USER MOD reduce.3.24.130724 H: found=0, std=0, add=670, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 666 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 24 MET CE :methyl -154:sc= -1.52 (180deg=-0.223) USER MOD Set 1.2: A 27 TYR OH : rot 164:sc= 1.31 USER MOD Set 1.3: A 60 HIS : no HD1:sc= 0.587 K(o=0.39,f=-7.1!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 40:sc= 0.274 USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.102 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -84:sc= 1 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= -0.222 K(o=-0.22,f=-2!) USER MOD Single : A 28 THR OG1 : rot 106:sc= 0.995 USER MOD Single : A 30 HIS : no HD1:sc= -0.173 K(o=-0.17,f=-1.2) USER MOD Single : A 32 MET CE :methyl -127:sc= -0.54 (180deg=-1.54) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -176:sc= -1 (180deg=-1.12) USER MOD Single : A 44 GLN : amide:sc= -0.0721 X(o=-0.072,f=-0.31) USER MOD Single : A 45 MET CE :methyl -159:sc= -0.0617 (180deg=-0.657) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 47 ASN : amide:sc= -0.372 K(o=-0.37,f=-1.4) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -2.82 K(o=-2.8,f=-2.2) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -117:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -171:sc= 0.226 (180deg=0.196) USER MOD Single : A 74 GLN : amide:sc= -0.025 X(o=-0.025,f=-0.49) USER MOD Single : A 76 ASN : amide:sc= -0.0774 K(o=-0.077,f=-0.85) USER MOD Single : A 77 THR OG1 : rot 150:sc= 0 USER MOD Single : A 83 SER OG : rot 45:sc= 1.2 USER MOD Single : A 86 SER OG : rot 180:sc= 0.0354 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.127 -4.357 -7.257 1.00 0.00 N ATOM 2 CA GLY A 1 1.504 -4.111 -7.641 1.00 0.00 C ATOM 3 C GLY A 1 2.169 -5.339 -8.232 1.00 0.00 C ATOM 4 O GLY A 1 2.236 -6.387 -7.590 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.283 -3.488 -6.859 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.420 -4.647 -8.093 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.095 -5.113 -6.544 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.536 -3.299 -8.368 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.068 -3.780 -6.769 1.00 0.00 H new ATOM 8 N SER A 2 2.662 -5.210 -9.460 1.00 0.00 N ATOM 9 CA SER A 2 3.320 -6.319 -10.140 1.00 0.00 C ATOM 10 C SER A 2 4.740 -5.940 -10.548 1.00 0.00 C ATOM 11 O SER A 2 5.150 -6.161 -11.688 1.00 0.00 O ATOM 12 CB SER A 2 2.517 -6.738 -11.373 1.00 0.00 C ATOM 13 OG SER A 2 1.128 -6.761 -11.093 1.00 0.00 O ATOM 0 H SER A 2 2.618 -4.348 -10.004 1.00 0.00 H new ATOM 0 HA SER A 2 3.372 -7.159 -9.447 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.715 -6.046 -12.192 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.841 -7.725 -11.704 1.00 0.00 H new ATOM 0 HG SER A 2 0.637 -7.030 -11.897 1.00 0.00 H new ATOM 19 N SER A 3 5.487 -5.367 -9.609 1.00 0.00 N ATOM 20 CA SER A 3 6.860 -4.953 -9.871 1.00 0.00 C ATOM 21 C SER A 3 7.730 -6.153 -10.232 1.00 0.00 C ATOM 22 O SER A 3 8.410 -6.156 -11.257 1.00 0.00 O ATOM 23 CB SER A 3 7.441 -4.236 -8.651 1.00 0.00 C ATOM 24 OG SER A 3 6.951 -2.910 -8.558 1.00 0.00 O ATOM 0 H SER A 3 5.164 -5.179 -8.660 1.00 0.00 H new ATOM 0 HA SER A 3 6.851 -4.266 -10.717 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.185 -4.786 -7.746 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.529 -4.221 -8.718 1.00 0.00 H new ATOM 0 HG SER A 3 7.336 -2.474 -7.769 1.00 0.00 H new ATOM 30 N GLY A 4 7.702 -7.174 -9.380 1.00 0.00 N ATOM 31 CA GLY A 4 8.492 -8.366 -9.625 1.00 0.00 C ATOM 32 C GLY A 4 7.748 -9.638 -9.268 1.00 0.00 C ATOM 33 O GLY A 4 7.708 -10.036 -8.104 1.00 0.00 O ATOM 0 H GLY A 4 7.146 -7.196 -8.525 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.778 -8.399 -10.676 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.414 -8.313 -9.045 1.00 0.00 H new ATOM 37 N SER A 5 7.156 -10.277 -10.272 1.00 0.00 N ATOM 38 CA SER A 5 6.405 -11.508 -10.057 1.00 0.00 C ATOM 39 C SER A 5 7.328 -12.722 -10.099 1.00 0.00 C ATOM 40 O SER A 5 7.066 -13.737 -9.454 1.00 0.00 O ATOM 41 CB SER A 5 5.307 -11.651 -11.113 1.00 0.00 C ATOM 42 OG SER A 5 4.023 -11.459 -10.544 1.00 0.00 O ATOM 0 H SER A 5 7.182 -9.963 -11.242 1.00 0.00 H new ATOM 0 HA SER A 5 5.946 -11.457 -9.070 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.467 -10.924 -11.909 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.362 -12.640 -11.568 1.00 0.00 H new ATOM 0 HG SER A 5 3.339 -11.554 -11.240 1.00 0.00 H new ATOM 48 N SER A 6 8.409 -12.609 -10.863 1.00 0.00 N ATOM 49 CA SER A 6 9.370 -13.698 -10.994 1.00 0.00 C ATOM 50 C SER A 6 10.717 -13.178 -11.487 1.00 0.00 C ATOM 51 O SER A 6 10.831 -12.684 -12.608 1.00 0.00 O ATOM 52 CB SER A 6 8.839 -14.763 -11.955 1.00 0.00 C ATOM 53 OG SER A 6 8.447 -14.187 -13.189 1.00 0.00 O ATOM 0 H SER A 6 8.642 -11.774 -11.401 1.00 0.00 H new ATOM 0 HA SER A 6 9.511 -14.145 -10.010 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.608 -15.516 -12.129 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.989 -15.274 -11.503 1.00 0.00 H new ATOM 0 HG SER A 6 9.094 -13.498 -13.449 1.00 0.00 H new ATOM 59 N GLY A 7 11.735 -13.293 -10.640 1.00 0.00 N ATOM 60 CA GLY A 7 13.061 -12.830 -11.007 1.00 0.00 C ATOM 61 C GLY A 7 13.423 -11.519 -10.338 1.00 0.00 C ATOM 62 O GLY A 7 12.736 -11.074 -9.419 1.00 0.00 O ATOM 0 H GLY A 7 11.666 -13.698 -9.707 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.795 -13.588 -10.735 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.114 -12.709 -12.089 1.00 0.00 H new ATOM 66 N GLU A 8 14.504 -10.899 -10.801 1.00 0.00 N ATOM 67 CA GLU A 8 14.956 -9.632 -10.239 1.00 0.00 C ATOM 68 C GLU A 8 15.248 -9.771 -8.748 1.00 0.00 C ATOM 69 O GLU A 8 14.804 -8.957 -7.939 1.00 0.00 O ATOM 70 CB GLU A 8 13.904 -8.544 -10.465 1.00 0.00 C ATOM 71 CG GLU A 8 14.465 -7.133 -10.404 1.00 0.00 C ATOM 72 CD GLU A 8 13.665 -6.151 -11.239 1.00 0.00 C ATOM 73 OE1 GLU A 8 12.524 -6.487 -11.617 1.00 0.00 O ATOM 74 OE2 GLU A 8 14.181 -5.048 -11.513 1.00 0.00 O ATOM 0 H GLU A 8 15.082 -11.253 -11.563 1.00 0.00 H new ATOM 0 HA GLU A 8 15.878 -9.347 -10.747 1.00 0.00 H new ATOM 0 HB2 GLU A 8 13.437 -8.699 -11.438 1.00 0.00 H new ATOM 0 HB3 GLU A 8 13.120 -8.647 -9.715 1.00 0.00 H new ATOM 0 HG2 GLU A 8 14.479 -6.796 -9.368 1.00 0.00 H new ATOM 0 HG3 GLU A 8 15.498 -7.141 -10.750 1.00 0.00 H new ATOM 81 N GLY A 9 15.997 -10.810 -8.391 1.00 0.00 N ATOM 82 CA GLY A 9 16.334 -11.038 -6.998 1.00 0.00 C ATOM 83 C GLY A 9 17.340 -12.158 -6.821 1.00 0.00 C ATOM 84 O GLY A 9 17.227 -12.964 -5.897 1.00 0.00 O ATOM 0 H GLY A 9 16.376 -11.498 -9.042 1.00 0.00 H new ATOM 0 HA2 GLY A 9 16.738 -10.120 -6.570 1.00 0.00 H new ATOM 0 HA3 GLY A 9 15.427 -11.277 -6.442 1.00 0.00 H new ATOM 88 N VAL A 10 18.327 -12.211 -7.710 1.00 0.00 N ATOM 89 CA VAL A 10 19.357 -13.241 -7.648 1.00 0.00 C ATOM 90 C VAL A 10 20.751 -12.632 -7.754 1.00 0.00 C ATOM 91 O VAL A 10 21.024 -11.792 -8.611 1.00 0.00 O ATOM 92 CB VAL A 10 19.177 -14.282 -8.769 1.00 0.00 C ATOM 93 CG1 VAL A 10 19.208 -13.610 -10.133 1.00 0.00 C ATOM 94 CG2 VAL A 10 20.247 -15.359 -8.672 1.00 0.00 C ATOM 0 H VAL A 10 18.435 -11.553 -8.482 1.00 0.00 H new ATOM 0 HA VAL A 10 19.253 -13.736 -6.682 1.00 0.00 H new ATOM 0 HB VAL A 10 18.203 -14.757 -8.647 1.00 0.00 H new ATOM 0 HG11 VAL A 10 19.079 -14.362 -10.912 1.00 0.00 H new ATOM 0 HG12 VAL A 10 18.402 -12.879 -10.197 1.00 0.00 H new ATOM 0 HG13 VAL A 10 20.165 -13.107 -10.269 1.00 0.00 H new ATOM 0 HG21 VAL A 10 20.105 -16.086 -9.471 1.00 0.00 H new ATOM 0 HG22 VAL A 10 21.232 -14.903 -8.768 1.00 0.00 H new ATOM 0 HG23 VAL A 10 20.172 -15.861 -7.707 1.00 0.00 H new ATOM 104 N PRO A 11 21.655 -13.065 -6.863 1.00 0.00 N ATOM 105 CA PRO A 11 23.037 -12.577 -6.836 1.00 0.00 C ATOM 106 C PRO A 11 23.845 -13.057 -8.037 1.00 0.00 C ATOM 107 O PRO A 11 24.524 -12.270 -8.696 1.00 0.00 O ATOM 108 CB PRO A 11 23.598 -13.170 -5.542 1.00 0.00 C ATOM 109 CG PRO A 11 22.772 -14.385 -5.293 1.00 0.00 C ATOM 110 CD PRO A 11 21.398 -14.066 -5.814 1.00 0.00 C ATOM 0 HA PRO A 11 23.086 -11.489 -6.878 1.00 0.00 H new ATOM 0 HB2 PRO A 11 24.653 -13.423 -5.647 1.00 0.00 H new ATOM 0 HB3 PRO A 11 23.521 -12.463 -4.716 1.00 0.00 H new ATOM 0 HG2 PRO A 11 23.191 -15.253 -5.803 1.00 0.00 H new ATOM 0 HG3 PRO A 11 22.740 -14.624 -4.230 1.00 0.00 H new ATOM 0 HD2 PRO A 11 20.905 -14.951 -6.215 1.00 0.00 H new ATOM 0 HD3 PRO A 11 20.753 -13.670 -5.030 1.00 0.00 H new ATOM 118 N PHE A 12 23.767 -14.354 -8.316 1.00 0.00 N ATOM 119 CA PHE A 12 24.492 -14.940 -9.437 1.00 0.00 C ATOM 120 C PHE A 12 23.639 -14.927 -10.703 1.00 0.00 C ATOM 121 O PHE A 12 22.410 -14.896 -10.635 1.00 0.00 O ATOM 122 CB PHE A 12 24.913 -16.373 -9.107 1.00 0.00 C ATOM 123 CG PHE A 12 25.555 -16.513 -7.756 1.00 0.00 C ATOM 124 CD1 PHE A 12 26.868 -16.121 -7.555 1.00 0.00 C ATOM 125 CD2 PHE A 12 24.844 -17.037 -6.689 1.00 0.00 C ATOM 126 CE1 PHE A 12 27.461 -16.250 -6.313 1.00 0.00 C ATOM 127 CE2 PHE A 12 25.432 -17.168 -5.444 1.00 0.00 C ATOM 128 CZ PHE A 12 26.741 -16.773 -5.256 1.00 0.00 C ATOM 0 H PHE A 12 23.209 -15.019 -7.781 1.00 0.00 H new ATOM 0 HA PHE A 12 25.384 -14.339 -9.614 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.037 -17.020 -9.153 1.00 0.00 H new ATOM 0 HB3 PHE A 12 25.609 -16.723 -9.869 1.00 0.00 H new ATOM 0 HD1 PHE A 12 27.435 -15.710 -8.377 1.00 0.00 H new ATOM 0 HD2 PHE A 12 23.819 -17.347 -6.831 1.00 0.00 H new ATOM 0 HE1 PHE A 12 28.486 -15.942 -6.169 1.00 0.00 H new ATOM 0 HE2 PHE A 12 24.868 -17.579 -4.620 1.00 0.00 H new ATOM 0 HZ PHE A 12 27.202 -16.873 -4.284 1.00 0.00 H new ATOM 138 N ARG A 13 24.300 -14.950 -11.855 1.00 0.00 N ATOM 139 CA ARG A 13 23.604 -14.939 -13.136 1.00 0.00 C ATOM 140 C ARG A 13 23.633 -16.321 -13.782 1.00 0.00 C ATOM 141 O ARG A 13 22.756 -16.667 -14.575 1.00 0.00 O ATOM 142 CB ARG A 13 24.237 -13.912 -14.076 1.00 0.00 C ATOM 143 CG ARG A 13 25.749 -14.027 -14.175 1.00 0.00 C ATOM 144 CD ARG A 13 26.243 -13.687 -15.572 1.00 0.00 C ATOM 145 NE ARG A 13 27.697 -13.555 -15.622 1.00 0.00 N ATOM 146 CZ ARG A 13 28.353 -13.034 -16.653 1.00 0.00 C ATOM 147 NH1 ARG A 13 27.688 -12.599 -17.714 1.00 0.00 N ATOM 148 NH2 ARG A 13 29.677 -12.948 -16.623 1.00 0.00 N ATOM 0 H ARG A 13 25.317 -14.976 -11.928 1.00 0.00 H new ATOM 0 HA ARG A 13 22.565 -14.663 -12.954 1.00 0.00 H new ATOM 0 HB2 ARG A 13 23.806 -14.029 -15.071 1.00 0.00 H new ATOM 0 HB3 ARG A 13 23.979 -12.910 -13.732 1.00 0.00 H new ATOM 0 HG2 ARG A 13 26.214 -13.358 -13.451 1.00 0.00 H new ATOM 0 HG3 ARG A 13 26.056 -15.040 -13.916 1.00 0.00 H new ATOM 0 HD2 ARG A 13 25.926 -14.464 -16.268 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.783 -12.756 -15.902 1.00 0.00 H new ATOM 0 HE ARG A 13 28.238 -13.881 -14.821 1.00 0.00 H new ATOM 0 HH11 ARG A 13 26.670 -12.664 -17.740 1.00 0.00 H new ATOM 0 HH12 ARG A 13 28.194 -12.199 -18.504 1.00 0.00 H new ATOM 0 HH21 ARG A 13 30.191 -13.282 -15.808 1.00 0.00 H new ATOM 0 HH22 ARG A 13 30.180 -12.548 -17.415 1.00 0.00 H new ATOM 162 N THR A 14 24.648 -17.109 -13.439 1.00 0.00 N ATOM 163 CA THR A 14 24.792 -18.452 -13.986 1.00 0.00 C ATOM 164 C THR A 14 24.910 -19.488 -12.875 1.00 0.00 C ATOM 165 O THR A 14 24.890 -19.150 -11.691 1.00 0.00 O ATOM 166 CB THR A 14 26.027 -18.555 -14.902 1.00 0.00 C ATOM 167 OG1 THR A 14 27.216 -18.280 -14.154 1.00 0.00 O ATOM 168 CG2 THR A 14 25.919 -17.583 -16.067 1.00 0.00 C ATOM 0 H THR A 14 25.382 -16.839 -12.785 1.00 0.00 H new ATOM 0 HA THR A 14 23.895 -18.653 -14.572 1.00 0.00 H new ATOM 0 HB THR A 14 26.074 -19.569 -15.299 1.00 0.00 H new ATOM 0 HG1 THR A 14 27.996 -18.349 -14.743 1.00 0.00 H new ATOM 0 HG21 THR A 14 26.802 -17.674 -16.700 1.00 0.00 H new ATOM 0 HG22 THR A 14 25.028 -17.813 -16.652 1.00 0.00 H new ATOM 0 HG23 THR A 14 25.849 -16.564 -15.686 1.00 0.00 H new ATOM 176 N VAL A 15 25.033 -20.754 -13.263 1.00 0.00 N ATOM 177 CA VAL A 15 25.157 -21.841 -12.299 1.00 0.00 C ATOM 178 C VAL A 15 26.603 -22.017 -11.851 1.00 0.00 C ATOM 179 O VAL A 15 26.880 -22.188 -10.664 1.00 0.00 O ATOM 180 CB VAL A 15 24.646 -23.171 -12.884 1.00 0.00 C ATOM 181 CG1 VAL A 15 24.828 -24.300 -11.882 1.00 0.00 C ATOM 182 CG2 VAL A 15 23.188 -23.045 -13.299 1.00 0.00 C ATOM 0 H VAL A 15 25.049 -21.052 -14.238 1.00 0.00 H new ATOM 0 HA VAL A 15 24.544 -21.572 -11.439 1.00 0.00 H new ATOM 0 HB VAL A 15 25.233 -23.407 -13.771 1.00 0.00 H new ATOM 0 HG11 VAL A 15 24.461 -25.232 -12.313 1.00 0.00 H new ATOM 0 HG12 VAL A 15 25.886 -24.404 -11.639 1.00 0.00 H new ATOM 0 HG13 VAL A 15 24.268 -24.075 -10.974 1.00 0.00 H new ATOM 0 HG21 VAL A 15 22.843 -23.994 -13.710 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.584 -22.785 -12.430 1.00 0.00 H new ATOM 0 HG23 VAL A 15 23.091 -22.266 -14.055 1.00 0.00 H new ATOM 192 N SER A 16 27.523 -21.973 -12.810 1.00 0.00 N ATOM 193 CA SER A 16 28.942 -22.131 -12.515 1.00 0.00 C ATOM 194 C SER A 16 29.380 -21.167 -11.417 1.00 0.00 C ATOM 195 O SER A 16 30.074 -21.553 -10.477 1.00 0.00 O ATOM 196 CB SER A 16 29.776 -21.898 -13.776 1.00 0.00 C ATOM 197 OG SER A 16 30.965 -21.188 -13.478 1.00 0.00 O ATOM 0 H SER A 16 27.311 -21.829 -13.797 1.00 0.00 H new ATOM 0 HA SER A 16 29.103 -23.150 -12.165 1.00 0.00 H new ATOM 0 HB2 SER A 16 30.026 -22.856 -14.233 1.00 0.00 H new ATOM 0 HB3 SER A 16 29.189 -21.340 -14.506 1.00 0.00 H new ATOM 0 HG SER A 16 31.481 -21.054 -14.300 1.00 0.00 H new ATOM 203 N GLU A 17 28.968 -19.909 -11.544 1.00 0.00 N ATOM 204 CA GLU A 17 29.318 -18.889 -10.563 1.00 0.00 C ATOM 205 C GLU A 17 28.704 -19.207 -9.203 1.00 0.00 C ATOM 206 O GLU A 17 29.212 -18.782 -8.166 1.00 0.00 O ATOM 207 CB GLU A 17 28.848 -17.512 -11.037 1.00 0.00 C ATOM 208 CG GLU A 17 29.391 -17.119 -12.401 1.00 0.00 C ATOM 209 CD GLU A 17 30.630 -16.250 -12.308 1.00 0.00 C ATOM 210 OE1 GLU A 17 31.726 -16.802 -12.076 1.00 0.00 O ATOM 211 OE2 GLU A 17 30.504 -15.018 -12.466 1.00 0.00 O ATOM 0 H GLU A 17 28.392 -19.573 -12.316 1.00 0.00 H new ATOM 0 HA GLU A 17 30.403 -18.880 -10.459 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.759 -17.502 -11.072 1.00 0.00 H new ATOM 0 HB3 GLU A 17 29.150 -16.763 -10.305 1.00 0.00 H new ATOM 0 HG2 GLU A 17 29.626 -18.020 -12.968 1.00 0.00 H new ATOM 0 HG3 GLU A 17 28.619 -16.586 -12.955 1.00 0.00 H new ATOM 218 N TRP A 18 27.609 -19.958 -9.217 1.00 0.00 N ATOM 219 CA TRP A 18 26.924 -20.334 -7.985 1.00 0.00 C ATOM 220 C TRP A 18 27.610 -21.524 -7.323 1.00 0.00 C ATOM 221 O TRP A 18 27.986 -21.463 -6.151 1.00 0.00 O ATOM 222 CB TRP A 18 25.460 -20.668 -8.273 1.00 0.00 C ATOM 223 CG TRP A 18 24.747 -21.272 -7.101 1.00 0.00 C ATOM 224 CD1 TRP A 18 24.559 -20.703 -5.874 1.00 0.00 C ATOM 225 CD2 TRP A 18 24.130 -22.563 -7.045 1.00 0.00 C ATOM 226 NE1 TRP A 18 23.862 -21.562 -5.059 1.00 0.00 N ATOM 227 CE2 TRP A 18 23.586 -22.710 -5.754 1.00 0.00 C ATOM 228 CE3 TRP A 18 23.982 -23.608 -7.961 1.00 0.00 C ATOM 229 CZ2 TRP A 18 22.908 -23.859 -5.359 1.00 0.00 C ATOM 230 CZ3 TRP A 18 23.309 -24.749 -7.567 1.00 0.00 C ATOM 231 CH2 TRP A 18 22.778 -24.867 -6.276 1.00 0.00 C ATOM 0 H TRP A 18 27.176 -20.319 -10.067 1.00 0.00 H new ATOM 0 HA TRP A 18 26.968 -19.487 -7.301 1.00 0.00 H new ATOM 0 HB2 TRP A 18 24.940 -19.759 -8.576 1.00 0.00 H new ATOM 0 HB3 TRP A 18 25.411 -21.359 -9.114 1.00 0.00 H new ATOM 0 HD1 TRP A 18 24.907 -19.722 -5.586 1.00 0.00 H new ATOM 0 HE1 TRP A 18 23.593 -21.375 -4.093 1.00 0.00 H new ATOM 0 HE3 TRP A 18 24.386 -23.525 -8.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 22.499 -23.952 -4.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 23.190 -25.563 -8.266 1.00 0.00 H new ATOM 0 HH2 TRP A 18 22.256 -25.771 -5.999 1.00 0.00 H new ATOM 242 N LEU A 19 27.770 -22.604 -8.078 1.00 0.00 N ATOM 243 CA LEU A 19 28.411 -23.809 -7.563 1.00 0.00 C ATOM 244 C LEU A 19 29.824 -23.508 -7.075 1.00 0.00 C ATOM 245 O LEU A 19 30.209 -23.905 -5.976 1.00 0.00 O ATOM 246 CB LEU A 19 28.452 -24.891 -8.645 1.00 0.00 C ATOM 247 CG LEU A 19 27.223 -25.795 -8.737 1.00 0.00 C ATOM 248 CD1 LEU A 19 27.375 -26.787 -9.880 1.00 0.00 C ATOM 249 CD2 LEU A 19 26.998 -26.525 -7.421 1.00 0.00 C ATOM 0 H LEU A 19 27.465 -22.671 -9.049 1.00 0.00 H new ATOM 0 HA LEU A 19 27.824 -24.170 -6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 19 28.594 -24.406 -9.611 1.00 0.00 H new ATOM 0 HB3 LEU A 19 29.327 -25.518 -8.471 1.00 0.00 H new ATOM 0 HG LEU A 19 26.351 -25.172 -8.937 1.00 0.00 H new ATOM 0 HD11 LEU A 19 26.491 -27.422 -9.930 1.00 0.00 H new ATOM 0 HD12 LEU A 19 27.487 -26.245 -10.819 1.00 0.00 H new ATOM 0 HD13 LEU A 19 28.257 -27.405 -9.710 1.00 0.00 H new ATOM 0 HD21 LEU A 19 26.119 -27.164 -7.505 1.00 0.00 H new ATOM 0 HD22 LEU A 19 27.870 -27.137 -7.190 1.00 0.00 H new ATOM 0 HD23 LEU A 19 26.843 -25.798 -6.624 1.00 0.00 H new ATOM 261 N GLU A 20 30.592 -22.802 -7.900 1.00 0.00 N ATOM 262 CA GLU A 20 31.962 -22.446 -7.550 1.00 0.00 C ATOM 263 C GLU A 20 32.011 -21.720 -6.209 1.00 0.00 C ATOM 264 O GLU A 20 33.017 -21.767 -5.502 1.00 0.00 O ATOM 265 CB GLU A 20 32.578 -21.568 -8.641 1.00 0.00 C ATOM 266 CG GLU A 20 32.057 -20.141 -8.640 1.00 0.00 C ATOM 267 CD GLU A 20 32.732 -19.273 -9.684 1.00 0.00 C ATOM 268 OE1 GLU A 20 33.096 -19.804 -10.754 1.00 0.00 O ATOM 269 OE2 GLU A 20 32.896 -18.061 -9.431 1.00 0.00 O ATOM 0 H GLU A 20 30.289 -22.466 -8.814 1.00 0.00 H new ATOM 0 HA GLU A 20 32.539 -23.367 -7.465 1.00 0.00 H new ATOM 0 HB2 GLU A 20 33.660 -21.551 -8.514 1.00 0.00 H new ATOM 0 HB3 GLU A 20 32.379 -22.018 -9.614 1.00 0.00 H new ATOM 0 HG2 GLU A 20 30.982 -20.150 -8.821 1.00 0.00 H new ATOM 0 HG3 GLU A 20 32.211 -19.703 -7.654 1.00 0.00 H new ATOM 276 N SER A 21 30.916 -21.049 -5.866 1.00 0.00 N ATOM 277 CA SER A 21 30.834 -20.309 -4.613 1.00 0.00 C ATOM 278 C SER A 21 30.895 -21.256 -3.418 1.00 0.00 C ATOM 279 O SER A 21 31.320 -20.870 -2.328 1.00 0.00 O ATOM 280 CB SER A 21 29.543 -19.489 -4.563 1.00 0.00 C ATOM 281 OG SER A 21 28.529 -20.178 -3.853 1.00 0.00 O ATOM 0 H SER A 21 30.073 -21.003 -6.439 1.00 0.00 H new ATOM 0 HA SER A 21 31.687 -19.633 -4.563 1.00 0.00 H new ATOM 0 HB2 SER A 21 29.737 -18.528 -4.086 1.00 0.00 H new ATOM 0 HB3 SER A 21 29.203 -19.278 -5.577 1.00 0.00 H new ATOM 0 HG SER A 21 28.073 -20.802 -4.456 1.00 0.00 H new ATOM 287 N ILE A 22 30.467 -22.495 -3.631 1.00 0.00 N ATOM 288 CA ILE A 22 30.474 -23.498 -2.573 1.00 0.00 C ATOM 289 C ILE A 22 31.465 -24.615 -2.881 1.00 0.00 C ATOM 290 O ILE A 22 31.326 -25.736 -2.391 1.00 0.00 O ATOM 291 CB ILE A 22 29.075 -24.110 -2.369 1.00 0.00 C ATOM 292 CG1 ILE A 22 28.563 -24.715 -3.677 1.00 0.00 C ATOM 293 CG2 ILE A 22 28.107 -23.057 -1.851 1.00 0.00 C ATOM 294 CD1 ILE A 22 27.196 -25.350 -3.555 1.00 0.00 C ATOM 0 H ILE A 22 30.111 -22.829 -4.527 1.00 0.00 H new ATOM 0 HA ILE A 22 30.777 -22.989 -1.658 1.00 0.00 H new ATOM 0 HB ILE A 22 29.147 -24.905 -1.627 1.00 0.00 H new ATOM 0 HG12 ILE A 22 28.526 -23.936 -4.438 1.00 0.00 H new ATOM 0 HG13 ILE A 22 29.274 -25.465 -4.023 1.00 0.00 H new ATOM 0 HG21 ILE A 22 27.123 -23.504 -1.712 1.00 0.00 H new ATOM 0 HG22 ILE A 22 28.467 -22.669 -0.898 1.00 0.00 H new ATOM 0 HG23 ILE A 22 28.036 -22.242 -2.571 1.00 0.00 H new ATOM 0 HD11 ILE A 22 26.897 -25.758 -4.520 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.232 -26.152 -2.818 1.00 0.00 H new ATOM 0 HD13 ILE A 22 26.473 -24.598 -3.239 1.00 0.00 H new ATOM 306 N LYS A 23 32.468 -24.301 -3.694 1.00 0.00 N ATOM 307 CA LYS A 23 33.486 -25.277 -4.065 1.00 0.00 C ATOM 308 C LYS A 23 32.849 -26.530 -4.657 1.00 0.00 C ATOM 309 O LYS A 23 33.214 -27.650 -4.301 1.00 0.00 O ATOM 310 CB LYS A 23 34.334 -25.649 -2.847 1.00 0.00 C ATOM 311 CG LYS A 23 35.131 -24.487 -2.282 1.00 0.00 C ATOM 312 CD LYS A 23 36.362 -24.194 -3.122 1.00 0.00 C ATOM 313 CE LYS A 23 37.416 -23.442 -2.324 1.00 0.00 C ATOM 314 NZ LYS A 23 37.305 -21.968 -2.509 1.00 0.00 N ATOM 0 H LYS A 23 32.598 -23.378 -4.109 1.00 0.00 H new ATOM 0 HA LYS A 23 34.127 -24.825 -4.822 1.00 0.00 H new ATOM 0 HB2 LYS A 23 33.682 -26.044 -2.068 1.00 0.00 H new ATOM 0 HB3 LYS A 23 35.021 -26.449 -3.124 1.00 0.00 H new ATOM 0 HG2 LYS A 23 34.500 -23.599 -2.238 1.00 0.00 H new ATOM 0 HG3 LYS A 23 35.433 -24.715 -1.260 1.00 0.00 H new ATOM 0 HD2 LYS A 23 36.783 -25.129 -3.491 1.00 0.00 H new ATOM 0 HD3 LYS A 23 36.077 -23.606 -3.994 1.00 0.00 H new ATOM 0 HE2 LYS A 23 37.312 -23.684 -1.266 1.00 0.00 H new ATOM 0 HE3 LYS A 23 38.408 -23.773 -2.