9.442 1.00 0.00 N ATOM 923 CA THR B 5 2.352 5.445 -8.823 1.00 0.00 C ATOM 924 C THR B 5 2.901 5.184 -7.424 1.00 0.00 C ATOM 925 O THR B 5 2.208 5.343 -6.422 1.00 0.00 O ATOM 926 CB THR B 5 1.102 6.333 -8.834 1.00 0.00 C ATOM 927 OG1 THR B 5 0.669 6.519 -10.164 1.00 0.00 O ATOM 928 CG2 THR B 5 1.388 7.713 -8.250 1.00 0.00 C ATOM 0 H THR B 5 1.486 3.544 -8.861 1.00 0.00 H new ATOM 0 HA THR B 5 3.110 5.992 -9.383 1.00 0.00 H new ATOM 0 HB THR B 5 0.343 5.834 -8.231 1.00 0.00 H new ATOM 0 HG1 THR B 5 -0.289 6.323 -10.227 1.00 0.00 H new ATOM 0 HG21 THR B 5 0.479 8.314 -8.274 1.00 0.00 H new ATOM 0 HG22 THR B 5 1.726 7.609 -7.219 1.00 0.00 H new ATOM 0 HG23 THR B 5 2.163 8.204 -8.839 1.00 0.00 H new ATOM 936 N ARG B 6 4.172 4.777 -7.368 1.00 0.00 N ATOM 937 CA ARG B 6 4.823 4.302 -6.154 1.00 0.00 C ATOM 938 C ARG B 6 5.170 5.464 -5.224 1.00 0.00 C ATOM 939 O ARG B 6 5.559 6.532 -5.691 1.00 0.00 O ATOM 940 CB ARG B 6 6.094 3.564 -6.588 1.00 0.00 C ATOM 941 CG ARG B 6 6.827 2.820 -5.470 1.00 0.00 C ATOM 942 CD ARG B 6 6.106 1.544 -5.027 1.00 0.00 C ATOM 943 NE ARG B 6 5.121 1.789 -3.970 1.00 0.00 N ATOM 944 CZ ARG B 6 3.813 1.534 -4.042 1.00 0.00 C ATOM 945 NH1 ARG B 6 3.252 1.095 -5.168 1.00 0.00 N ATOM 946 NH2 ARG B 6 3.059 1.724 -2.965 1.00 0.00 N ATOM 0 H ARG B 6 4.785 4.770 -8.183 1.00 0.00 H new ATOM 0 HA ARG B 6 4.157 3.641 -5.599 1.00 0.00 H new ATOM 0 HB2 ARG B 6 5.832 2.849 -7.368 1.00 0.00 H new ATOM 0 HB3 ARG B 6 6.780 4.285 -7.034 1.00 0.00 H new ATOM 0 HG2 ARG B 6 7.831 2.564 -5.809 1.00 0.00 H new ATOM 0 HG3 ARG B 6 6.939 3.483 -4.613 1.00 0.00 H new ATOM 0 HD2 ARG B 6 5.607 1.097 -5.887 1.00 0.00 H new ATOM 0 HD3 ARG B 6 6.841 0.821 -4.673 1.00 0.00 H new ATOM 0 HE ARG B 6 5.467 2.192 -3.099 1.00 0.00 H new ATOM 0 HH11 ARG B 6 3.825 0.947 -5.999 1.00 0.00 H new ATOM 0 HH12 ARG B 6 2.250 0.907 -5.199 1.00 0.00 H new ATOM 0 HH21 ARG B 6 3.481 2.060 -2.100 1.00 0.00 H new ATOM 0 HH22 ARG B 6 2.058 1.534 -3.003 1.00 0.00 H new ATOM 960 N LYS B 7 5.033 5.264 -3.908 1.00 0.00 N ATOM 961 CA LYS B 7 5.480 6.245 -2.924 1.00 0.00 C ATOM 962 C LYS B 7 7.004 6.175 -2.861 1.00 0.00 C ATOM 963 O LYS B 7 7.575 5.087 -2.910 1.00 0.00 O ATOM 964 CB LYS B 7 4.897 5.937 -1.537 1.00 0.00 C ATOM 965 CG LYS B 7 3.415 6.300 -1.367 1.00 0.00 C ATOM 966 CD LYS B 7 2.476 5.424 -2.200 1.00 0.00 C ATOM 967 CE LYS B 7 1.009 5.707 -1.865 1.00 0.00 C ATOM 968 NZ LYS B 7 0.657 5.276 -0.497 1.00 0.00 N ATOM 0 H LYS B 7 4.614 4.427 -3.503 1.00 0.00 H new ATOM 0 HA LYS B 7 5.142 7.239 -3.217 1.00 0.00 H new ATOM 0 HB2 LYS B 7 5.022 4.873 -1.334 1.00 0.00 H new ATOM 0 HB3 LYS B 7 5.477 6.475 -0.787 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.145 6.211 -0.315 1.00 0.00 H new ATOM 0 HG3 LYS B 7 3.270 7.344 -1.646 1.00 0.00 H new ATOM 0 HD2 LYS B 7 2.651 5.606 -3.260 1.00 0.00 H new ATOM 0 HD3 LYS B 7 2.697 4.373 -2.016 1.00 0.00 H new ATOM 0 HE2 LYS B 7 0.813 6.774 -1.970 1.00 0.00 H new ATOM 0 HE3 LYS B 7 0.369 5.194 -2.582 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -0.378 5.247 -0.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 1.048 4.329 -0.320 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 1.052 5.948 0.191 1.00 0.00 H new ATOM 982 N VAL B 8 7.680 7.323 -2.750 1.00 0.00 N ATOM 983 CA VAL B 8 9.136 7.323 -2.698 1.00 0.00 C ATOM 984 C VAL B 8 9.623 6.539 -1.486 1.00 0.00 C ATOM 985 O VAL B 8 8.938 6.435 -0.470 1.00 0.00 O ATOM 986 CB VAL B 8 9.692 8.746 -2.690 1.00 0.00 C ATOM 987 CG1 VAL B 8 9.321 9.411 -4.011 1.00 0.00 C ATOM 988 CG2 VAL B 8 9.182 9.612 -1.540 1.00 0.00 C ATOM 0 H VAL B 8 7.248 8.245 -2.696 1.00 0.00 H new ATOM 0 HA VAL B 8 9.507 6.833 -3.598 1.00 0.00 H new ATOM 0 HB VAL B 8 10.770 8.664 -2.554 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.709 10.430 -4.027 1.00 0.00 H new ATOM 0 HG12 VAL B 8 9.753 8.845 -4.837 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.236 9.434 -4.115 1.00 0.00 H new ATOM 0 HG21 VAL B 8 9.625 10.606 -1.608 1.00 0.00 H new ATOM 0 HG22 VAL B 8 8.097 9.694 -1.600 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.460 9.156 -0.590 1.00 0.00 H new ATOM 998 N GLY B 9 10.829 5.989 -1.619 1.00 0.00 N ATOM 999 CA GLY B 9 11.457 5.167 -0.599 1.00 0.00 C ATOM 1000 C GLY B 9 10.984 3.711 -0.650 1.00 0.00 C ATOM 1001 O GLY B 9 11.571 2.857 0.012 1.00 0.00 O ATOM 0 H GLY B 