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 38.040 -21.491 -1.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 37.429 -21.734 -3.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 36.367 -21.648 -2.193 1.00 0.00 H new ATOM 328 N MET A 24 31.896 -26.333 -5.562 1.00 0.00 N ATOM 329 CA MET A 24 31.211 -27.448 -6.205 1.00 0.00 C ATOM 330 C MET A 24 31.013 -27.179 -7.693 1.00 0.00 C ATOM 331 O MET A 24 30.099 -27.720 -8.314 1.00 0.00 O ATOM 332 CB MET A 24 29.858 -27.697 -5.536 1.00 0.00 C ATOM 333 CG MET A 24 29.969 -28.123 -4.081 1.00 0.00 C ATOM 334 SD MET A 24 29.939 -29.914 -3.877 1.00 0.00 S ATOM 335 CE MET A 24 31.581 -30.209 -3.227 1.00 0.00 C ATOM 0 H MET A 24 31.581 -25.412 -5.867 1.00 0.00 H new ATOM 0 HA MET A 24 31.833 -28.336 -6.094 1.00 0.00 H new ATOM 0 HB2 MET A 24 29.260 -26.788 -5.595 1.00 0.00 H new ATOM 0 HB3 MET A 24 29.323 -28.467 -6.092 1.00 0.00 H new ATOM 0 HG2 MET A 24 30.894 -27.729 -3.661 1.00 0.00 H new ATOM 0 HG3 MET A 24 29.149 -27.683 -3.514 1.00 0.00 H new ATOM 0 HE1 MET A 24 31.893 -31.224 -3.472 1.00 0.00 H new ATOM 0 HE2 MET A 24 32.280 -29.498 -3.668 1.00 0.00 H new ATOM 0 HE3 MET A 24 31.572 -30.084 -2.144 1.00 0.00 H new ATOM 345 N GLN A 25 31.876 -26.341 -8.259 1.00 0.00 N ATOM 346 CA GLN A 25 31.794 -26.001 -9.674 1.00 0.00 C ATOM 347 C GLN A 25 31.977 -27.241 -10.543 1.00 0.00 C ATOM 348 O GLN A 25 31.500 -27.291 -11.677 1.00 0.00 O ATOM 349 CB GLN A 25 32.850 -24.954 -10.031 1.00 0.00 C ATOM 350 CG GLN A 25 34.261 -25.348 -9.623 1.00 0.00 C ATOM 351 CD GLN A 25 35.322 -24.513 -10.311 1.00 0.00 C ATOM 352 OE1 GLN A 25 35.861 -24.904 -11.347 1.00 0.00 O ATOM 353 NE2 GLN A 25 35.630 -23.356 -9.738 1.00 0.00 N ATOM 0 H GLN A 25 32.640 -25.885 -7.759 1.00 0.00 H new ATOM 0 HA GLN A 25 30.804 -25.588 -9.865 1.00 0.00 H new ATOM 0 HB2 GLN A 25 32.827 -24.780 -11.107 1.00 0.00 H new ATOM 0 HB3 GLN A 25 32.592 -24.011 -9.550 1.00 0.00 H new ATOM 0 HG2 GLN A 25 34.365 -25.243 -8.543 1.00 0.00 H new ATOM 0 HG3 GLN A 25 34.423 -26.400 -9.858 1.00 0.00 H new ATOM 0 HE21 GLN A 25 35.159 -23.071 -8.880 1.00 0.00 H new ATOM 0 HE22 GLN A 25 36.338 -22.752 -10.156 1.00 0.00 H new ATOM 362 N GLN A 26 32.671 -28.238 -10.004 1.00 0.00 N ATOM 363 CA GLN A 26 32.917 -29.478 -10.732 1.00 0.00 C ATOM 364 C GLN A 26 31.608 -30.195 -11.045 1.00 0.00 C ATOM 365 O GLN A 26 31.537 -31.001 -11.972 1.00 0.00 O ATOM 366 CB GLN A 26 33.835 -30.395 -9.923 1.00 0.00 C ATOM 367 CG GLN A 26 33.170 -30.986 -8.689 1.00 0.00 C ATOM 368 CD GLN A 26 34.137 -31.168 -7.536 1.00 0.00 C ATOM 369 OE1 GLN A 26 35.144 -30.465 -7.438 1.00 0.00 O ATOM 370 NE2 GLN A 26 33.836 -32.114 -6.655 1.00 0.00 N ATOM 0 H GLN A 26 33.073 -28.212 -9.067 1.00 0.00 H new ATOM 0 HA GLN A 26 33.405 -29.226 -11.674 1.00 0.00 H new ATOM 0 HB2 GLN A 26 34.180 -31.207 -10.563 1.00 0.00 H new ATOM 0 HB3 GLN A 26 34.717 -29.833 -9.616 1.00 0.00 H new ATOM 0 HG2 GLN A 26 32.354 -30.336 -8.374 1.00 0.00 H new ATOM 0 HG3 GLN A 26 32.730 -31.950 -8.945 1.00 0.00 H new ATOM 0 HE21 GLN A 26 32.991 -32.673 -6.775 1.00 0.00 H new ATOM 0 HE22 GLN A 26 34.449 -32.282 -5.858 1.00 0.00 H new ATOM 379 N TYR A 27 30.575 -29.896 -10.265 1.00 0.00 N ATOM 380 CA TYR A 27 29.269 -30.515 -10.457 1.00 0.00 C ATOM 381 C TYR A 27 28.467 -29.776 -11.524 1.00 0.00 C ATOM 382 O TYR A 27 27.427 -30.253 -11.979 1.00 0.00 O ATOM 383 CB TYR A 27 28.491 -30.533 -9.140 1.00 0.00 C ATOM 384 CG TYR A 27 28.827 -31.711 -8.254 1.00 0.00 C ATOM 385 CD1 TYR A 27 28.755 -33.012 -8.738 1.00 0.00 C ATOM 386 CD2 TYR A 27 29.217 -31.524 -6.933 1.00 0.00 C ATOM 387 CE1 TYR A 27 29.060 -34.091 -7.932 1.00 0.00 C ATOM 388 CE2 TYR A 27 29.525 -32.597 -6.121 1.00 0.00 C ATOM 389 CZ TYR A 27 29.445 -33.879 -6.624 1.00 0.00 C ATOM 390 OH TYR A 27 29.751 -34.952 -5.818 1.00 0.00 O ATOM 0 H TYR A 27 30.617 -29.229 -9.494 1.00 0.00 H new ATOM 0 HA TYR A 27 29.427 -31.540 -10.792 1.00 0.00 H new ATOM 0 HB2 TYR A 27 28.693 -29.611 -8.596 1.00 0.00 H new ATOM 0 HB3 TYR A 27 27.423 -30.547 -9.359 1.00 0.00 H new ATOM 0 HD1 TYR A 27 28.455 -33.182 -9.762 1.00 0.00 H new ATOM 0 HD2 TYR A 27 29.280 -30.522 -6.535 1.00 0.00 H new ATOM 0 HE1 TYR A 27 28.998 -35.096 -8.323 1.00 0.00 H new ATOM 0 HE2 TYR A 27 29.827 -32.434 -5.097 1.00 0.00 H new ATOM 0 HH TYR A 27 30.236 -34.639 -5.026 1.00 0.00 H new ATOM 400 N THR A 28 28.959 -28.606 -11.920 1.00 0.00 N ATOM 401 CA THR A 28 28.291 -27.799 -12.933 1.00 0.00 C ATOM 402 C THR A 28 27.975 -28.625 -14.174 1.00 0.00 C ATOM 403 O THR A 28 26.853 -28.600 -14.678 1.00 0.00 O ATOM 404 CB THR A 28 29.149 -26.587 -13.342 1.00 0.00 C ATOM 405 OG1 THR A 28 29.445 -25.786 -12.192 1.00 0.00 O ATOM 406 CG2 THR A 28 28.430 -25.742 -14.383 1.00 0.00 C ATOM 0 H THR A 28 29.818 -28.196 -11.554 1.00 0.00 H new ATOM 0 HA THR A 28 27.361 -27.443 -12.490 1.00 0.00 H new ATOM 0 HB THR A 28 30.078 -26.957 -13.776 1.00 0.00 H new ATOM 0 HG1 THR A 28 30.381 -25.919 -11.933 1.00 0.00 H new ATOM 0 HG21 THR A 28 29.055 -24.892 -14.656 1.00 0.00 H new ATOM 0 HG22 THR A 28 28.232 -26.346 -15.268 1.00 0.00 H new ATOM 0 HG23 THR A 28 27.487 -25.382 -13.971 1.00 0.00 H new ATOM 414 N GLU A 29 28.971 -29.358 -14.661 1.00 0.00 N ATOM 415 CA GLU A 29 28.798 -30.192 -15.844 1.00 0.00 C ATOM 416 C GLU A 29 27.582 -31.103 -15.694 1.00 0.00 C ATOM 417 O GLU A 29 26.933 -31.458 -16.679 1.00 0.00 O ATOM 418 CB GLU A 29 30.052 -31.034 -16.090 1.00 0.00 C ATOM 419 CG GLU A 29 31.301 -30.206 -16.341 1.00 0.00 C ATOM 420 CD GLU A 29 32.545 -30.830 -15.738 1.00 0.00 C ATOM 421 OE1 GLU A 29 32.855 -31.988 -16.087 1.00 0.00 O ATOM 422 OE2 GLU A 29 33.208 -30.160 -14.919 1.00 0.00 O ATOM 0 H GLU A 29 29.906 -29.391 -14.255 1.00 0.00 H new ATOM 0 HA GLU A 29 28.636 -29.536 -16.699 1.00 0.00 H new ATOM 0 HB2 GLU A 29 30.221 -31.679 -15.228 1.00 0.00 H new ATOM 0 HB3 GLU A 29 29.880 -31.685 -16.947 1.00 0.00 H new ATOM 0 HG2 GLU A 29 31.443 -30.086 -17.415 1.00 0.00 H new ATOM 0 HG3 GLU A 29 31.161 -29.208 -15.925 1.00 0.00 H new ATOM 429 N HIS A 30 27.281 -31.478 -14.455 1.00 0.00 N ATOM 430 CA HIS A 30 26.143 -32.347 -14.176 1.00 0.00 C ATOM 431 C HIS A 30 24.839 -31.555 -14.183 1.00 0.00 C ATOM 432 O HIS A 30 23.855 -31.967 -14.797 1.00 0.00 O ATOM 433 CB HIS A 30 26.324 -33.041 -12.825 1.00 0.00 C ATOM 434 CG HIS A 30 27.569 -33.869 -12.739 1.00 0.00 C ATOM 435 ND1 HIS A 30 28.837 -33.327 -12.767 1.00 0.00 N ATOM 436 CD2 HIS A 30 27.736 -35.207 -12.623 1.00 0.00 C ATOM 437 CE1 HIS A 30 29.730 -34.296 -12.675 1.00 0.00 C ATOM 438 NE2 HIS A 30 29.088 -35.447 -12.586 1.00 0.00 N ATOM 0 H HIS A 30 27.808 -31.194 -13.629 1.00 0.00 H new ATOM 0 HA HIS A 30 26.093 -33.102 -14.961 1.00 0.00 H new ATOM 0 HB2 HIS A 30 26.344 -32.287 -12.038 1.00 0.00 H new ATOM 0 HB3 HIS A 30 25.460 -33.678 -12.634 1.00 0.00 H new ATOM 0 HD2 HIS A 30 26.952 -35.948 -12.569 1.00 0.00 H new ATOM 0 HE1 HIS A 30 30.802 -34.169 -12.673 1.00 0.00 H new ATOM 0 HE2 HIS A 30 29.525 -36.365 -12.503 1.00 0.00 H new ATOM 446 N PHE A 31 24.839 -30.418 -13.496 1.00 0.00 N ATOM 447 CA PHE A 31 23.656 -29.569 -13.423 1.00 0.00 C ATOM 448 C PHE A 31 23.116 -29.267 -14.817 1.00 0.00 C ATOM 449 O PHE A 31 21.929 -29.448 -15.087 1.00 0.00 O ATOM 450 CB PHE A 31 23.984 -28.263 -12.696 1.00 0.00 C ATOM 451 CG PHE A 31 23.833 -28.352 -11.204 1.00 0.00 C ATOM 452 CD1 PHE A 31 24.892 -28.764 -10.412 1.00 0.00 C ATOM 453 CD2 PHE A 31 22.633 -28.024 -10.595 1.00 0.00 C ATOM 454 CE1 PHE A 31 24.756 -28.848 -9.039 1.00 0.00 C ATOM 455 CE2 PHE A 31 22.491 -28.106 -9.222 1.00 0.00 C ATOM 456 CZ PHE A 31 23.555 -28.517 -8.443 1.00 0.00 C ATOM 0 H PHE A 31 25.645 -30.063 -12.982 1.00 0.00 H new ATOM 0 HA PHE A 31 22.889 -30.105 -12.864 1.00 0.00 H new ATOM 0 HB2 PHE A 31 25.007 -27.972 -12.933 1.00 0.00 H new ATOM 0 HB3 PHE A 31 23.333 -27.474 -13.072 1.00 0.00 H new ATOM 0 HD1 PHE A 31 25.834 -29.022 -10.872 1.00 0.00 H new ATOM 0 HD2 PHE A 31 21.799 -27.700 -11.200 1.00 0.00 H new ATOM 0 HE1 PHE A 31 25.589 -29.172 -8.433 1.00 0.00 H new ATOM 0 HE2 PHE A 31 21.550 -27.849 -8.759 1.00 0.00 H new ATOM 0 HZ PHE A 31 23.448 -28.579 -7.370 1.00 0.00 H new ATOM 466 N MET A 32 23.996 -28.804 -15.699 1.00 0.00 N ATOM 467 CA MET A 32 23.608 -28.477 -17.066 1.00 0.00 C ATOM 468 C MET A 32 22.963 -29.678 -17.750 1.00 