9 11.402 6.107 -2.454 1.00 0.00 H new ATOM 0 HA2 GLY B 9 12.539 5.199 -0.726 1.00 0.00 H new ATOM 0 HA3 GLY B 9 11.238 5.583 0.385 1.00 0.00 H new ATOM 1005 N GLU B 10 9.933 3.413 -1.425 1.00 0.00 N ATOM 1006 CA GLU B 10 9.467 2.044 -1.616 1.00 0.00 C ATOM 1007 C GLU B 10 10.090 1.464 -2.886 1.00 0.00 C ATOM 1008 O GLU B 10 10.951 2.097 -3.498 1.00 0.00 O ATOM 1009 CB GLU B 10 7.937 2.003 -1.668 1.00 0.00 C ATOM 1010 CG GLU B 10 7.351 2.542 -0.362 1.00 0.00 C ATOM 1011 CD GLU B 10 5.844 2.305 -0.276 1.00 0.00 C ATOM 1012 OE1 GLU B 10 5.170 2.450 -1.320 1.00 0.00 O ATOM 1013 OE2 GLU B 10 5.375 1.981 0.838 1.00 0.00 O ATOM 0 H GLU B 10 9.389 4.112 -1.931 1.00 0.00 H new ATOM 0 HA GLU B 10 9.780 1.431 -0.771 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.578 2.597 -2.509 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.598 0.980 -1.833 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.843 2.061 0.483 1.00 0.00 H new ATOM 0 HG3 GLU B 10 7.556 3.610 -0.285 1.00 0.00 H new ATOM 1020 N SER B 11 9.671 0.263 -3.297 1.00 0.00 N ATOM 1021 CA SER B 11 10.250 -0.379 -4.470 1.00 0.00 C ATOM 1022 C SER B 11 9.210 -1.072 -5.341 1.00 0.00 C ATOM 1023 O SER B 11 8.059 -1.258 -4.946 1.00 0.00 O ATOM 1024 CB SER B 11 11.287 -1.416 -4.030 1.00 0.00 C ATOM 1025 OG SER B 11 12.296 -0.817 -3.246 1.00 0.00 O ATOM 0 H SER B 11 8.939 -0.277 -2.836 1.00 0.00 H new ATOM 0 HA SER B 11 10.710 0.411 -5.064 1.00 0.00 H new ATOM 0 HB2 SER B 11 10.798 -2.206 -3.459 1.00 0.00 H new ATOM 0 HB3 SER B 11 11.733 -1.885 -4.907 1.00 0.00 H new ATOM 0 HG SER B 11 13.145 -0.835 -3.735 1.00 0.00 H new ATOM 1031 N ILE B 12 9.653 -1.451 -6.542 1.00 0.00 N ATOM 1032 CA ILE B 12 8.928 -2.275 -7.496 1.00 0.00 C ATOM 1033 C ILE B 12 9.809 -3.495 -7.762 1.00 0.00 C ATOM 1034 O ILE B 12 10.986 -3.489 -7.401 1.00 0.00 O ATOM 1035 CB ILE B 12 8.649 -1.465 -8.774 1.00 0.00 C ATOM 1036 CG1 ILE B 12 7.820 -0.204 -8.491 1.00 0.00 C ATOM 1037 CG2 ILE B 12 7.943 -2.303 -9.844 1.00 0.00 C ATOM 1038 CD1 ILE B 12 6.435 -0.514 -7.922 1.00 0.00 C ATOM 0 H ILE B 12 10.572 -1.175 -6.887 1.00 0.00 H new ATOM 0 HA ILE B 12 7.957 -2.595 -7.117 1.00 0.00 H new ATOM 0 HB ILE B 12 9.626 -1.164 -9.151 1.00 0.00 H new ATOM 0 HG12 ILE B 12 8.361 0.430 -7.789 1.00 0.00 H new ATOM 0 HG13 ILE B 12 7.708 0.365 -9.414 1.00 0.00 H new ATOM 0 HG21 ILE B 12 7.766 -1.690 -10.728 1.00 0.00 H new ATOM 0 HG22 ILE B 12 8.569 -3.154 -10.112 1.00 0.00 H new ATOM 0 HG23 ILE B 12 6.990 -2.662 -9.455 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.898 0.418 -7.743 1.00 0.00 H new ATOM 0 HD12 ILE B 12 5.877 -1.123 -8.633 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.541 -1.058 -6.983 1.00 0.00 H new ATOM 1050 N ASN B 13 9.271 -4.543 -8.385 1.00 0.00 N ATOM 1051 CA ASN B 13 10.042 -5.745 -8.647 1.00 0.00 C ATOM 1052 C ASN B 13 9.724 -6.289 -10.038 1.00 0.00 C ATOM 1053 O ASN B 13 8.632 -6.061 -10.556 1.00 0.00 O ATOM 1054 CB ASN B 13 9.715 -6.767 -7.556 1.00 0.00 C ATOM 1055 CG ASN B 13 10.812 -7.810 -7.433 1.00 0.00 C ATOM 1056 OD1 ASN B 13 10.719 -8.898 -7.992 1.00 0.00 O ATOM 1057 ND2 ASN B 13 11.861 -7.469 -6.693 1.00 0.00 N ATOM 0 H ASN B 13 8.306 -4.578 -8.715 1.00 0.00 H new ATOM 0 HA ASN B 13 11.109 -5.525 -8.627 1.00 0.00 H new ATOM 0 HB2 ASN B 13 9.587 -6.256 -6.602 1.00 0.00 H new ATOM 0 HB3 ASN B 13 8.768 -7.256 -7.785 1.00 0.00 H new ATOM 0 HD21 ASN B 13 12.633 -8.124 -6.571 1.00 0.00 H new ATOM 0 HD22 ASN B 13 11.894 -6.552 -6.247 1.00 0.00 H new ATOM 1064 N ILE B 14 10.677 -7.006 -10.639 1.00 0.00 N ATOM 1065 CA ILE B 14 10.508 -7.606 -11.955 1.00 0.00 C ATOM 1066 C ILE B 14 11.134 -8.999 -11.957 1.00 0.00 C ATOM 1067 O ILE B 14 12.176 -9.218 -11.337 1.00 0.00 O ATOM 1068 CB ILE B 14 11.148 -6.720 -13.038 1.00 0.00 C ATOM 1069 CG1 ILE B 14 10.609 -5.285 -12.955 1.00 0.00 C ATOM 1070 CG2 ILE B 14 10.856 -7.311 -14.422 1.00 0.00 C ATOM 1071 CD1 ILE B 14 11.279 -4.355 -13.966 1.00 0.00 C ATOM 0 H ILE B 14 11.590 -7.185 -10.220 1.00 0.00 H new ATOM 0 HA ILE B 14 9.445 -7.691 -12.179 1.00 0.00 H new ATOM 0 HB ILE B 14 12.225 -6.690 -12.875 1.00 0.00 H new ATOM 0 HG12 ILE B 14 9.533 -5.293 -13.129 1.00 0.00 H new ATOM 0 HG13 ILE B 14 10.766 -4.898 -11.948 1.00 0.00 H new ATOM 0 HG21 ILE B 14 11.310 -6.683 -15.189 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.272 -8.317 -14.483 1.00 0.00 H new ATOM 0 HG23 ILE B 14 9.778 -7.354 -14.579 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.864 -3.352 -13.868 1.00 0.00 H new ATOM 0 HD12 ILE B 14 12.352 -4.324 -13.776 1.00 0.00 H new ATOM 0 HD13 ILE B 14 11.099 -4.725 -14.975 1.00 0.00 H new ATOM 1083 N GLY B 15 10.492 -9.936 -12.659 1.00 0.00 N ATOM 1084 CA GLY B 15 10.933 -11.319 -12.732 1.00 0.00 C ATOM 1085 C GLY B 15 11.002 -11.924 -11.334 1.00 0.00 C ATOM 1086 O GLY B 15 9.981 -12.057 -10.662 1.00 0.00 O ATOM 0 H GLY B 15 9.645 -9.748 -13.195 1.00 0.00 H new ATOM 0 HA2 GLY B 15 10.246 -11.895 -13.352 1.00 0.00 H new ATOM 0 HA3 GLY B 15 11.912 -11.371 -13.208 1.00 0.00 H new ATOM 1090 N ASP B 16 12.211 -12.291 -10.903 1.00 0.00 N ATOM 1091 CA ASP B 16 12.444 -12.844 -9.576 1.00 0.00 C ATOM 1092 C ASP B 16 13.794 -12.387 -9.014 1.00 0.00 C ATOM 1093 O ASP B 16 14.185 -12.808 -7.926 1.00 0.00 O ATOM 1094 CB ASP B 16 12.366 -14.370 -9.665 1.00 0.00 C ATOM 1095 CG ASP B 16 12.398 -15.031 -8.289 1.00 0.00 C ATOM 1096 OD1 ASP B 16 11.542 -14.667 -7.451 1.00 0.00 O ATOM 1097 OD2 ASP B 16 13.278 -15.896 -8.084 1.00 0.00 O ATOM 0 H ASP B 16 13.055 -12.211 -11.470 1.00 0.00 H new ATOM 0 HA ASP B 16 11.680 -12.480 -8.889 1.00 0.00 H new ATOM 0 HB2 ASP B 16 11.450 -14.656 -10.182 1.00 0.00 H new ATOM 0 HB3 ASP B 16 13.198 -14.740 -10.263 1.00 0.00 H new ATOM 1102 N ASP B 17 14.516 -11.527 -9.744 1.00 0.00 N ATOM 1103 CA ASP B 17 15.864 -11.119 -9.366 1.00 0.00 C ATOM 1104 C ASP B 17 16.113 -9.622 -9.568 1.00 0.00 C ATOM 1105 O ASP B 17 17.219 -9.155 -9.303 1.00 0.00 O ATOM 1106 CB ASP B 17 16.880 -11.926 -10.178 1.00 0.00 C ATOM 1107 CG ASP B 17 16.787 -13.422 -9.889 1.00 0.00 C ATOM 1108 OD1 ASP B 17 17.328 -13.840 -8.841 1.00 0.00 O ATOM 1109 OD2 ASP B 17 16.176 -14.133 -10.718 1.00 0.00 O ATOM 0 H ASP B 17 14.180 -11.100 -10.607 1.00 0.00 H new ATOM 0 HA ASP B 17 15.977 -11.317 -8.300 1.00 0.00 H new ATOM 0 HB2 ASP B 17 16.715 -11.752 -11.241 1.00 0.00 H new ATOM 0 HB3 ASP B 17 17.886 -11.575 -9.950 1.00 0.00 H new ATOM 1114 N ILE B 18 15.115 -8.857 -10.028 1.00 0.00 N ATOM 1115 CA ILE B 18 15.306 -7.435 -10.285 1.00 0.00 C ATOM 1116 C ILE B 18 14.382 -6.608 -9.398 1.00 0.00 C ATOM 1117 O ILE B 18 13.203 -6.928 -9.260 1.00 0.00 O ATOM 1118 CB ILE B 18 15.073 -7.116 -11.770 1.00 0.00 C ATOM 1119 CG1 ILE B 18 16.047 -7.873 -12.679 1.00 0.00 C ATOM 1120 CG2 ILE B 18 15.256 -5.615 -12.011 1.00 0.00 C ATOM 1121 CD1 ILE B 18 15.465 -9.218 -13.114 1.00 0.00 C ATOM 0 H ILE B 18 14.176 -9.201 -10.227 1.00 0.00 H new ATOM 0 HA ILE B 18 16.336 -7.174 -10.044 1.00 0.00 H new ATOM 0 HB ILE B 18 14.057 -7.428 -12.012 1.00 0.00 H new ATOM 0 HG12 ILE B 18 16.272 -7.269 -13.558 1.00 0.00 H new ATOM 0 HG13 ILE B 18 16.988 -8.034 -12.154 1.00 0.00 H new ATOM 0 HG21 ILE B 18 15.090 -5.393 -13.065 1.00 0.00 H new ATOM 0 HG22 ILE B 18 14.540 -5.059 -11.406 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.269 -5.323 -11.734 1.00 0.00 H new ATOM 0 HD11 ILE B 18 16.179 -9.732 -13.758 1.00 0.00 H new ATOM 0 HD12 ILE B 18 15.264 -9.829 -12.234 1.00 0.00 H new ATOM 0 HD13 ILE B 18 14.536 -9.053 -13.661 1.00 0.00 H new ATOM 1133 N THR B 19 14.926 -5.544 -8.797 1.00 0.00 N ATOM 1134 CA THR B 19 14.178 -4.657 -7.918 1.00 0.00 C ATOM 1135 C THR B 19 14.444 -3.213 -8.319 1.00 0.00 C ATOM 1136 O THR B 19 15.574 -2.858 -8.647 1.00 0.00 O ATOM 1137 CB THR B 19 14.597 -4.903 -6.465 1.00 0.00 C ATOM 1138 OG1 THR B 19 14.515 -6.278 -6.159 1.00 0.00 O ATOM 1139 CG2 THR B 19 13.686 -4.145 -5.503 1.00 0.00 C ATOM 0 H THR B 19 15.904 -5.278 -8.912 1.00 0.00 H new ATOM 0 HA THR B 19 13.110 -4.855 -8.008 1.00 0.00 H new ATOM 0 HB THR B 19 15.623 -4.552 -6.353 1.00 0.00 H new ATOM 0 HG1 THR B 19 14.787 -6.423 -5.229 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.002 -4.334 -4.477 1.00 0.00 H new ATOM 0 HG22 THR B 19 13.747 -3.077 -5.710 1.00 0.00 H new ATOM 0 HG23 THR B 19 12.658 -4.482 -5.634 1.00 0.00 H new ATOM 1147 N ILE B 20 13.401 -2.379 -8.295 1.00 0.00 N ATOM 1148 CA ILE B 20 13.487 -0.985 -8.710 1.00 0.00 C ATOM 1149 C ILE B 20 13.059 -0.082 -7.554 1.00 0.00 C ATOM 1150 O ILE B 20 11.880 0.238 -7.411 1.00 0.00 O ATOM 1151 CB ILE B 20 12.624 -0.742 -9.958 1.00 0.00 C ATOM 1152 CG1 ILE B 20 12.805 -1.811 -11.045 1.00 0.00 C ATOM 1153 CG2 ILE B 20 12.928 0.646 -10.523 1.00 0.00 C