0.00 C ATOM 469 O MET A 32 21.866 -29.577 -18.298 1.00 0.00 O ATOM 470 CB MET A 32 24.826 -28.012 -17.867 1.00 0.00 C ATOM 471 CG MET A 32 25.618 -26.910 -17.183 1.00 0.00 C ATOM 472 SD MET A 32 26.102 -25.596 -18.319 1.00 0.00 S ATOM 473 CE MET A 32 25.557 -24.149 -17.415 1.00 0.00 C ATOM 0 H MET A 32 24.982 -28.647 -15.491 1.00 0.00 H new ATOM 0 HA MET A 32 22.878 -27.669 -17.027 1.00 0.00 H new ATOM 0 HB2 MET A 32 25.482 -28.864 -18.043 1.00 0.00 H new ATOM 0 HB3 MET A 32 24.495 -27.658 -18.843 1.00 0.00 H new ATOM 0 HG2 MET A 32 25.021 -26.486 -16.376 1.00 0.00 H new ATOM 0 HG3 MET A 32 26.511 -27.338 -16.727 1.00 0.00 H new ATOM 0 HE1 MET A 32 24.919 -23.539 -18.055 1.00 0.00 H new ATOM 0 HE2 MET A 32 24.996 -24.460 -16.534 1.00 0.00 H new ATOM 0 HE3 MET A 32 26.424 -23.565 -17.106 1.00 0.00 H new ATOM 483 N ALA A 33 23.652 -30.814 -17.715 1.00 0.00 N ATOM 484 CA ALA A 33 23.145 -32.035 -18.330 1.00 0.00 C ATOM 485 C ALA A 33 21.764 -32.389 -17.789 1.00 0.00 C ATOM 486 O ALA A 33 20.876 -32.787 -18.542 1.00 0.00 O ATOM 487 CB ALA A 33 24.115 -33.184 -18.100 1.00 0.00 C ATOM 0 H ALA A 33 24.563 -30.914 -17.267 1.00 0.00 H new ATOM 0 HA ALA A 33 23.053 -31.862 -19.402 1.00 0.00 H new ATOM 0 HB1 ALA A 33 23.724 -34.089 -18.565 1.00 0.00 H new ATOM 0 HB2 ALA A 33 25.081 -32.938 -18.541 1.00 0.00 H new ATOM 0 HB3 ALA A 33 24.236 -33.349 -17.029 1.00 0.00 H new ATOM 493 N ALA A 34 21.591 -32.243 -16.480 1.00 0.00 N ATOM 494 CA ALA A 34 20.318 -32.547 -15.839 1.00 0.00 C ATOM 495 C ALA A 34 19.234 -31.570 -16.281 1.00 0.00 C ATOM 496 O ALA A 34 18.045 -31.886 -16.241 1.00 0.00 O ATOM 497 CB ALA A 34 20.469 -32.520 -14.325 1.00 0.00 C ATOM 0 H ALA A 34 22.317 -31.916 -15.842 1.00 0.00 H new ATOM 0 HA ALA A 34 20.016 -33.548 -16.145 1.00 0.00 H new ATOM 0 HB1 ALA A 34 19.510 -32.749 -13.860 1.00 0.00 H new ATOM 0 HB2 ALA A 34 21.207 -33.262 -14.020 1.00 0.00 H new ATOM 0 HB3 ALA A 34 20.798 -31.530 -14.010 1.00 0.00 H new ATOM 503 N GLY A 35 19.652 -30.380 -16.703 1.00 0.00 N ATOM 504 CA GLY A 35 18.703 -29.374 -17.145 1.00 0.00 C ATOM 505 C GLY A 35 18.601 -28.209 -16.181 1.00 0.00 C ATOM 506 O GLY A 35 17.534 -27.615 -16.025 1.00 0.00 O ATOM 0 H GLY A 35 20.630 -30.095 -16.747 1.00 0.00 H new ATOM 0 HA2 GLY A 35 19.001 -29.004 -18.126 1.00 0.00 H new ATOM 0 HA3 GLY A 35 17.721 -29.832 -17.262 1.00 0.00 H new ATOM 510 N TYR A 36 19.713 -27.882 -15.531 1.00 0.00 N ATOM 511 CA TYR A 36 19.743 -26.783 -14.574 1.00 0.00 C ATOM 512 C TYR A 36 20.832 -25.778 -14.933 1.00 0.00 C ATOM 513 O TYR A 36 21.609 -25.352 -14.077 1.00 0.00 O ATOM 514 CB TYR A 36 19.973 -27.317 -13.159 1.00 0.00 C ATOM 515 CG TYR A 36 18.906 -28.284 -12.696 1.00 0.00 C ATOM 516 CD1 TYR A 36 17.564 -27.924 -12.705 1.00 0.00 C ATOM 517 CD2 TYR A 36 19.240 -29.556 -12.248 1.00 0.00 C ATOM 518 CE1 TYR A 36 16.586 -28.803 -12.283 1.00 0.00 C ATOM 519 CE2 TYR A 36 18.268 -30.442 -11.825 1.00 0.00 C ATOM 520 CZ TYR A 36 16.943 -30.061 -11.844 1.00 0.00 C ATOM 521 OH TYR A 36 15.972 -30.940 -11.422 1.00 0.00 O ATOM 0 H TYR A 36 20.605 -28.362 -15.650 1.00 0.00 H new ATOM 0 HA TYR A 36 18.779 -26.276 -14.612 1.00 0.00 H new ATOM 0 HB2 TYR A 36 20.943 -27.813 -13.120 1.00 0.00 H new ATOM 0 HB3 TYR A 36 20.016 -26.477 -12.465 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.281 -26.940 -13.048 1.00 0.00 H new ATOM 0 HD2 TYR A 36 20.277 -29.857 -12.230 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.547 -28.507 -12.297 1.00 0.00 H new ATOM 0 HE2 TYR A 36 18.545 -31.428 -11.481 1.00 0.00 H new ATOM 0 HH TYR A 36 16.391 -31.782 -11.146 1.00 0.00 H new ATOM 531 N THR A 37 20.884 -25.401 -16.207 1.00 0.00 N ATOM 532 CA THR A 37 21.878 -24.446 -16.682 1.00 0.00 C ATOM 533 C THR A 37 21.562 -23.036 -16.195 1.00 0.00 C ATOM 534 O THR A 37 22.450 -22.190 -16.098 1.00 0.00 O ATOM 535 CB THR A 37 21.960 -24.439 -18.220 1.00 0.00 C ATOM 536 OG1 THR A 37 20.721 -23.984 -18.775 1.00 0.00 O ATOM 537 CG2 THR A 37 22.280 -25.829 -18.751 1.00 0.00 C ATOM 0 H THR A 37 20.249 -25.743 -16.929 1.00 0.00 H new ATOM 0 HA THR A 37 22.839 -24.761 -16.276 1.00 0.00 H new ATOM 0 HB THR A 37 22.760 -23.761 -18.516 1.00 0.00 H new ATOM 0 HG1 THR A 37 20.782 -23.981 -19.753 1.00 0.00 H new ATOM 0 HG21 THR A 37 22.333 -25.799 -19.839 1.00 0.00 H new ATOM 0 HG22 THR A 37 23.238 -26.160 -18.350 1.00 0.00 H new ATOM 0 HG23 THR A 37 21.499 -26.524 -18.444 1.00 0.00 H new ATOM 545 N ALA A 38 20.292 -22.791 -15.890 1.00 0.00 N ATOM 546 CA ALA A 38 19.860 -21.484 -15.410 1.00 0.00 C ATOM 547 C ALA A 38 19.430 -21.550 -13.949 1.00 0.00 C ATOM 548 O ALA A 38 18.939 -22.579 -13.483 1.00 0.00 O ATOM 549 CB ALA A 38 18.725 -20.954 -16.273 1.00 0.00 C ATOM 0 H ALA A 38 19.544 -23.480 -15.967 1.00 0.00 H new ATOM 0 HA ALA A 38 20.706 -20.800 -15.481 1.00 0.00 H new ATOM 0 HB1 ALA A 38 18.412 -19.977 -15.903 1.00 0.00 H new ATOM 0 HB2 ALA A 38 19.065 -20.860 -17.304 1.00 0.00 H new ATOM 0 HB3 ALA A 38 17.883 -21.645 -16.231 1.00 0.00 H new ATOM 555 N ILE A 39 19.617 -20.448 -13.231 1.00 0.00 N ATOM 556 CA ILE A 39 19.247 -20.382 -11.823 1.00 0.00 C ATOM 557 C ILE A 39 17.736 -20.484 -11.646 1.00 0.00 C ATOM 558 O ILE A 39 17.251 -20.899 -10.594 1.00 0.00 O ATOM 559 CB ILE A 39 19.742 -19.077 -11.171 1.00 0.00 C ATOM 560 CG1 ILE A 39 21.253 -18.929 -11.358 1.00 0.00 C ATOM 561 CG2 ILE A 39 19.380 -19.052 -9.694 1.00 0.00 C ATOM 562 CD1 ILE A 39 22.052 -20.048 -10.727 1.00 0.00 C ATOM 0 H ILE A 39 20.023 -19.589 -13.601 1.00 0.00 H new ATOM 0 HA ILE A 39 19.726 -21.229 -11.331 1.00 0.00 H new ATOM 0 HB ILE A 39 19.251 -18.235 -11.659 1.00 0.00 H new ATOM 0 HG12 ILE A 39 21.477 -18.890 -12.424 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.573 -17.979 -10.930 1.00 0.00 H new ATOM 0 HG21 ILE A 39 19.737 -18.124 -9.248 1.00 0.00 H new ATOM 0 HG22 ILE A 39 18.297 -19.115 -9.584 1.00 0.00 H new ATOM 0 HG23 ILE A 39 19.846 -19.899 -9.191 1.00 0.00 H new ATOM 0 HD11 ILE A 39 23.115 -19.878 -10.899 1.00 0.00 H new ATOM 0 HD12 ILE A 39 21.857 -20.074 -9.655 1.00 0.00 H new ATOM 0 HD13 ILE A 39 21.760 -20.999 -11.172 1.00 0.00 H new ATOM 574 N GLU A 40 16.997 -20.104 -12.683 1.00 0.00 N ATOM 575 CA GLU A 40 15.540 -20.155 -12.642 1.00 0.00 C ATOM 576 C GLU A 40 15.052 -21.574 -12.365 1.00 0.00 C ATOM 577 O GLU A 40 14.024 -21.774 -11.718 1.00 0.00 O ATOM 578 CB GLU A 40 14.953 -19.650 -13.962 1.00 0.00 C ATOM 579 CG GLU A 40 15.561 -18.342 -14.438 1.00 0.00 C ATOM 580 CD GLU A 40 14.643 -17.577 -15.372 1.00 0.00 C ATOM 581 OE1 GLU A 40 14.493 -18.002 -16.537 1.00 0.00 O ATOM 582 OE2 GLU A 40 14.075 -16.553 -14.938 1.00 0.00 O ATOM 0 H GLU A 40 17.383 -19.758 -13.561 1.00 0.00 H new ATOM 0 HA GLU A 40 15.202 -19.509 -11.831 1.00 0.00 H new ATOM 0 HB2 GLU A 40 15.100 -20.410 -14.730 1.00 0.00 H new ATOM 0 HB3 GLU A 40 13.877 -19.519 -13.845 1.00 0.00 H new ATOM 0 HG2 GLU A 40 15.795 -17.719 -13.575 1.00 0.00 H new ATOM 0 HG3 GLU A 40 16.502 -18.548 -14.948 1.00 0.00 H new ATOM 589 N LYS A 41 15.797 -22.556 -12.861 1.00 0.00 N ATOM 590 CA LYS A 41 15.443 -23.957 -12.667 1.00 0.00 C ATOM 591 C LYS A 41 16.191 -24.548 -11.476 1.00 0.00 C ATOM 592 O LYS A 41 15.732 -25.509 -10.857 1.00 0.00 O ATOM 593 CB LYS A 41 15.757 -24.763 -13.930 1.00 0.00 C ATOM 594 CG LYS A 41 15.135 -24.185 -15.190 1.00 0.00 C ATOM 595 CD LYS A 41 16.196 -23.700 -16.164 1.00 0.00 C ATOM 596 CE LYS A 41 15.579 -22.936 -17.325 1.00 0.00 C ATOM 597 NZ LYS A 41 14.950 -21.662 -16.879 1.00 0.00 N ATOM 0 H LYS A 41 16.650 -22.407 -13.400 1.00 0.00 H new ATOM 0 HA LYS A 41 14.373 -24.011 -12.465 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.838 -24.814 -14.059 1.00 0.00 H new ATOM 0 HB3 LYS A 41 15.403 -25.785 -13.796 1.00 0.00 H new ATOM 0 HG2 LYS A 41 14.516 -24.942 -15.672 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.477 -23.357 -14.925 1.00 0.00 H new ATOM 0 HD2 LYS A 41 16.906 -23.059 -15.641 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.758 -24.552 -16.546 1.00 0.00 H new ATOM 0 HE2 LYS A 41 16.347 -22.721 -18.068 1.00 0.00 H new ATOM 0 HE3 LYS A 41 14.830 -23.560 -17.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.482 -21.204 -17.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.246 -21.862 -16.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 15.681 -21.028 -16.498 1.00 0.00 H new ATOM 611 N VAL A 42 17.343 -23.967 -11.159 1.00 0.00 N ATOM 612 CA VAL A 42 18.153 -24.435 -10.040 1.00 0.00 C ATOM 613 C VAL A 42 17.420 -24.248 -8.716 1.00 0.00 C ATOM 614 O VAL A 42 17.722 -24.917 -7.728 1.00 0.00 O ATOM 615 CB VAL A 42 19.502 -23.695 -9.976 1.00 0.00 C ATOM 616 CG1 VAL A 42 20.315 -24.168 -8.781 1.00 0.00 C ATOM 617 CG2 VAL A 42 20.278 -23.890 -11.270 1.00 0.00 C ATOM 0 H VAL A 42 17.737 -23.171 -11.661 1.00 0.00 H new ATOM 0 HA VAL A 42 18.337 -25.497 -10.204 1.00 0.00 H new ATOM 0 HB VAL A 42 19.307 -22.630 -9.853 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.265 -23.634 -8.753 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.761 -23.972 -7.863 1.00 0.00 H new ATOM 0 HG13 VAL A 42 20.503 -25.238 -8.869 1.00 0.00 H new ATOM 0 HG21 VAL A 42 21.229 -23.360 -11.208 1.00 0.00 H new ATOM 0 HG22 VAL A 42 20.464 -24.953 -11.426 1.00 0.00 H new ATOM 0 HG23 VAL A 42 19.698 -23.497 -12.105 1.00 0.00 H new ATOM 627 N VAL A 43 16.455 -23.335 -8.704 1.00 0.00 N ATOM 628 CA VAL A 43 15.677 -23.061 -7.502 1.00 0.00 C ATOM 629 C VAL A 43 14.409 -23.907 -7.463 1.00 0.00 C ATOM 630 O VAL A 43 13.841 -24.140 -6.397 1.00 0.00 O ATOM 631 CB VAL A 43 15.290 -21.573 -7.410 1.00 0.00 C ATOM 632 CG1 VAL A 43 16.535 -20.699 -7.371 1.00 0.00 C ATOM 633 CG2 VAL A 43 14.392 -21.183 -8.575 1.00 0.00 C ATOM 0 H VAL A 43 16.193 -22.772 -9.513 1.00 0.00 H new ATOM 0 HA VAL A 43 16.309 -23.318 -6.652 1.00 0.00 H new ATOM 0 HB VAL A 43 14.735 -21.416 -6.485 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.242 -19.651 -7.306 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.137 -20.962 -6.501 1.00 0.00 H new ATOM 0 HG13 VAL A 43 17.119 -20.857 -8.278 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.128 -20.128 -8.494 1.00 0.00 H new ATOM 0 HG22 VAL A 43 14.919 -21.354 -9.514 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.485 -21.787 -8.553 1.00 0.00 H new ATOM 643 N GLN A 44 13.973 -24.364 -8.632 1.00 0.00 N ATOM 644 CA GLN A 44 12.773 -25.185 -8.731 1.00 0.00 C ATOM 645 C GLN A 44 13.040 -26.603 -8.237 1.00 0.00 C ATOM 646 O GLN A 44 12.197 -27.210 -7.577 1.00 0.00 O ATOM 647 CB GLN A 44 12.272 -25.222 -10.176 1.00 0.00 C ATOM 648 CG GLN A 44 11.817 -23.868 -10.696 1.00 0.00 C ATOM 649 CD GLN A 44 10.462 -23.929 -11.374 1.00 0.00 C ATOM 650 OE1 GLN A 44 9.532 -24.559 -10.872 1.00 0.00 O ATOM 651 NE2 GLN A 44 10.345 -23.271 -12.522 1.00 0.00 N ATOM 0 H GLN A 44 14.433 -24.180 -9.524 1.00 0.00 H new ATOM 0 HA GLN A 44 12.006 -24.738 -8.099 1.00 0.00 H new ATOM 0 HB2 GLN A 44 13.067 -25.600 -10.818 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.443 -25.926 -10.247 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.773 -23.161 -9.868 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.555 -23.487 -11.402 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.143 -22.762 -12.901 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.457 -23.275 -13.024 1.00 0.00 H new ATOM 660 N MET A 45 14.219 -27.125 -8.561 1.00 0.00 N ATOM 661 CA MET A 45 14.598 -28.472 -8.149 1.00 0.00 C ATOM 662 C MET A 45 14.577 -28.601 -6.630 1.00 0.00 C ATOM 663 O MET A 45 14.798 -27.626 -5.910 1.00 0.00 O ATOM 664 CB MET A 45 15.988 -28.820 -8.684 1.00 0.00 C ATOM 665 CG MET A 45 17.060 -27.819 -8.285 1.00 0.00 C ATOM 666 SD MET A 45 18.614 -28.078 -9.164 1.00 0.00 S ATOM 667 CE MET A 45 19.146 -29.636 -8.457 1.00 0.00 C ATOM 0 H MET A 45 14.928 -26.636 -9.107 1.00 0.00 H new ATOM 0 HA MET A 45 13.872 -29.171 -8.565 1.00 0.00 H new ATOM 0 HB2 MET A 45 16.271 -29.808 -8.321 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.945 -28.880 -9.771 1.00 0.00 H new ATOM 0 HG2 MET A 45 16.700 -26.809 -8.481 1.00 0.00 H new ATOM 0 HG3 MET A 45 17.238 -27.891 -7.212 1.00 0.00 H new ATOM 0 HE1 MET A 45 20.221 -29.751 -8.597 1.00 0.00 H new ATOM 0 HE2 MET A 45 18.915 -29.650 -7.392 1.00 0.00 H new ATOM 0 HE3 MET A 45 18.626 -30.456 -8.952 1.00 0.00 H new ATOM 677 N THR A 46 14.312 -29.811 -6.146 1.00 0.00 N ATOM 678 CA THR A 46 14.261 -30.067 -4.713 1.00 0.00 C ATOM 679 C THR A 46 15.505 -30.812 -4.243 1.00 0.00 C ATOM 680 O THR A 46 16.354 -31.192 -5.049 1.00 0.00 O ATOM 681 CB THR A 46 13.013 -30.884 -4.331 1.00 0.00 C ATOM 682 OG1 THR A 46 12.866 -30.919 -2.907 1.00 0.00 O ATOM 683 CG2 THR A 46 13.109 -32.303 -4.871 1.00 0.00 C ATOM 0 H THR A 46 14.129 -30.629 -6.727 1.00 0.00 H new ATOM 0 HA THR A 46 14.214 -29.096 -4.221 1.00 0.00 H new ATOM 0 HB THR A 46 12.141 -30.402 -4.773 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.069 -31.439 -2.673 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.216 -32.861 -4.589 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.190 -32.274 -5.958 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.989 -32.792 -4.454 1.00 0.00 H new ATOM 691 N ASN A 47 15.607 -31.020 -2.934 1.00 0.00 N ATOM 692 CA ASN A 47 16.749 -31.721 -2.358 1.00 0.00 C ATOM 693 C ASN A 47 16.978 -33.056 -3.060 1.00 0.00 C ATOM 694 O ASN A 47 18.118 -33.467 -3.277 1.00 0.00 O ATOM 695 CB ASN A 47 16.530 -31.949 -0.861 1.00 0.00 C ATOM 696 CG ASN A 47 16.006 -30.712 -0.157 1.00 0.00 C ATOM 697 OD1 ASN A 47 16.176 -29.592 -0.639 1.00 0.00 O ATOM 698 ND2 ASN A 47 15.365 -30.911 0.989 1.00 0.00 N ATOM 0 H ASN A 47 14.913 -30.713 -2.252 1.00 0.00 H new ATOM 0 HA ASN A 47 17.634 -31.101 -2.499 1.00 0.00 H new ATOM 0 HB2 ASN A 47 15.826 -32.769 -0.721 1.00 0.00 H new ATOM 0 HB3 ASN A 47 17.470 -32.254 -0.402 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.990 -30.117 1.508 1.00 0.00 H new ATOM 0 HD22 ASN A 47 15.248 -31.858 1.350 1.00 0.00 H new ATOM 705 N ASP A 48 15.888 -33.727 -3.412 1.00 0.00 N ATOM 706 CA ASP A 48 15.969 -35.015 -4.091 1.00 0.00 C ATOM 707 C ASP A 48 16.727 -34.888 -5.409 1.00 0.00 C ATOM 708 O ASP A 48 17.618 -35.684 -5.704 1.00 0.00 O ATOM 709 CB ASP A 48 14.567 -35.571 -4.346 1.00 0.00 C ATOM 710 CG ASP A 48 14.592 -37.013 -4.814 1.00 0.00 C ATOM 711 OD1 ASP A 48 15.698 -37.536 -5.067 1.00 0.00 O ATOM 712 OD2 ASP A 48 13.507 -37.619 -4.926 1.00 0.00 O ATOM 0 H ASP A 48 14.937 -33.401 -3.239 1.00 0.00 H new ATOM 0 HA ASP A 48 16.512 -35.705 -3.445 1.00 0.00 H new ATOM 0 HB2 ASP A 48 13.979 -35.499 -3.431 1.00 0.00 H new ATOM 0 HB3 ASP A 48 14.067 -34.958 -5.095 1.00 0.00 H new ATOM 717 N ASP A 49 16.365 -33.883 -6.198 1.00 0.00 N ATOM 718 CA ASP A 49 17.010 -33.651 -7.485 1.00 0.00 C ATOM 719 C ASP A 49 18.524 -33.555 -7.325 1.00 0.00 C ATOM 720 O ASP A 49 19.280 -34.059 -8.156 1.00 0.00 O ATOM 721 CB ASP A 49 16.471 -32.371 -8.127 1.00 0.00 C ATOM 722 CG ASP A 49 15.021 -32.502 -8.550 1.00 0.00 C ATOM 723 OD1 ASP A 49 14.657 -33.563 -9.099 1.00 0.00 O ATOM 724 OD2 ASP A 49 14.251 -31.543 -8.333 1.00 0.00 O ATOM 0 H ASP A 49 15.628 -33.216 -5.969 1.00 0.00 H new ATOM 0 HA ASP A 49 16.784 -34.497 -8.134 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.568 -31.546 -7.422 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.079 -32.120 -8.996 1.00 0.00 H new ATOM 729 N VAL A 50 18.961 -32.905 -6.251 1.00 0.00 N ATOM 730 CA VAL A 50 20.384 -32.743 -5.981 1.00 0.00 C ATOM 731 C VAL A 50 21.082 -34.095 -5.881 1.00 0.00 C ATOM 732 O VAL A 50 22.294 -34.197 -6.072 1.00 0.00 O ATOM 733 CB VAL A 50 20.623 -31.957 -4.678 1.00 0.00 C ATOM 734 CG1 VAL A 50 22.112 -31.847 -4.386 1.00 0.00 C ATOM 735 CG2 VAL A 50 19.985 -30.579 -4.764 1.00 0.00 C ATOM 0 H VAL A 50 18.349 -32.482 -5.553 1.00 0.00 H new ATOM 0 HA VAL A 50 20.802 -32.182 -6.817 1.00 0.00 H new ATOM 0 HB VAL A 50 20.155 -32.499 -3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 50 22.261 -31.289 -3.462 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.537 -32.845 -4.279 1.00 0.00 H new ATOM 0 HG13 VAL A 50 22.606 -31.328 -5.207 1.00 0.00 H new ATOM 0 HG21 VAL A 50 20.163 -30.037 -3.835 1.00 0.00 H new ATOM 0 HG22 VAL A 50 20.422 -30.027 -5.596 1.00 0.00 H new ATOM 0 HG23 VAL A 50 18.912 -30.684 -4.922 1.00 0.00 H new ATOM 745 N LYS A 51 20.308 -35.133 -5.580 1.00 0.00 N ATOM 746 CA LYS A 51 20.850 -36.481 -5.456 1.00 0.00 C ATOM 747 C LYS A 51 20.787 -37.217 -6.790 1.00 0.00 C ATOM 748 O LYS A 51 21.447 -38.240 -6.976 1.00 0.00 O ATOM 749 CB LYS A 51 20.081 -37.265 -4.391 1.00 0.00 C ATOM 750 CG LYS A 51 20.154 -36.644 -3.006 1.00 0.00 C ATOM 751 CD LYS A 51 19.582 -37.573 -1.948 1.00 0.00 C ATOM 752 CE LYS A 51 20.422 -38.833 -1.799 1.00 0.00 C ATOM 753 NZ LYS A 51 19.606 -40.066 -1.973 1.00 0.00 N ATOM 0 H LYS A 51 19.303 -35.066 -5.417 1.00 0.00 H new ATOM 0 HA LYS A 51 21.895 -36.400 -5.155 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.036 -37.340 -4.691 1.00 0.00 H new ATOM 0 HB3 LYS A 51 20.474 -38.281 -4.346 1.00 0.00 H new ATOM 0 HG2 LYS A 51 21.191 -36.411 -2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 51 19.606 -35.702 -2.999 1.00 0.00 H new ATOM 0 HD2 LYS A 51 19.534 -37.051 -0.992 1.00 0.00 H new ATOM 0 HD3 LYS A 51 18.561 -37.845 -2.215 1.00 0.00 H new ATOM 0 HE2 LYS A 51 21.226 -38.823 -2.535 1.00 0.00 H new ATOM 0 HE3 LYS A 51 20.890 -38.843 -0.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 20.214 -40.903 -1.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 18.854 -40.089 -1.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 19.179 -40.069 -2.921 1.00 0.00 H new ATOM 767 N ARG A 52 19.991 -36.691 -7.714 1.00 0.00 N ATOM 768 CA ARG A 52 19.843 -37.299 -9.031 1.00 0.00 C ATOM 769 C ARG A 52 20.818 -36.680 -10.029 1.00 0.00 C ATOM 770 O ARG A 52 21.299 -37.353 -10.941 1.00 0.00 O ATOM 771 CB ARG A 52 18.408 -37.133 -9.534 1.00 0.00 C ATOM 772 CG ARG A 52 18.165 -37.758 -10.898 1.00 0.00 C ATOM 773 CD ARG A 52 16.693 -38.078 -11.110 1.00 0.00 C ATOM 774 NE ARG A 52 16.396 -39.484 -10.846 1.00 0.00 N ATOM 775 CZ ARG A 52 16.688 -40.468 -11.689 1.00 0.00 C ATOM 776 NH1 ARG A 52 17.283 -40.201 -12.844 1.00 0.00 N ATOM 777 NH2 ARG A 52 16.385 -41.721 -11.378 1.00 0.00 N ATOM 0 H ARG A 52 19.438 -35.845 -7.575 1.00 0.00 H new ATOM 0 HA ARG A 52 20.069 -38.361 -8.940 1.00 0.00 H new ATOM 0 HB2 ARG A 52 17.725 -37.580 -8.812 1.00 0.00 H new ATOM 0 HB3 ARG A 52 18.170 -36.071 -9.583 1.00 0.00 H new ATOM 0 HG2 ARG A 52 18.506 -37.077 -11.678 1.00 0.00 H new ATOM 0 HG3 ARG A 52 18.754 -38.670 -10.992 1.00 0.00 H new ATOM 0 HD2 ARG A 52 16.088 -37.450 -10.456 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.413 -37.834 -12.135 1.00 0.00 H new ATOM 0 HE ARG A 52 15.939 -39.723 -9.966 1.00 0.00 H new ATOM 0 HH11 ARG A 52 17.517 -39.238 -13.086 1.00 0.00 H new ATOM 0 HH12 ARG A 52 17.506 -40.958 -13.490 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.927 -41.930 -10.491 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.610 -42.476 -12.026 1.00 0.00 H new ATOM 791 N ILE A 53 21.104 -35.395 -9.849 1.00 0.00 N ATOM 792 CA ILE A 53 22.021 -34.686 -10.733 1.00 0.00 