ATOM 1154 CD1 ILE B 20 14.220 -1.865 -11.617 1.00 0.00 C ATOM 0 H ILE B 20 12.470 -2.658 -7.985 1.00 0.00 H new ATOM 0 HA ILE B 20 14.518 -0.747 -8.972 1.00 0.00 H new ATOM 0 HB ILE B 20 11.582 -0.805 -9.643 1.00 0.00 H new ATOM 0 HG12 ILE B 20 12.552 -2.787 -10.630 1.00 0.00 H new ATOM 0 HG13 ILE B 20 12.101 -1.617 -11.855 1.00 0.00 H new ATOM 0 HG21 ILE B 20 12.317 0.820 -11.408 1.00 0.00 H new ATOM 0 HG22 ILE B 20 12.702 1.402 -9.771 1.00 0.00 H new ATOM 0 HG23 ILE B 20 13.982 0.706 -10.792 1.00 0.00 H new ATOM 0 HD11 ILE B 20 14.275 -2.642 -12.379 1.00 0.00 H new ATOM 0 HD12 ILE B 20 14.469 -0.902 -12.062 1.00 0.00 H new ATOM 0 HD13 ILE B 20 14.927 -2.089 -10.818 1.00 0.00 H new ATOM 1166 N THR B 21 14.021 0.330 -6.725 1.00 0.00 N ATOM 1167 CA THR B 21 13.757 1.170 -5.563 1.00 0.00 C ATOM 1168 C THR B 21 13.713 2.642 -5.963 1.00 0.00 C ATOM 1169 O THR B 21 14.725 3.201 -6.381 1.00 0.00 O ATOM 1170 CB THR B 21 14.846 0.948 -4.511 1.00 0.00 C ATOM 1171 OG1 THR B 21 14.953 -0.428 -4.221 1.00 0.00 O ATOM 1172 CG2 THR B 21 14.503 1.686 -3.216 1.00 0.00 C ATOM 0 H THR B 21 15.005 0.088 -6.844 1.00 0.00 H new ATOM 0 HA THR B 21 12.788 0.897 -5.146 1.00 0.00 H new ATOM 0 HB THR B 21 15.786 1.329 -4.910 1.00 0.00 H new ATOM 0 HG1 THR B 21 15.652 -0.567 -3.548 1.00 0.00 H new ATOM 0 HG21 THR B 21 15.289 1.516 -2.481 1.00 0.00 H new ATOM 0 HG22 THR B 21 14.419 2.754 -3.417 1.00 0.00 H new ATOM 0 HG23 THR B 21 13.555 1.315 -2.826 1.00 0.00 H new ATOM 1180 N ILE B 22 12.544 3.280 -5.838 1.00 0.00 N ATOM 1181 CA ILE B 22 12.422 4.713 -6.063 1.00 0.00 C ATOM 1182 C ILE B 22 13.059 5.434 -4.874 1.00 0.00 C ATOM 1183 O ILE B 22 12.493 5.474 -3.785 1.00 0.00 O ATOM 1184 CB ILE B 22 10.952 5.110 -6.295 1.00 0.00 C ATOM 1185 CG1 ILE B 22 10.770 6.633 -6.278 1.00 0.00 C ATOM 1186 CG2 ILE B 22 9.996 4.491 -5.271 1.00 0.00 C ATOM 1187 CD1 ILE B 22 11.571 7.309 -7.389 1.00 0.00 C ATOM 0 H ILE B 22 11.671 2.820 -5.581 1.00 0.00 H new ATOM 0 HA ILE B 22 12.949 5.009 -6.970 1.00 0.00 H new ATOM 0 HB ILE B 22 10.701 4.717 -7.280 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.713 6.875 -6.392 1.00 0.00 H new ATOM 0 HG13 ILE B 22 11.084 7.027 -5.311 1.00 0.00 H new ATOM 0 HG21 ILE B 22 8.976 4.808 -5.488 1.00 0.00 H new ATOM 0 HG22 ILE B 22 10.058 3.404 -5.326 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.273 4.820 -4.269 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.417 8.387 -7.345 1.00 0.00 H new ATOM 0 HD12 ILE B 22 12.631 7.089 -7.259 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.238 6.934 -8.357 1.00 0.00 H new ATOM 1199 N LEU B 23 14.246 6.008 -5.079 1.00 0.00 N ATOM 1200 CA LEU B 23 14.983 6.646 -3.996 1.00 0.00 C ATOM 1201 C LEU B 23 14.316 7.970 -3.639 1.00 0.00 C ATOM 1202 O LEU B 23 14.433 8.442 -2.509 1.00 0.00 O ATOM 1203 CB LEU B 23 16.453 6.848 -4.382 1.00 0.00 C ATOM 1204 CG LEU B 23 17.116 5.551 -4.872 1.00 0.00 C ATOM 1205 CD1 LEU B 23 18.627 5.748 -4.955 1.00 0.00 C ATOM 1206 CD2 LEU B 23 16.850 4.385 -3.925 1.00 0.00 C ATOM 0 H LEU B 23 14.714 6.042 -5.985 1.00 0.00 H new ATOM 0 HA LEU B 23 14.965 5.998 -3.119 1.00 0.00 H new ATOM 0 HB2 LEU B 23 16.519 7.604 -5.164 1.00 0.00 H new ATOM 0 HB3 LEU B 23 17.002 7.230 -3.522 1.00 0.00 H new ATOM 0 HG LEU B 23 16.692 5.321 -5.849 1.00 0.00 H new ATOM 0 HD11 LEU B 23 19.095 4.827 -5.303 1.00 0.00 H new ATOM 0 HD12 LEU B 23 18.851 6.555 -5.653 1.00 0.00 H new ATOM 0 HD13 LEU B 23 19.015 6.003 -3.969 1.00 0.00 H new ATOM 0 HD21 LEU B 23 17.336 3.487 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU B 23 17.248 4.620 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU B 23 15.776 4.213 -3.852 1.00 0.00 H new ATOM 1218 N GLY B 24 13.615 8.562 -4.610 1.00 0.00 N ATOM 1219 CA GLY B 24 12.720 9.677 -4.364 1.00 0.00 C ATOM 1220 C GLY B 24 12.751 10.739 -5.454 1.00 0.00 C ATOM 1221 O GLY B 24 13.589 10.717 -6.354 1.00 0.00 O ATOM 0 H GLY B 24 13.658 8.275 -5.588 1.00 0.00 H new ATOM 0 HA2 GLY B 24 11.702 9.300 -4.266 1.00 0.00 H new ATOM 0 HA3 GLY B 24 12.982 10.138 -3.412 1.00 0.00 H new ATOM 1225 N VAL B 25 11.806 11.674 -5.344 1.00 0.00 N ATOM 1226 CA VAL B 25 11.652 12.793 -6.257 1.00 0.00 C ATOM 1227 C VAL B 25 12.820 13.766 -6.095 1.00 0.00 C ATOM 1228 O VAL B 25 13.382 13.903 -5.009 1.00 0.00 O ATOM 1229 CB VAL B 25 10.290 13.458 -5.998 1.00 0.00 C ATOM 