C ATOM 793 C ILE A 53 23.368 -35.396 -10.811 1.00 0.00 C ATOM 794 O ILE A 53 24.069 -35.312 -11.818 1.00 0.00 O ATOM 795 CB ILE A 53 22.245 -33.236 -10.266 1.00 0.00 C ATOM 796 CG1 ILE A 53 22.635 -33.207 -8.787 1.00 0.00 C ATOM 797 CG2 ILE A 53 20.994 -32.403 -10.505 1.00 0.00 C ATOM 798 CD1 ILE A 53 23.181 -31.872 -8.331 1.00 0.00 C ATOM 0 H ILE A 53 20.714 -34.824 -9.099 1.00 0.00 H new ATOM 0 HA ILE A 53 21.561 -34.674 -11.721 1.00 0.00 H new ATOM 0 HB ILE A 53 23.061 -32.806 -10.846 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.762 -33.458 -8.185 1.00 0.00 H new ATOM 0 HG13 ILE A 53 23.383 -33.978 -8.602 1.00 0.00 H new ATOM 0 HG21 ILE A 53 21.168 -31.381 -10.170 1.00 0.00 H new ATOM 0 HG22 ILE A 53 20.756 -32.401 -11.569 1.00 0.00 H new ATOM 0 HG23 ILE A 53 20.160 -32.830 -9.948 1.00 0.00 H new ATOM 0 HD11 ILE A 53 23.436 -31.926 -7.273 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.073 -31.628 -8.907 1.00 0.00 H new ATOM 0 HD13 ILE A 53 22.428 -31.099 -8.484 1.00 0.00 H new ATOM 810 N GLY A 54 23.724 -36.099 -9.739 1.00 0.00 N ATOM 811 CA GLY A 54 24.985 -36.816 -9.707 1.00 0.00 C ATOM 812 C GLY A 54 25.586 -36.870 -8.317 1.00 0.00 C ATOM 813 O GLY A 54 26.201 -37.867 -7.937 1.00 0.00 O ATOM 0 H GLY A 54 23.161 -36.184 -8.893 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.831 -37.831 -10.073 1.00 0.00 H new ATOM 0 HA3 GLY A 54 25.690 -36.336 -10.386 1.00 0.00 H new ATOM 817 N VAL A 55 25.411 -35.794 -7.556 1.00 0.00 N ATOM 818 CA VAL A 55 25.942 -35.723 -6.200 1.00 0.00 C ATOM 819 C VAL A 55 25.344 -36.814 -5.318 1.00 0.00 C ATOM 820 O VAL A 55 24.133 -36.857 -5.102 1.00 0.00 O ATOM 821 CB VAL A 55 25.662 -34.350 -5.559 1.00 0.00 C ATOM 822 CG1 VAL A 55 26.413 -34.211 -4.244 1.00 0.00 C ATOM 823 CG2 VAL A 55 26.038 -33.230 -6.518 1.00 0.00 C ATOM 0 H VAL A 55 24.906 -34.960 -7.856 1.00 0.00 H new ATOM 0 HA VAL A 55 27.020 -35.869 -6.274 1.00 0.00 H new ATOM 0 HB VAL A 55 24.595 -34.276 -5.349 1.00 0.00 H new ATOM 0 HG11 VAL A 55 26.203 -33.235 -3.806 1.00 0.00 H new ATOM 0 HG12 VAL A 55 26.091 -34.994 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 55 27.484 -34.304 -4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 55 25.834 -32.267 -6.050 1.00 0.00 H new ATOM 0 HG22 VAL A 55 27.099 -33.299 -6.760 1.00 0.00 H new ATOM 0 HG23 VAL A 55 25.451 -33.321 -7.432 1.00 0.00 H new ATOM 833 N ARG A 56 26.202 -37.692 -4.810 1.00 0.00 N ATOM 834 CA ARG A 56 25.759 -38.784 -3.951 1.00 0.00 C ATOM 835 C ARG A 56 26.408 -38.690 -2.573 1.00 0.00 C ATOM 836 O ARG A 56 26.007 -39.383 -1.638 1.00 0.00 O ATOM 837 CB ARG A 56 26.092 -40.133 -4.592 1.00 0.00 C ATOM 838 CG ARG A 56 27.506 -40.212 -5.145 1.00 0.00 C ATOM 839 CD ARG A 56 27.506 -40.298 -6.663 1.00 0.00 C ATOM 840 NE ARG A 56 28.078 -41.555 -7.140 1.00 0.00 N ATOM 841 CZ ARG A 56 27.399 -42.696 -7.198 1.00 0.00 C ATOM 842 NH1 ARG A 56 26.132 -42.737 -6.812 1.00 0.00 N ATOM 843 NH2 ARG A 56 27.989 -43.798 -7.643 1.00 0.00 N ATOM 0 H ARG A 56 27.208 -37.669 -4.978 1.00 0.00 H new ATOM 0 HA ARG A 56 24.679 -38.703 -3.831 1.00 0.00 H new ATOM 0 HB2 ARG A 56 25.956 -40.921 -3.851 1.00 0.00 H new ATOM 0 HB3 ARG A 56 25.384 -40.327 -5.398 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.071 -39.335 -4.829 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.012 -41.084 -4.730 1.00 0.00 H new ATOM 0 HD2 ARG A 56 26.485 -40.201 -7.032 1.00 0.00 H new ATOM 0 HD3 ARG A 56 28.073 -39.463 -7.073 1.00 0.00 H new ATOM 0 HE ARG A 56 29.051 -41.557 -7.445 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.676 -41.892 -6.469 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.613 -43.614 -6.858 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.964 -43.770 -7.941 1.00 0.00 H new ATOM 0 HH22 ARG A 56 27.467 -44.673 -7.687 1.00 0.00 H new ATOM 857 N LEU A 57 27.412 -37.828 -2.456 1.00 0.00 N ATOM 858 CA LEU A 57 28.118 -37.643 -1.193 1.00 0.00 C ATOM 859 C LEU A 57 27.236 -36.924 -0.177 1.00 0.00 C ATOM 860 O LEU A 57 26.300 -36.206 -0.529 1.00 0.00 O ATOM 861 CB LEU A 57 29.407 -36.850 -1.417 1.00 0.00 C ATOM 862 CG LEU A 57 30.620 -37.658 -1.881 1.00 0.00 C ATOM 863 CD1 LEU A 57 31.033 -38.660 -0.814 1.00 0.00 C ATOM 864 CD2 LEU A 57 30.317 -38.368 -3.193 1.00 0.00 C ATOM 0 H LEU A 57 27.755 -37.246 -3.220 1.00 0.00 H new ATOM 0 HA LEU A 57 28.369 -38.627 -0.798 1.00 0.00 H new ATOM 0 HB2 LEU A 57 29.209 -36.074 -2.156 1.00 0.00 H new ATOM 0 HB3 LEU A 57 29.666 -36.346 -0.486 1.00 0.00 H new ATOM 0 HG LEU A 57 31.450 -36.971 -2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 57 31.897 -39.226 -1.161 1.00 0.00 H new ATOM 0 HD12 LEU A 57 31.291 -38.130 0.103 1.00 0.00 H new ATOM 0 HD13 LEU A 57 30.207 -39.344 -0.618 1.00 0.00 H new ATOM 0 HD21 LEU A 57 31.191 -38.938 -3.508 1.00 0.00 H new ATOM 0 HD22 LEU A 57 29.473 -39.044 -3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 57 30.070 -37.631 -3.957 1.00 0.00 H new ATOM 876 N PRO A 58 27.541 -37.119 1.115 1.00 0.00 N ATOM 877 CA PRO A 58 26.790 -36.496 2.208 1.00 0.00 C ATOM 878 C PRO A 58 27.014 -34.989 2.281 1.00 0.00 C ATOM 879 O PRO A 58 26.064 -34.213 2.366 1.00 0.00 O ATOM 880 CB PRO A 58 27.348 -37.181 3.458 1.00 0.00 C ATOM 881 CG PRO A 58 28.718 -37.620 3.069 1.00 0.00 C ATOM 882 CD PRO A 58 28.643 -37.962 1.607 1.00 0.00 C ATOM 0 HA PRO A 58 25.714 -36.617 2.083 1.00 0.00 H new ATOM 0 HB2 PRO A 58 27.377 -36.496 4.305 1.00 0.00 H new ATOM 0 HB3 PRO A 58 26.730 -38.028 3.755 1.00 0.00 H new ATOM 0 HG2 PRO A 58 29.447 -36.829 3.248 1.00 0.00 H new ATOM 0 HG3 PRO A 58 29.033 -38.483 3.656 1.00 0.00 H new ATOM 0 HD2 PRO A 58 29.579 -37.740 1.094 1.00 0.00 H new ATOM 0 HD3 PRO A 58 28.438 -39.021 1.452 1.00 0.00 H new ATOM 890 N GLY A 59 28.280 -34.582 2.247 1.00 0.00 N ATOM 891 CA GLY A 59 28.606 -33.169 2.310 1.00 0.00 C ATOM 892 C GLY A 59 28.287 -32.443 1.018 1.00 0.00 C ATOM 893 O GLY A 59 27.654 -31.387 1.031 1.00 0.00 O ATOM 0 H GLY A 59 29.085 -35.205 2.177 1.00 0.00 H new ATOM 0 HA2 GLY A 59 28.053 -32.708 3.128 1.00 0.00 H new ATOM 0 HA3 GLY A 59 29.666 -33.053 2.536 1.00 0.00 H new ATOM 897 N HIS A 60 28.729 -33.008 -0.101 1.00 0.00 N ATOM 898 CA HIS A 60 28.488 -32.406 -1.408 1.00 0.00 C ATOM 899 C HIS A 60 27.008 -32.084 -1.593 1.00 0.00 C ATOM 900 O HIS A 60 26.653 -31.135 -2.292 1.00 0.00 O ATOM 901 CB HIS A 60 28.961 -33.343 -2.519 1.00 0.00 C ATOM 902 CG HIS A 60 30.428 -33.640 -2.467 1.00 0.00 C ATOM 903 ND1 HIS A 60 31.070 -34.424 -3.403 1.00 0.00 N ATOM 904 CD2 HIS A 60 31.379 -33.253 -1.586 1.00 0.00 C ATOM 905 CE1 HIS A 60 32.353 -34.507 -3.098 1.00 0.00 C ATOM 906 NE2 HIS A 60 32.567 -33.805 -1.999 1.00 0.00 N ATOM 0 H HIS A 60 29.256 -33.881 -0.129 1.00 0.00 H new ATOM 0 HA HIS A 60 29.054 -31.476 -1.462 1.00 0.00 H new ATOM 0 HB2 HIS A 60 28.406 -34.279 -2.454 1.00 0.00 H new ATOM 0 HB3 HIS A 60 28.723 -32.898 -3.485 1.00 0.00 H new ATOM 0 HD2 HIS A 60 31.231 -32.626 -0.719 1.00 0.00 H new ATOM 0 HE1 HIS A 60 33.100 -35.055 -3.653 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.467 -33.692 -1.533 1.00 0.00 H new ATOM 914 N GLN A 61 26.150 -32.881 -0.964 1.00 0.00 N ATOM 915 CA GLN A 61 24.709 -32.681 -1.061 1.00 0.00 C ATOM 916 C GLN A 61 24.266 -31.495 -0.213 1.00 0.00 C ATOM 917 O GLN A 61 23.630 -30.564 -0.710 1.00 0.00 O ATOM 918 CB GLN A 61 23.967 -33.944 -0.621 1.00 0.00 C ATOM 919 CG GLN A 61 23.859 -34.998 -1.712 1.00 0.00 C ATOM 920 CD GLN A 61 23.158 -36.256 -1.240 1.00 0.00 C ATOM 921 OE1 GLN A 61 22.473 -36.253 -0.217 1.00 0.00 O ATOM 922 NE2 GLN A 61 23.327 -37.343 -1.985 1.00 0.00 N ATOM 0 H GLN A 61 26.428 -33.671 -0.382 1.00 0.00 H new ATOM 0 HA GLN A 61 24.466 -32.470 -2.102 1.00 0.00 H new ATOM 0 HB2 GLN A 61 24.479 -34.375 0.239 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.965 -33.670 -0.291 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.318 -34.582 -2.562 1.00 0.00 H new ATOM 0 HG3 GLN A 61 24.858 -35.254 -2.065 1.00 0.00 H new ATOM 0 HE21 GLN A 61 23.903 -37.301 -2.825 1.00 0.00 H new ATOM 0 HE22 GLN A 61 22.880 -38.220 -1.716 1.00 0.00 H new ATOM 931 N LYS A 62 24.604 -31.533 1.072 1.00 0.00 N ATOM 932 CA LYS A 62 24.241 -30.461 1.991 1.00 0.00 C ATOM 933 C LYS A 62 24.811 -29.126 1.522 1.00 0.00 C ATOM 934 O LYS A 62 24.165 -28.086 1.649 1.00 0.00 O ATOM 935 CB LYS A 62 24.748 -30.776 3.400 1.00 0.00 C ATOM 936 CG LYS A 62 24.087 -31.993 4.026 1.00 0.00 C ATOM 937 CD LYS A 62 23.515 -31.674 5.397 1.00 0.00 C ATOM 938 CE LYS A 62 24.610 -31.565 6.446 1.00 0.00 C ATOM 939 NZ LYS A 62 24.056 -31.280 7.799 1.00 0.00 N ATOM 0 H LYS A 62 25.129 -32.295 1.500 1.00 0.00 H new ATOM 0 HA LYS A 62 23.154 -30.386 2.010 1.00 0.00 H new ATOM 0 HB2 LYS A 62 25.825 -30.937 3.362 1.00 0.00 H new ATOM 0 HB3 LYS A 62 24.578 -29.911 4.040 1.00 0.00 H new ATOM 0 HG2 LYS A 62 23.291 -32.352 3.373 1.00 0.00 H new ATOM 0 HG3 LYS A 62 24.815 -32.799 4.113 1.00 0.00 H new ATOM 0 HD2 LYS A 62 22.959 -30.738 5.351 1.00 0.00 H new ATOM 0 HD3 LYS A 62 22.808 -32.451 5.687 1.00 0.00 H new ATOM 0 HE2 LYS A 62 25.179 -32.494 6.475 1.00 0.00 H new ATOM 0 HE3 LYS A 62 25.305 -30.774 6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 24.834 -31.213 8.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 23.534 -30.381 7.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 23.412 -32.047 8.079 1.00 0.00 H new ATOM 953 N ARG A 63 26.024 -29.163 0.979 1.00 0.00 N ATOM 954 CA ARG A 63 26.680 -27.956 0.491 1.00 0.00 C ATOM 955 C ARG A 63 25.803 -27.236 -0.530 1.00 0.00 C ATOM 956 O ARG A 63 25.698 -26.009 -0.515 1.00 0.00 O ATOM 957 CB ARG A 63 28.031 -28.303 -0.137 1.00 0.00 C ATOM 958 CG ARG A 63 28.960 -27.109 -0.282 1.00 0.00 C ATOM 959 CD ARG A 63 30.324 -27.387 0.329 1.00 0.00 C ATOM 960 NE ARG A 63 30.908 -26.192 0.932 1.00 0.00 N ATOM 961 CZ ARG A 63 32.158 -26.129 1.377 1.00 0.00 C ATOM 962 NH1 ARG A 63 32.952 -27.188 1.287 1.00 0.00 N ATOM 963 NH2 ARG A 63 32.617 -25.006 1.913 1.00 0.00 N ATOM 0 H ARG A 63 26.572 -30.016 0.866 1.00 0.00 H new ATOM 0 HA ARG A 63 26.841 -27.291 1.340 1.00 0.00 H new ATOM 0 HB2 ARG A 63 28.521 -29.062 0.473 1.00 0.00 H new ATOM 0 HB3 ARG A 63 27.863 -28.743 -1.120 1.00 0.00 H new ATOM 0 HG2 ARG A 63 29.076 -26.863 -1.338 1.00 0.00 H new ATOM 0 HG3 ARG A 63 28.514 -26.239 0.201 1.00 0.00 H new ATOM 0 HD2 ARG A 63 30.230 -28.166 1.086 1.00 0.00 H new ATOM 0 HD3 ARG A 63 30.995 -27.769 -0.440 1.00 0.00 H new ATOM 0 HE ARG A 63 30.324 -25.360 1.016 1.00 0.00 H new ATOM 0 HH11 ARG A 63 32.603 -28.054 0.875 1.00 0.00 H new ATOM 0 HH12 ARG A 63 33.911 -27.137 1.630 1.00 0.00 H new ATOM 0 HH21 ARG A 63 32.010 -24.189 1.984 1.00 0.00 H new ATOM 0 HH22 ARG A 63 33.577 -24.959 2.254 1.00 0.00 H new ATOM 977 N ILE A 64 25.177 -28.006 -1.413 1.00 0.00 N ATOM 978 CA ILE A 64 24.310 -27.441 -2.439 1.00 0.00 C ATOM 979 C ILE A 64 22.914 -27.166 -1.889 1.00 0.00 C ATOM 980 O ILE A 64 22.370 -26.077 -2.065 1.00 0.00 O ATOM 981 CB ILE A 64 24.194 -28.378 -3.656 1.00 0.00 C ATOM 982 CG1 ILE A 64 25.576 -28.643 -4.256 1.00 0.00 C ATOM 983 CG2 ILE A 64 23.264 -27.777 -4.700 1.00 0.00 C ATOM 984 CD1 ILE A 64 25.549 -29.570 -5.451 1.00 0.00 C ATOM 0 H ILE A 64 25.254 -29.023 -1.439 1.00 0.00 H new ATOM 0 HA ILE A 64 24.765 -26.502 -2.755 1.00 0.00 H new ATOM 0 HB ILE A 64 23.773 -29.328 -3.326 1.00 0.00 H new ATOM 0 HG12 ILE A 64 26.022 -27.694 -4.553 1.00 0.00 H new ATOM 0 HG13 ILE A 64 26.220 -29.072 -3.488 1.00 0.00 H new ATOM 0 HG21 ILE A 64 23.192 -28.450 -5.554 1.00 0.00 H new ATOM 0 HG22 ILE A 64 22.274 -27.634 -4.266 1.00 0.00 H new ATOM 0 HG23 ILE A 64 23.659 -26.816 -5.028 1.00 0.00 H new ATOM 0 HD11 ILE A 64 26.563 -29.712 -5.824 1.00 0.00 H new ATOM 0 HD12 ILE A 64 25.133 -30.533 -5.155 1.00 0.00 H new ATOM 0 HD13 ILE A 64 24.932 -29.134 -6.236 1.00 0.00 H new ATOM 996 N ALA A 65 22.341 -28.162 -1.220 1.00 0.00 N ATOM 997 CA ALA A 65 21.011 -28.026 -0.640 1.00 0.00 C ATOM 998 C ALA A 65 20.918 -26.782 0.236 1.00 0.00 C ATOM 999 O ALA A 65 19.962 -26.012 0.140 1.00 0.00 O ATOM 1000 CB ALA A 65 20.656 -29.268 0.164 1.00 0.00 C ATOM 0 H ALA A 65 22.777 -29.071 -1.067 1.00 0.00 H new ATOM 0 HA ALA A 65 20.296 -27.918 -1.455 1.00 0.00 H new ATOM 0 HB1 ALA A 65 19.660 -29.152 0.591 1.00 0.00 H new ATOM 0 HB2 ALA A 65 20.672 -30.141 -0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 65 21.382 -29.402 0.966 1.00 0.00 H new ATOM 1006 N TYR A 66 21.917 -26.590 1.091 1.00 0.00 N ATOM 1007 CA TYR A 66 21.947 -25.441 1.987 1.00 0.00 C ATOM 1008 C TYR A 66 22.013 -24.137 1.199 1.00 0.00 C ATOM 1009 O TYR A 66 21.471 -23.115 1.620 1.00 0.00 O ATOM 1010 CB TYR A 66 23.143 -25.538 2.935 1.00 0.00 C ATOM 1011 CG TYR A 66 23.036 -24.630 4.140 1.00 0.00 C ATOM 1012 CD1 TYR A 66 21.858 -24.552 4.873 1.00 0.00 C ATOM 1013 CD2 TYR A 66 24.112 -23.849 4.544 1.00 0.00 C ATOM 1014 CE1 TYR A 66 21.755 -23.723 5.974 1.00 0.00 C ATOM 1015 CE2 TYR A 66 24.019 -23.019 5.644 1.00 0.00 C ATOM 1016 CZ TYR A 66 22.838 -22.959 6.356 1.00 0.00 C ATOM 1017 OH TYR A 66 22.741 -22.132 7.451 1.00 0.00 O ATOM 0 H TYR A 66 22.717 -27.216 1.182 1.00 0.00 H new ATOM 0 HA TYR A 66 21.027 -25.445 2.572 1.00 0.00 H new ATOM 0 HB2 TYR A 66 23.244 -26.569 3.275 1.00 0.00 H new ATOM 0 HB3 TYR A 66 24.052 -25.293 2.386 1.00 0.00 H new ATOM 0 HD1 TYR A 66 21.008 -25.149 4.577 1.00 0.00 H new ATOM 0 HD2 TYR A 66 25.037 -23.892 3.988 1.00 0.00 H new ATOM 0 HE1 TYR A 66 20.832 -23.674 6.532 1.00 0.00 H new ATOM 0 HE2 TYR A 66 24.866 -22.420 5.945 1.00 0.00 H new ATOM 0 HH TYR A 66 23.592 -21.665 7.585 1.00 0.00 H new ATOM 1027 N SER A 67 22.681 -24.180 0.050 1.00 0.00 N ATOM 1028 CA SER A 67 22.821 -23.002 -0.798 1.00 0.00 C ATOM 1029 C SER A 67 21.526 -22.718 -1.552 1.00 0.00 C ATOM 1030 O SER A 67 21.184 -21.562 -1.807 1.00 0.00 O ATOM 1031 CB SER A 67 23.970 -23.196 -1.789 1.00 0.00 C ATOM 1032 OG SER A 67 24.895 -22.124 -1.714 1.00 0.00 O ATOM 0 H SER A 67 23.134 -25.018 -0.315 1.00 0.00 H new ATOM 0 HA SER A 67 23.042 -22.148 -0.158 1.00 0.00 H new ATOM 0 HB2 SER A 67 24.480 -24.136 -1.579 1.00 0.00 H new ATOM 0 HB3 SER A 67 23.573 -23.268 -2.802 1.00 0.00 H new ATOM 0 HG SER A 67 24.911 -21.646 -2.569 1.00 0.00 H new ATOM 1038 N LEU A 68 20.809 -23.779 -1.905 1.00 0.00 N ATOM 1039 CA LEU A 68 19.551 -23.645 -2.630 1.00 0.00 C ATOM 1040 C LEU A 68 18.537 -22.845 -1.818 1.00 0.00 C ATOM 1041 O LEU A 68 17.713 -22.119 -2.376 1.00 0.00 O ATOM 1042 CB LEU A 68 18.981 -25.026 -2.961 1.00 0.00 C ATOM 1043 CG LEU A 68 19.617 -25.748 -4.149 1.00 0.00 C ATOM 1044 CD1 LEU A 68 18.990 -27.120 -4.337 1.00 0.00 C ATOM 1045 CD2 LEU A 68 19.477 -24.916 -5.415 1.00 0.00 C ATOM 0 H LEU A 68 21.077 -24.742 -1.701 1.00 0.00 H new ATOM 0 HA LEU A 68 19.750 -23.109 -3.558 1.00 0.00 H new ATOM 0 HB2 LEU A 68 19.083 -25.660 -2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 68 17.914 -24.919 -3.155 1.00 0.00 H new ATOM 0 HG LEU A 68 20.679 -25.883 -3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 68 19.455 -27.619 -5.187 1.00 0.00 H new ATOM 0 HD12 LEU A 68 19.143 -27.716 -3.438 1.00 0.00 H new ATOM 0 HD13 LEU A 68 17.921 -27.010 -4.521 1.00 0.00 H new ATOM 0 HD21 LEU A 68 19.935 -25.445 -6.251 1.00 0.00 H new ATOM 0 HD22 LEU A 68 18.421 -24.750 -5.626 1.00 0.00 H new ATOM 0 HD23 LEU A 68 19.975 -23.956 -5.277 1.00 0.00 H new ATOM 1057 N LEU A 69 18.605 -22.980 -0.498 1.00 0.00 N ATOM 1058 CA LEU A 69 17.694 -22.268 0.391 1.00 0.00 C ATOM 1059 C LEU A 69 17.784 -20.762 0.170 1.00 0.00 C ATOM 1060 O LEU A 69 16.771 -20.091 -0.020 1.00 0.00 O ATOM 1061 CB LEU A 69 18.011 -22.601 1.850 1.00 0.00 C ATOM 1062 CG LEU A 69 18.252 -24.078 2.165 1.00 0.00 C ATOM 1063 CD1 LEU A 69 18.474 -24.276 3.657 1.00 0.00 C ATOM 1064 CD2 LEU A 69 17.083 -24.923 1.681 1.00 0.00 C ATOM 0 H LEU A 69 19.281 -23.576 -0.020 1.00 0.00 H new ATOM 0 HA LEU A 69 16.678 -22.590 0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 69 18.896 -22.038 2.146 1.00 0.00 H new ATOM 0 HB3 LEU A 69 17.187 -22.248 2.470 1.00 0.00 H new ATOM 0 HG LEU A 69 19.150 -24.401 1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 69 18.644 -25.333 3.862 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.343 -23.700 3.975 1.00 0.00 H new ATOM 0 HD13 LEU A 69 17.594 -23.937 4.204 1.00 0.00 H new ATOM 0 HD21 LEU A 69 17.271 -25.971 1.913 1.00 0.00 H new ATOM 0 HD22 LEU A 69 16.169 -24.599 2.179 1.00 0.00 H new ATOM 0 HD23 LEU A 69 16.970 -24.805 0.603 1.00 0.00 H new ATOM 1076 N GLY A 70 19.005 -20.237 0.195 1.00 0.00 N ATOM 1077 CA GLY A 70 19.205 -18.813 -0.006 1.00 0.00 C ATOM 1078 C GLY A 70 18.694 -18.341 -1.353 1.00 0.00 C ATOM 1079 O GLY A 70 18.222 -17.211 -1.485 1.00 0.00 O ATOM 0 H GLY A 70 19.859 -20.772 0.351 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.697 -18.262 0.785 1.00 0.00 H new ATOM 0 HA3 GLY A 70 20.267 -18.583 0.077 1.00 0.00 H new ATOM 1083 N LEU A 71 18.790 -19.206 -2.357 1.00 0.00 N ATOM 1084 CA LEU A 71 18.335 -18.871 -3.702 1.00 0.00 C ATOM 1085 C LEU A 71 16.842 -18.561 -3.710 1.00 0.00 C ATOM 1086 O LEU A 71 16.430 -17.445 -4.028 1.00 0.00 O ATOM 1087 CB LEU A 71 18.634 -20.022 -4.664 1.00 0.00 C ATOM 1088 CG LEU A 71 20.111 -20.369 -4.857 1.00 0.00 C ATOM 1089 CD1 LEU A 71 20.263 -21.536 -5.820 1.00 0.00 C ATOM 1090 CD2 LEU A 71 20.882 -19.157 -5.359 1.00 0.00 C ATOM 0 H LEU A 71 19.179 -20.144 -2.265 1.00 0.00 H new ATOM 0 HA LEU A 71 18.873 -17.982 -4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 71 18.116 -20.912 -4.306 1.00 0.00 H new ATOM 0 HB3 LEU A 71 18.209 -19.775 -5.637 1.00 0.00 H new ATOM 0 HG LEU A 71 20.525 -20.664 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 71 21.320 -21.769 -5.945 1.00 0.00 H new ATOM 0 HD12 LEU A 71 19.744 -22.407 -5.420 1.00 0.00 H new ATOM 0 HD13 LEU A 71 19.833 -21.269 -6.786 1.00 0.00 H new ATOM 0 HD21 LEU A 71 21.931 -19.422 -5.491 1.00 0.00 H new ATOM 0 HD22 LEU A 71 20.467 -18.832 -6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 71 20.801 -18.348 -4.633 1.00 0.00 H new ATOM 1102 N LYS A 72 16.034 -19.555 -3.356 1.00 0.00 N ATOM 1103 CA LYS A 72 14.586 -19.389 -3.319 1.00 0.00 C ATOM 1104 C LYS A 72 14.199 -18.174 -2.481 1.00 0.00 C ATOM 1105 O LYS A 72 13.175 -17.538 -2.731 1.00 0.00 O ATOM 1106 CB LYS A 72 13.923 -20.646 -2.751 1.00 0.00 C ATOM 1107 CG LYS A 72 14.277 -21.915 -3.507 1.00 0.00 C ATOM 1108 CD LYS A 72 14.177 -23.141 -2.615 1.00 0.00 C ATOM 1109 CE LYS A 72 15.247 -24.166 -2.955 1.00 0.00 C ATOM 1110 NZ LYS A 72 14.671 -25.373 -3.611 1.00 0.00 N ATOM 0 H LYS A 72 16.358 -20.485 -3.090 1.00 0.00 H new ATOM 0 HA LYS A 72 14.237 -19.231 -4.339 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.216 -20.761 -1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 72 12.841 -20.514 -2.766 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.609 -22.029 -4.361 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.289 -21.833 -3.903 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.276 -22.842 -1.572 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.191 -23.593 -2.725 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.987 -23.713 -3.614 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.769 -24.462 -2.