1230 CG1 VAL B 25 10.079 13.798 -4.519 1.00 0.00 C ATOM 1231 CG2 VAL B 25 10.128 14.728 -6.830 1.00 0.00 C ATOM 0 H VAL B 25 11.112 11.668 -4.596 1.00 0.00 H new ATOM 0 HA VAL B 25 11.670 12.451 -7.292 1.00 0.00 H new ATOM 0 HB VAL B 25 9.536 12.728 -6.294 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.103 14.265 -4.389 1.00 0.00 H new ATOM 0 HG12 VAL B 25 10.126 12.885 -3.925 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.858 14.486 -4.189 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.155 15.176 -6.625 1.00 0.00 H new ATOM 0 HG22 VAL B 25 10.915 15.436 -6.570 1.00 0.00 H new ATOM 0 HG23 VAL B 25 10.198 14.480 -7.889 1.00 0.00 H new ATOM 1241 N SER B 26 13.178 14.441 -7.190 1.00 0.00 N ATOM 1242 CA SER B 26 14.269 15.404 -7.245 1.00 0.00 C ATOM 1243 C SER B 26 13.849 16.574 -8.131 1.00 0.00 C ATOM 1244 O SER B 26 14.604 17.010 -9.000 1.00 0.00 O ATOM 1245 CB SER B 26 15.533 14.730 -7.788 1.00 0.00 C ATOM 1246 OG SER B 26 15.876 13.611 -6.996 1.00 0.00 O ATOM 0 H SER B 26 12.701 14.326 -8.084 1.00 0.00 H new ATOM 0 HA SER B 26 14.491 15.777 -6.245 1.00 0.00 H new ATOM 0 HB2 SER B 26 15.371 14.417 -8.819 1.00 0.00 H new ATOM 0 HB3 SER B 26 16.357 15.443 -7.797 1.00 0.00 H new ATOM 0 HG SER B 26 16.684 13.190 -7.357 1.00 0.00 H new ATOM 1252 N GLY B 27 12.635 17.082 -7.910 1.00 0.00 N ATOM 1253 CA GLY B 27 12.073 18.138 -8.735 1.00 0.00 C ATOM 1254 C GLY B 27 11.652 17.557 -10.079 1.00 0.00 C ATOM 1255 O GLY B 27 10.997 16.517 -10.130 1.00 0.00 O ATOM 0 H GLY B 27 12.021 16.771 -7.157 1.00 0.00 H new ATOM 0 HA2 GLY B 27 11.215 18.588 -8.235 1.00 0.00 H new ATOM 0 HA3 GLY B 27 12.807 18.930 -8.882 1.00 0.00 H new ATOM 1259 N GLN B 28 12.028 18.227 -11.170 1.00 0.00 N ATOM 1260 CA GLN B 28 11.775 17.742 -12.518 1.00 0.00 C ATOM 1261 C GLN B 28 12.586 16.473 -12.811 1.00 0.00 C ATOM 1262 O GLN B 28 12.420 15.860 -13.865 1.00 0.00 O ATOM 1263 CB GLN B 28 12.113 18.859 -13.512 1.00 0.00 C ATOM 1264 CG GLN B 28 11.385 18.679 -14.846 1.00 0.00 C ATOM 1265 CD GLN B 28 9.868 18.716 -14.685 1.00 0.00 C ATOM 1266 OE1 GLN B 28 9.160 17.891 -15.255 1.00 0.00 O ATOM 1267 NE2 GLN B 28 9.349 19.668 -13.912 1.00 0.00 N ATOM 0 H GLN B 28 12.517 19.122 -11.138 1.00 0.00 H new ATOM 0 HA GLN B 28 10.723 17.474 -12.617 1.00 0.00 H new ATOM 0 HB2 GLN B 28 11.844 19.823 -13.079 1.00 0.00 H new ATOM 0 HB3 GLN B 28 13.189 18.876 -13.686 1.00 0.00 H new ATOM 0 HG2 GLN B 28 11.695 19.464 -15.536 1.00 0.00 H new ATOM 0 HG3 GLN B 28 11.678 17.729 -15.293 1.00 0.00 H new ATOM 0 HE21 GLN B 28 9.961 20.340 -13.450 1.00 0.00 H new ATOM 0 HE22 GLN B 28 8.339 19.725 -13.781 1.00 0.00 H new ATOM 1276 N GLN B 29 13.464 16.075 -11.880 1.00 0.00 N ATOM 1277 CA GLN B 29 14.265 14.869 -12.018 1.00 0.00 C ATOM 1278 C GLN B 29 13.820 13.841 -10.978 1.00 0.00 C ATOM 1279 O GLN B 29 13.095 14.175 -10.043 1.00 0.00 O ATOM 1280 CB GLN B 29 15.760 15.201 -11.911 1.00 0.00 C ATOM 1281 CG GLN B 29 16.092 16.456 -12.726 1.00 0.00 C ATOM 1282 CD GLN B 29 17.590 16.664 -12.879 1.00 0.00 C ATOM 1283 OE1 GLN B 29 18.070 16.951 -13.971 1.00 0.00 O ATOM 1284 NE2 GLN B 29 18.346 16.524 -11.797 1.00 0.00 N ATOM 0 H GLN B 29 13.633 16.586 -11.013 1.00 0.00 H new ATOM 0 HA GLN B 29 14.111 14.433 -13.005 1.00 0.00 H new ATOM 0 HB2 GLN B 29 16.030 15.357 -10.866 1.00 0.00 H new ATOM 0 HB3 GLN B 29 16.352 14.360 -12.271 1.00 0.00 H new ATOM 0 HG2 GLN B 29 15.636 16.377 -13.713 1.00 0.00 H new ATOM 0 HG3 GLN B 29 15.654 17.328 -12.241 1.00 0.00 H new ATOM 0 HE21 GLN B 29 17.917 16.285 -10.903 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.356 16.656 -11.860 1.00 0.00 H new ATOM 1293 N VAL B 30 14.251 12.588 -11.135 1.00 0.00 N ATOM 1294 CA VAL B 30 13.830 11.499 -10.262 1.00 0.00 C ATOM 1295 C VAL B 30 14.970 10.506 -10.076 1.00 0.00 C ATOM 1296 O VAL B 30 15.405 9.878 -11.039 1.00 0.00 O ATOM 1297 CB VAL B 30 12.620 10.778 -10.868 1.00 0.00 C ATOM 1298 CG1 VAL B 30 12.216 9.602 -9.981 1.00 0.00 C ATOM 1299 CG2 VAL B 30 11.418 11.713 -10.999 1.00 0.00 C ATOM 0 H VAL B 30 14.899 12.304 -11.869 1.00 0.00 H new ATOM 0 HA VAL B 30 13.554 11.916 -9.293 1.00 0.00 H new ATOM 0 HB VAL B 30 12.911 10.431 -11.859 1.00 0.00 H new ATOM 0 HG11 VAL B 30 11.356 9.095 -10.418 1.00 0.00 H new ATOM 0 HG12 VAL B 30 13.048 8.903 -9.903 1.00 0.00 H new ATOM 0 HG13 VAL B 30 11.955 9.968 -8.988 1.00 0.00 H new ATOM 0 HG21 VAL B 30 10.579 11.168 -11.432 1.00 0.00 H new ATOM 0 HG22 VAL B 30 11.139 12.087 -10.014 1.00 0.00 H new ATOM 0 HG23 VAL B 30 11.678 12.552 -11.645 1.00 0.00 H new ATOM 1309 N ARG B 31 15.462 10.354 -8.844 1.00 0.00 N ATOM 1310 CA ARG B 31 16.502 9.377 -8.568 1.00 0.00 C ATOM 1311 C ARG B 31 15.883 8.004 -8.320 1.00 0.00 C ATOM 1312 O ARG B 31 15.153 7.810 -7.348 1.00 0.00 O ATOM 1313 CB ARG B 31 17.348 9.825 -7.378 1.00 0.00 C ATOM 1314 CG ARG B 31 18.491 8.828 -7.194 1.00 0.00 C ATOM 1315 CD ARG B 31 19.433 9.277 -6.080 1.00 0.00 C ATOM 1316 NE ARG B 31 20.233 10.431 -6.505 1.00 0.00 N ATOM 1317 CZ ARG B 31 21.430 10.747 -6.001 1.00 0.00 C ATOM 1318 NH1 ARG B 31 21.970 10.036 -5.017 1.00 0.00 N ATOM 1319 NH2 ARG B 31 22.107 11.786 -6.478 1.00 0.00 N ATOM 0 H ARG B 31 15.157 10.892 -8.033 1.00 0.00 H new ATOM 0 HA ARG B 31 17.157 9.301 -9.436 1.00 0.00 H new ATOM 0 HB2 ARG B 31 17.743 10.826 -7.549 1.00 0.00 H new ATOM 0 HB3 ARG B 31 16.738 9.873 -6.476 1.00 0.00 H new ATOM 0 HG2 ARG B 31 18.086 7.844 -6.958 1.00 0.00 H new ATOM 0 HG3 ARG B 31 19.046 8.729 -8.127 1.00 0.00 H new ATOM 0 HD2 ARG B 31 18.856 9.536 -5.193 1.00 0.00 H new ATOM 0 HD3 ARG B 31 20.092 8.455 -5.802 1.00 0.00 H new ATOM 0 HE ARG B 31 19.850 11.033 -7.234 1.00 0.00 H new ATOM 0 HH11 ARG B 31 21.470 9.234 -4.634 1.00 0.00 H new ATOM 0 HH12 ARG B 31 22.885 10.292 -4.645 1.00 0.00 H new ATOM 0 HH21 ARG B 31 21.714 12.348 -7.233 1.00 0.00 H new ATOM 0 HH22 ARG B 31 23.020 12.022 -6.089 1.00 0.00 H new ATOM 1333 N ILE B 32 16.181 7.055 -9.211 1.00 0.00 N ATOM 1334 CA ILE B 32 15.737 5.671 -9.093 1.00 0.00 C ATOM 1335 C ILE B 32 16.958 4.756 -8.987 1.00 0.00 C ATOM 1336 O ILE B 32 18.019 5.069 -9.522 1.00 0.00 O ATOM 1337 CB ILE B 32 14.864 5.298 -10.301 1.00 0.00 C ATOM 1338 CG1 ILE B 32 13.729 6.320 -10.455 1.00 0.00 C ATOM 1339 CG2 ILE B 32 14.287 3.890 -10.121 1.00 0.00 C ATOM 1340 CD1 ILE B 32 12.810 6.008 -11.635 1.00 0.00 C ATOM 0 H ILE B 32 16.744 7.232 -10.043 1.00 0.00 H new ATOM 0 HA ILE B 32 15.134 5.549 -8.193 1.00 0.00 H new ATOM 0 HB ILE B 32 15.478 5.310 -11.202 1.00 0.00 H new ATOM 0 HG12 ILE B 32 13.140 6.344 -9.538 1.00 0.00 H new ATOM 0 HG13 ILE B 32 14.156 7.314 -10.586 1.00 0.00 H new ATOM 0 HG21 ILE B 32 13.670 3.637 -10.983 1.00 0.00 H new ATOM 0 HG22 ILE B 32 15.102 3.171 -10.034 1.00 0.00 H new ATOM 0 HG23 ILE B 32 13.678 3.859 -9.218 1.00 0.00 H new ATOM 0 HD11 ILE B 32 12.026 6.763 -11.695 1.00 0.00 H new ATOM 0 HD12 ILE B 32 13.389 6.012 -12.558 1.00 0.00 H new ATOM 0 HD13 ILE B 32 12.358 5.026 -11.494 1.00 0.00 H new ATOM 1352 N GLY B 33 16.800 3.625 -8.295 1.00 0.00 N ATOM 1353 CA GLY B 33 17.858 2.648 -8.090 1.00 0.00 C ATOM 1354 C GLY B 33 17.480 1.310 -8.714 1.00 0.00 C ATOM 1355 O GLY B 33 16.655 0.580 -8.167 1.00 0.00 O ATOM 0 H GLY B 33 15.917 3.364 -7.857 1.00 0.00 H new ATOM 0 HA2 GLY B 33 18.786 3.011 -8.530 1.00 0.00 H new ATOM 0 HA3 GLY B 33 18.040 2.519 -7.023 1.00 0.00 H new ATOM 1359 N ILE B 34 18.084 0.990 -9.862 1.00 0.00 N ATOM 1360 CA ILE B 34 17.807 -0.244 -10.579 1.00 0.00 C ATOM 1361 C ILE B 34 18.746 -1.329 -10.060 1.00 0.00 C ATOM 1362 O ILE B 34 19.956 -1.234 -10.243 1.00 0.00 O ATOM 1363 CB ILE B 34 18.013 -0.049 -12.087 1.00 0.00 C ATOM 1364 CG1 ILE B 34 17.021 0.949 -12.702 1.00 0.00 C ATOM 1365 CG2 ILE B 34 17.808 -1.397 -12.780 1.00 0.00 C ATOM 1366 CD1 ILE B 34 17.400 2.411 -12.447 1.00 0.00 C ATOM 0 H ILE B 34 18.778 1.584 -10.315 1.00 0.00 H new ATOM 0 HA ILE B 34 16.770 -0.536 -10.414 1.00 0.00 H new ATOM 0 HB ILE B 34 19.019 0.346 -12.229 1.00 0.00 H new ATOM 0 HG12 ILE B 34 16.963 0.778 -13.777 1.00 0.00 H new ATOM 0 HG13 ILE B 34 16.027 0.762 -12.295 1.00 0.00 H new ATOM 0 HG21 ILE B 34 17.950 -1.279 -13.854 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.530 -2.117 -12.395 1.00 0.00 H new ATOM 0 HG23 ILE B 34 16.798 -1.756 -12.585 1.00 0.00 H new ATOM 0 HD11 ILE B 34 16.659 3.065 -12.907 1.00 0.00 H new ATOM 0 HD12 ILE B 34 17.431 2.597 -11.373 1.00 0.00 H new ATOM 0 HD13 ILE B 34 18.380 2.613 -12.879 1.00 0.00 H new ATOM 1378 N ASN B 35 18.202 -2.361 -9.413 1.00 0.00 N ATOM 1379 CA ASN B 35 19.009 -3.424 -8.842 1.00 0.00 C ATOM 1380 C ASN B 35 18.742 -4.748 -9.548 1.00 0.00 C ATOM 1381 O ASN B 35 17.654 -5.308 -9.450 1.00 0.00 O ATOM 1382 CB ASN B 35 18.743 -3.519 -7.344 1.00 0.00 C ATOM 1383 CG ASN B 35 19.717 -4.478 -6.677 1.00 0.00 C ATOM 1384 OD1 ASN B 35 20.920 -4.228 -6.655 1.00 0.00 O ATOM 1385 ND2 ASN B 35 19.209 -5.579 -6.132 1.00 0.00 N ATOM 0 H ASN B 35 17.198 -2.477 -9.274 1.00 0.00 H new ATOM 0 HA ASN B 35 20.064 -3.192 -8.989 1.00 0.00 H new ATOM 0 HB2 ASN B 35 18.833 -2.531 -6.892 1.00 0.00 H new ATOM 0 HB3 ASN B 35 17.721 -3.856 -7.173 1.00 0.00 H new ATOM 0 HD21 ASN B 35 19.824 -6.252 -5.675 1.00 0.00 H new ATOM 0 HD22 ASN B 35 18.204 -5.751 -6.171 1.00 0.00 H new ATOM 1392 N ALA B 36 19.757 -5.234 -10.261 1.00 0.00 N ATOM 1393 CA ALA B 36 19.712 -6.478 -11.014 1.00 0.00 C ATOM 1394 C ALA B 36 21.074 -7.167 -10.921 1.00 0.00 C ATOM 1395 O ALA B 36 22.083 -6.496 -10.700 1.00 0.00 O ATOM 1396 CB ALA B 36 19.368 -6.149 -12.466 1.00 0.00 C ATOM 0 H ALA B 36 20.656 -4.757 -10.330 1.00 0.00 H new ATOM 0 HA ALA B 36 18.956 -7.151 -10.610 1.00 0.00 H new ATOM 0 HB1 ALA B 36 19.329 -7.070 -13.048 1.00 0.00 H new ATOM 0 HB2 ALA B 36 18.398 -5.653 -12.507 1.00 0.00 H new ATOM 0 HB3 ALA B 36 20.131 -5.490 -12.880 1.00 0.00 H new ATOM 1402 N PRO B 37 21.129 -8.494 -11.086 1.00 0.00 N ATOM 1403 CA PRO B 37 22.378 -9.234 -11.060 1.00 0.00 C ATOM 1404 C PRO B 37 23.161 -8.959 -12.339 1.00 0.00 C ATOM 1405 O PRO B 37 22.589 -8.542 -13.345 1.00 0.00 O ATOM 1406 CB PRO B 37 21.960 -10.702 -10.966 1.00 0.00 C ATOM 1407 CG PRO B 37 20.616 -10.724 -11.692 1.00 0.00 C ATOM 1408 CD PRO B 37 20.001 -9.379 -11.308 1.00 0.00 C ATOM 0 HA PRO B 37 23.025 -8.952 -10.230 1.00 0.00 H new ATOM 0 HB2 PRO B 37 22.687 -11.360 -11.442 1.00 0.00 H new ATOM 0 HB3 PRO B 37 21.865 -11.029 -9.931 1.00 0.00 H new ATOM 0 HG2 PRO B 37 20.741 -10.818 -12.771 1.00 0.00 H new ATOM 0 HG3 PRO B 37 19.995 -11.560 -11.369 1.00 0.00 H new ATOM 0 HD2 PRO B 37 19.354 -9.001 -12.100 1.00 0.00 H new ATOM 0 HD3 PRO B 37 19.388 -9.468 -10.411 1.00 0.00 H new ATOM 1416 N LYS B 38 24.476 -9.189 -12.316 1.00 0.00 N ATOM 1417 CA LYS B 38 25.312 -8.950 -13.486 1.00 0.00 C ATOM 1418 C LYS B 38 25.059 -9.992 -14.579 1.00 0.00 C ATOM 1419 O LYS B 38 25.697 -9.952 -15.629 1.00 0.00 O ATOM 1420 CB LYS B 38 26.783 -8.882 -13.071 1.00 0.00 C ATOM 1421 CG LYS B 38 26.963 -7.700 -12.110 1.00 0.00 C ATOM 1422 CD LYS B 38 28.435 -7.433 -11.789 1.00 0.00 C ATOM 1423 CE LYS B 38 29.179 -6.939 -13.031 1.00 0.00 C ATOM 1424 NZ LYS B 38 30.587 -6.631 -12.717 1.00 0.00 N ATOM 0 H LYS B 38 24.980 -9.539 -11.501 1.00 0.00 H new ATOM 0 HA LYS B 38 25.044 -7.987 -13.920 1.00 0.00 H new ATOM 0 HB2 LYS B 38 27.084 -9.812 -12.588 1.00 0.00 H new ATOM 0 HB3 LYS B 38 27.419 -8.758 -13.948 1.00 0.00 H new ATOM 0 HG2 LYS B 38 26.521 -6.806 -12.550 1.00 0.00 H new ATOM 0 HG3 LYS B 38 26.422 -7.901 -11.185 1.00 0.00 H new ATOM 0 HD2 LYS B 38 28.510 -6.690 -10.995 1.00 0.00 H new ATOM 0 HD3 LYS B 38 28.903 -8.345 -11.418 1.00 0.00 H new ATOM 0 HE2 LYS B 38 29.135 -7.698 -13.812 1.00 0.00 H new ATOM 0 HE3 LYS B 38 28.687 -6.049 -13.424 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 31.069 -6.298 -13.576 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 30.626 -5.890 -11.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 31.060 -7.488 -12.365 1.00 0.00 H new ATOM 1438 N ASP B 39 24.131 -10.922 -14.334 1.00 0.00 N ATOM 1439 CA ASP B 39 23.677 -11.885 -15.326 1.00 0.00 C ATOM 1440 C ASP B 39 22.813 -11.197 -16.382 1.00 0.00 C ATOM 1441 O ASP B 39 22.491 -11.799 -17.406 1.00 0.00 O ATOM 1442 CB ASP B 39 22.862 -12.972 -14.625 1.00 0.00 C ATOM 1443 CG ASP B 39 23.746 -13.846 -13.742 1.00 0.00 C ATOM 1444 OD1 ASP B 39 24.388 -14.766 -14.297 1.00 0.00 O ATOM 1445 OD2 ASP B 39 23.773 -13.590 -12.517 1.00 0.00 O ATOM 0 H ASP B 39 23.672 -11.023 -13.429 1.00 0.00 H new ATOM 0 HA ASP B 39 24.543 -12.326 -15.820 1.00 0.00 H new ATOM 0 HB2 ASP B 39 22.082 -12.511 -14.019 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.362 -13.592 -15.370 1.00 0.00 H new ATOM 1450 N VAL B 40 22.440 -9.936 -16.136 1.00 0.00 N ATOM 1451 CA VAL B 40 21.646 -9.129 -17.052 1.00 0.00 C ATOM 1452 C VAL B 40 22.272 -7.743 -17.176 1.00 0.00 C ATOM 1453 O VAL B 40 23.225 -7.419 -16.468 1.00 0.00 O ATOM 1454 CB VAL B 40 20.190 -9.041 -16.573 1.00 0.00 C ATOM 1455 CG1 VAL B 40 19.576 -10.431 -16.414 1.00 0.00 C ATOM 1456 CG2 VAL B 40 20.079 -8.347 -15.220 1.00 0.00 C ATOM 0 H VAL B 40 22.689 -9.445 -15.278 1.00 0.00 H new ATOM 0 HA VAL B 40 21.638 -9.600 -18.035 1.00 0.00 H new ATOM 0 HB VAL B 40 19.660 -8.468 -17.334 1.00 0.00 H new ATOM 0 HG11 VAL B 40 18.545 -10.336 -16.074 1.00 0.00 H new ATOM 0 HG12 VAL B 40 19.596 -10.949 -17.373 1.00 0.00 H new ATOM 0 HG13 VAL B 40 20.149 -11.000 -15.682 1.00 0.00 H new ATOM 0 HG21 VAL B 40 19.033 -8.305 -14.917 1.00 0.00 H new ATOM 0 HG22 VAL B 40 20.650 -8.904 -14.477 1.00 0.00 H new ATOM 0 HG23 VAL B 40 20.475 -7.334 -15.297 1.00 0.00 H new ATOM 1466 N ALA B 41 21.736 -6.915 -18.079 1.00 0.00 N ATOM 1467 CA ALA B 41 22.276 -5.587 -18.316 1.00 0.00 C ATOM 1468 C ALA B 41 21.247 -4.508 -17.996 1.00 0.00 C ATOM 1469 O ALA B 41 20.051 -4.781 -17.916 1.00 0.00 O ATOM 1470 CB ALA B 41 22.745 -5.494 -19.767 1.00 0.00 C ATOM 0 H ALA B 41 20.927 -7.149 -18.655 1.00 0.00 H new ATOM 0 HA ALA B 41 23.125 -5.420 -17.653 1.00 0.00 H new ATOM 0 HB1 ALA B 41 23.152 -4.500 -19.955 1.00 0.00 H new ATOM 0 HB2 ALA B 41 23.516 -6.243 -19.949 1.00 0.00 H new ATOM 0 HB3 ALA B 41 21.902 -5.673 -20.434 1.00 0.00 H new ATOM 1476 N VAL B 42 21.729 -3.278 -17.815 1.00 0.00 N ATOM 1477 CA VAL B 42 20.902 -2.114 -17.531 1.00 0.00 C ATOM 1478 C VAL B 42 21.605 -0.865 -18.061 1.00 0.00 C ATOM 1479 O VAL B 42 22.676 -0.493 -17.586 1.00 0.00 O ATOM 1480 CB VAL B 42 20.598 -2.025 -16.025 1.00 0.00 C ATOM 1481 CG1 VAL B 42 21.802 -2.398 -15.163 1.00 0.00 C ATOM 1482 CG2 VAL B 42 20.122 -0.627 -15.627 1.00 0.00 C ATOM 0 H VAL B 42 22.725 -3.063 -17.863 1.00 0.00 H new ATOM 0 HA VAL B 42 19.940 -2.202 -18.037 1.00 0.00 H new ATOM 0 HB VAL B 42 19.802 -2.747 -15.843 1.00 0.00 H new ATOM 0 HG11 VAL B 42 21.534 -2.319 -14.109 1.00 0.00 H new ATOM 0 HG12 VAL B 42 22.105 -3.421 -15.384 1.00 0.00 H new ATOM 0 HG13 VAL B 42 22.628 -1.720 -15.379 1.00 0.00 H new ATOM 0 HG21 VAL B 42 19.917 -0.603 -14.557 1.00 0.00 H new ATOM 0 HG22 VAL B 42 20.896 0.102 -15.865 1.00 0.00 H new ATOM 0 HG23 VAL B 42 19.213 -0.382 -16.176 1.00 0.00 H new ATOM 1492 N HIS B 43 20.990 -0.218 -19.055 1.00 0.00 N ATOM 1493 CA HIS B 43 21.528 0.991 -19.666 1.00 0.00 C ATOM 1494 C HIS B 43 20.419 2.003 -19.954 1.00 0.00 C ATOM 1495 O HIS B 43 19.234 1.676 -19.896 1.00 0.00 O ATOM 1496 CB HIS B 43 22.273 0.631 -20.955 1.00 0.00 C ATOM 1497 CG HIS B 43 23.504 -0.206 -20.718 1.00 0.00 C ATOM 1498 ND1 HIS B 43 24.800 0.256 -20.648 1.00 0.00 N ATOM 1499 CD2 HIS B 43 23.534 -1.562 -20.535 1.00 0.00 C ATOM 1500 CE1 HIS B 43 25.591 -0.805 -20.407 1.00 0.00 C ATOM 1501 NE2 HIS B 43 24.867 -1.935 -20.336 1.00 0.00 N ATOM 0 H HIS B 43 20.103 -0.522 -19.456 1.00 0.00 H new ATOM 0 HA HIS B 43 22.225 1.452 -18.966 1.00 0.00 H new ATOM 0 HB2 HIS B 43 21.597 0.091 -21.618 1.00 0.00 H new ATOM 0 HB3 HIS B 43 22.559 1.548 -21.469 1.00 0.00 H new ATOM 0 HD2 HIS B 43 22.681 -2.225 -20.543 1.00 0.00 H new ATOM 0 HE1 HIS B 43 26.663 -0.755 -20.287 1.00 0.00 H new ATOM 0 HE2 HIS B 43 25.220 -2.878 -20.170 1.00 0.00 H new ATOM 1509 N ARG B 44 20.820 3.241 -20.266 1.00 0.00 N ATOM 1510 CA ARG B 44 19.913 4.357 -20.509 1.00 0.00 C ATOM 1511 C ARG B 44 19.611 4.571 -21.995 1.00 0.00 C ATOM 1512 O ARG B 44 19.170 5.652 -22.379 1.00 0.00 O ATOM 1513 CB ARG B 44 20.481 5.621 -19.852 1.00 0.00 C ATOM 1514 CG ARG B 44 21.804 6.045 -20.490 1.00 0.00 C ATOM 1515 CD ARG B 44 22.294 7.362 -19.899 1.00 0.00 C ATOM 1516 NE ARG B 44 22.837 7.203 -18.551 1.00 0.00 N ATOM 1517 CZ ARG B 44 23.212 8.234 -17.791 1.00 0.00 C ATOM 1518 NH1 ARG B 44 23.085 9.489 -18.223 1.00 0.00 N ATOM 1519 NH2 ARG B 44 23.721 8.009 -16.586 1.00 0.00 N ATOM 0 H ARG B 44 21.804 3.495 -20.357 1.00 0.00 H new ATOM 0 HA ARG B 44 18.952 4.117 -20.055 1.00 0.00 H new ATOM 0 HB2 ARG B 44 19.758 6.432 -19.939 1.00 0.00 H new ATOM 0 HB3 ARG B 44 20.632 5.441 -18.787 1.00 0.00 H new ATOM 0 HG2 ARG B 44 22.554 5.270 -20.332 1.00 0.00 H new ATOM 0 HG3 ARG B 44 21.676 6.150 -21.567 1.00 0.00 H new ATOM 0 HD2 ARG B 44 23.060 7.785 -20.548 1.00 0.00 H new ATOM 0 HD3 ARG B 44 21.469 8.074 -19.873 1.00 0.00 H new ATOM 0 HE ARG B 44 22.934 6.260 -18.174 1.00 0.00 H new ATOM 0 HH11 ARG B 44 22.696 9.673 -19.148 1.00 0.00 H new ATOM 0 HH12 ARG B 44 23.377 10.265 -17.629 1.00 0.00 H new ATOM 0 HH21 ARG B 44 23.824 7.053 -16.246 1.00 0.00 H new ATOM 0 HH22 ARG B 44 24.010 8.792 -16.000 1.00 0.00 H new