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.402 -26.108 -3.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 13.878 -25.732 -3.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 14.330 -25.122 -4.561 1.00 0.00 H new ATOM 1124 N ASP A 73 15.024 -17.859 -1.489 1.00 0.00 N ATOM 1125 CA ASP A 73 14.769 -16.718 -0.617 1.00 0.00 C ATOM 1126 C ASP A 73 15.067 -15.406 -1.336 1.00 0.00 C ATOM 1127 O ASP A 73 14.256 -14.481 -1.319 1.00 0.00 O ATOM 1128 CB ASP A 73 15.616 -16.822 0.653 1.00 0.00 C ATOM 1129 CG ASP A 73 14.980 -16.111 1.832 1.00 0.00 C ATOM 1130 OD1 ASP A 73 13.861 -16.501 2.228 1.00 0.00 O ATOM 1131 OD2 ASP A 73 15.601 -15.165 2.359 1.00 0.00 O ATOM 0 H ASP A 73 15.875 -18.377 -1.268 1.00 0.00 H new ATOM 0 HA ASP A 73 13.714 -16.729 -0.344 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.764 -17.873 0.903 1.00 0.00 H new ATOM 0 HB3 ASP A 73 16.602 -16.397 0.465 1.00 0.00 H new ATOM 1136 N GLN A 74 16.236 -15.334 -1.965 1.00 0.00 N ATOM 1137 CA GLN A 74 16.641 -14.135 -2.688 1.00 0.00 C ATOM 1138 C GLN A 74 15.613 -13.768 -3.754 1.00 0.00 C ATOM 1139 O GLN A 74 15.125 -12.639 -3.798 1.00 0.00 O ATOM 1140 CB GLN A 74 18.011 -14.342 -3.335 1.00 0.00 C ATOM 1141 CG GLN A 74 19.126 -14.589 -2.332 1.00 0.00 C ATOM 1142 CD GLN A 74 20.001 -13.368 -2.120 1.00 0.00 C ATOM 1143 OE1 GLN A 74 19.537 -12.232 -2.222 1.00 0.00 O ATOM 1144 NE2 GLN A 74 21.274 -13.597 -1.821 1.00 0.00 N ATOM 0 H GLN A 74 16.919 -16.092 -1.988 1.00 0.00 H new ATOM 0 HA GLN A 74 16.705 -13.315 -1.973 1.00 0.00 H new ATOM 0 HB2 GLN A 74 17.956 -15.188 -4.020 1.00 0.00 H new ATOM 0 HB3 GLN A 74 18.258 -13.464 -3.932 1.00 0.00 H new ATOM 0 HG2 GLN A 74 18.692 -14.890 -1.379 1.00 0.00 H new ATOM 0 HG3 GLN A 74 19.743 -15.418 -2.677 1.00 0.00 H new ATOM 0 HE21 GLN A 74 21.616 -14.555 -1.747 1.00 0.00 H new ATOM 0 HE22 GLN A 74 21.910 -12.815 -1.666 1.00 0.00 H new ATOM 1153 N VAL A 75 15.288 -14.730 -4.611 1.00 0.00 N ATOM 1154 CA VAL A 75 14.317 -14.509 -5.677 1.00 0.00 C ATOM 1155 C VAL A 75 12.995 -13.995 -5.117 1.00 0.00 C ATOM 1156 O VAL A 75 12.277 -13.249 -5.782 1.00 0.00 O ATOM 1157 CB VAL A 75 14.056 -15.800 -6.475 1.00 0.00 C ATOM 1158 CG1 VAL A 75 13.484 -16.881 -5.571 1.00 0.00 C ATOM 1159 CG2 VAL A 75 13.124 -15.523 -7.645 1.00 0.00 C ATOM 0 H VAL A 75 15.683 -15.670 -4.588 1.00 0.00 H new ATOM 0 HA VAL A 75 14.743 -13.759 -6.343 1.00 0.00 H new ATOM 0 HB VAL A 75 15.005 -16.159 -6.873 1.00 0.00 H new ATOM 0 HG11 VAL A 75 13.306 -17.785 -6.153 1.00 0.00 H new ATOM 0 HG12 VAL A 75 14.191 -17.098 -4.770 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.544 -16.536 -5.141 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.950 -16.446 -8.198 1.00 0.00 H new ATOM 0 HG22 VAL A 75 12.175 -15.140 -7.271 1.00 0.00 H new ATOM 0 HG23 VAL A 75 13.579 -14.784 -8.305 1.00 0.00 H new ATOM 1169 N ASN A 76 12.681 -14.398 -3.891 1.00 0.00 N ATOM 1170 CA ASN A 76 11.445 -13.977 -3.241 1.00 0.00 C ATOM 1171 C ASN A 76 11.737 -13.270 -1.921 1.00 0.00 C ATOM 1172 O ASN A 76 11.414 -13.778 -0.847 1.00 0.00 O ATOM 1173 CB ASN A 76 10.537 -15.185 -2.996 1.00 0.00 C ATOM 1174 CG ASN A 76 9.640 -15.483 -4.181 1.00 0.00 C ATOM 1175 OD1 ASN A 76 9.109 -14.573 -4.817 1.00 0.00 O ATOM 1176 ND2 ASN A 76 9.466 -16.765 -4.483 1.00 0.00 N ATOM 0 H ASN A 76 13.265 -15.016 -3.327 1.00 0.00 H new ATOM 0 HA ASN A 76 10.936 -13.276 -3.903 1.00 0.00 H new ATOM 0 HB2 ASN A 76 11.151 -16.059 -2.779 1.00 0.00 H new ATOM 0 HB3 ASN A 76 9.922 -15.001 -2.115 1.00 0.00 H new ATOM 0 HD21 ASN A 76 8.872 -17.028 -5.270 1.00 0.00 H new ATOM 0 HD22 ASN A 76 9.926 -17.487 -3.928 1.00 0.00 H new ATOM 1183 N THR A 77 12.350 -12.094 -2.009 1.00 0.00 N ATOM 1184 CA THR A 77 12.687 -11.317 -0.823 1.00 0.00 C ATOM 1185 C THR A 77 11.568 -10.344 -0.468 1.00 0.00 C ATOM 1186 O THR A 77 10.951 -9.744 -1.347 1.00 0.00 O ATOM 1187 CB THR A 77 13.995 -10.527 -1.022 1.00 0.00 C ATOM 1188 OG1 THR A 77 14.264 -9.727 0.135 1.00 0.00 O ATOM 1189 CG2 THR A 77 13.908 -9.636 -2.252 1.00 0.00 C ATOM 0 H THR A 77 12.623 -11.659 -2.890 1.00 0.00 H new ATOM 0 HA THR A 77 12.821 -12.027 -0.007 1.00 0.00 H new ATOM 0 HB THR A 77 14.806 -11.240 -1.167 1.00 0.00 H new ATOM 0 HG1 THR A 77 15.232 -9.621 0.241 1.00 0.00 H new ATOM 0 HG21 THR A 77 14.843 -9.089 -2.372 1.00 0.00 H new ATOM 0 HG22 THR A 77 13.732 -10.251 -3.135 1.00 0.00 H new ATOM 0 HG23 THR A 77 13.087 -8.930 -2.132 1.00 0.00 H new ATOM 1197 N VAL A 78 11.313 -10.192 0.828 1.00 0.00 N ATOM 1198 CA VAL A 78 10.269 -9.291 1.300 1.00 0.00 C ATOM 1199 C VAL A 78 10.677 -7.833 1.117 1.00 0.00 C ATOM 1200 O VAL A 78 9.831 -6.959 0.932 1.00 0.00 O ATOM 1201 CB VAL A 78 9.943 -9.538 2.785 1.00 0.00 C ATOM 1202 CG1 VAL A 78 8.796 -8.647 3.236 1.00 0.00 C ATOM 1203 CG2 VAL A 78 9.615 -11.004 3.022 1.00 0.00 C ATOM 0 H VAL A 78 11.815 -10.681 1.569 1.00 0.00 H new ATOM 0 HA VAL A 78 9.381 -9.495 0.702 1.00 0.00 H new ATOM 0 HB VAL A 78 10.822 -9.286 3.378 1.00 0.00 H new ATOM 0 HG11 VAL A 78 8.580 -8.836 4.288 1.00 0.00 H new ATOM 0 HG12 VAL A 78 9.074 -7.601 3.105 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.910 -8.864 2.639 1.00 0.00 H new ATOM 0 HG21 VAL A 78 9.387 -11.160 4.076 1.00 0.00 H new ATOM 0 HG22 VAL A 78 8.752 -11.286 2.419 1.00 0.00 H new ATOM 0 HG23 VAL A 78 10.470 -11.618 2.741 1.00 0.00 H new ATOM 1213 N GLY A 79 11.981 -7.578 1.168 1.00 0.00 N ATOM 1214 CA GLY A 79 12.479 -6.225 1.005 1.00 0.00 C ATOM 1215 C GLY A 79 13.962 -6.114 1.296 1.00 0.00 C ATOM 1216 O GLY A 79 14.431 -6.563 2.343 1.00 0.00 O ATOM 0 H GLY A 79 12.701 -8.284 1.319 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.286 -5.890 -0.014 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.931 -5.557 1.669 1.00 0.00 H new ATOM 1220 N ILE A 80 14.703 -5.517 0.369 1.00 0.00 N ATOM 1221 CA ILE A 80 16.142 -5.350 0.532 1.00 0.00 C ATOM 1222 C ILE A 80 16.508 -3.880 0.706 1.00 0.00 C ATOM 1223 O ILE A 80 15.812 -2.981 0.233 1.00 0.00 O ATOM 1224 CB ILE A 80 16.915 -5.921 -0.672 1.00 0.00 C ATOM 1225 CG1 ILE A 80 16.409 -5.296 -1.974 1.00 0.00 C ATOM 1226 CG2 ILE A 80 16.780 -7.436 -0.718 1.00 0.00 C ATOM 1227 CD1 ILE A 80 17.490 -4.600 -2.770 1.00 0.00 C ATOM 0 H ILE A 80 14.331 -5.141 -0.503 1.00 0.00 H new ATOM 0 HA ILE A 80 16.424 -5.901 1.429 1.00 0.00 H new ATOM 0 HB ILE A 80 17.970 -5.673 -0.558 1.00 0.00 H new ATOM 0 HG12 ILE A 80 15.959 -6.074 -2.590 1.00 0.00 H new ATOM 0 HG13 ILE A 80 15.622 -4.579 -1.741 1.00 0.00 H new ATOM 0 HG21 ILE A 80 17.332 -7.825 -1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 80 17.184 -7.865 0.199 1.00 0.00 H new ATOM 0 HG23 ILE A 80 15.728 -7.705 -0.812 1.00 0.00 H new ATOM 0 HD11 ILE A 80 17.059 -4.181 -3.679 1.00 0.00 H new ATOM 0 HD12 ILE A 80 17.924 -3.799 -2.171 1.00 0.00 H new ATOM 0 HD13 ILE A 80 18.267 -5.318 -3.034 1.00 0.00 H new ATOM 1239 N PRO A 81 17.628 -3.627 1.399 1.00 0.00 N ATOM 1240 CA PRO A 81 18.114 -2.267 1.650 1.00 0.00 C ATOM 1241 C PRO A 81 18.630 -1.593 0.383 1.00 0.00 C ATOM 1242 O PRO A 81 19.111 -2.260 -0.534 1.00 0.00 O ATOM 1243 CB PRO A 81 19.257 -2.477 2.646 1.00 0.00 C ATOM 1244 CG PRO A 81 19.726 -3.869 2.398 1.00 0.00 C ATOM 1245 CD PRO A 81 18.507 -4.650 1.991 1.00 0.00 C ATOM 0 HA PRO A 81 17.323 -1.613 2.019 1.00 0.00 H new ATOM 0 HB2 PRO A 81 20.058 -1.755 2.487 1.00 0.00 H new ATOM 0 HB3 PRO A 81 18.915 -2.352 3.673 1.00 0.00 H new ATOM 0 HG2 PRO A 81 20.484 -3.892 1.615 1.00 0.00 H new ATOM 0 HG3 PRO A 81 20.180 -4.293 3.293 1.00 0.00 H new ATOM 0 HD2 PRO A 81 18.752 -5.433 1.273 1.00 0.00 H new ATOM 0 HD3 PRO A 81 18.038 -5.137 2.846 1.00 0.00 H new ATOM 1253 N ILE A 82 18.526 -0.269 0.338 1.00 0.00 N ATOM 1254 CA ILE A 82 18.984 0.494 -0.816 1.00 0.00 C ATOM 1255 C ILE A 82 20.493 0.707 -0.771 1.00 0.00 C ATOM 1256 O ILE A 82 21.072 0.896 0.298 1.00 0.00 O ATOM 1257 CB ILE A 82 18.285 1.864 -0.898 1.00 0.00 C ATOM 1258 CG1 ILE A 82 16.765 1.688 -0.874 1.00 0.00 C ATOM 1259 CG2 ILE A 82 18.718 2.605 -2.154 1.00 0.00 C ATOM 1260 CD1 ILE A 82 16.120 2.185 0.401 1.00 0.00 C ATOM 0 H ILE A 82 18.129 0.297 1.087 1.00 0.00 H new ATOM 0 HA ILE A 82 18.729 -0.089 -1.701 1.00 0.00 H new ATOM 0 HB ILE A 82 18.577 2.457 -0.031 1.00 0.00 H new ATOM 0 HG12 ILE A 82 16.332 2.219 -1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 82 16.527 0.632 -1.004 1.00 0.00 H new ATOM 0 HG21 ILE A 82 18.216 3.571 -2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 82 19.797 2.758 -2.133 1.00 0.00 H new ATOM 0 HG23 ILE A 82 18.452 2.018 -3.033 1.00 0.00 H new ATOM 0 HD11 ILE A 82 15.043 2.029 0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 82 16.525 1.637 1.251 1.00 0.00 H new ATOM 0 HD13 ILE A 82 16.327 3.248 0.523 1.00 0.00 H new ATOM 1272 N SER A 83 21.124 0.677 -1.941 1.00 0.00 N ATOM 1273 CA SER A 83 22.567 0.865 -2.035 1.00 0.00 C ATOM 1274 C SER A 83 23.003 1.008 -3.490 1.00 0.00 C ATOM 1275 O SER A 83 23.547 2.036 -3.889 1.00 0.00 O ATOM 1276 CB SER A 83 23.300 -0.311 -1.385 1.00 0.00 C ATOM 1277 OG SER A 83 23.570 -0.050 -0.018 1.00 0.00 O ATOM 0 H SER A 83 20.659 0.524 -2.836 1.00 0.00 H new ATOM 0 HA SER A 83 22.824 1.782 -1.505 1.00 0.00 H new ATOM 0 HB2 SER A 83 22.696 -1.214 -1.474 1.00 0.00 H new ATOM 0 HB3 SER A 83 24.234 -0.499 -1.914 1.00 0.00 H new ATOM 0 HG SER A 83 22.775 0.337 0.405 1.00 0.00 H new ATOM 1283 N GLY A 84 22.757 -0.034 -4.280 1.00 0.00 N ATOM 1284 CA GLY A 84 23.129 -0.006 -5.682 1.00 0.00 C ATOM 1285 C GLY A 84 23.631 -1.348 -6.176 1.00 0.00 C ATOM 1286 O GLY A 84 22.970 -2.032 -6.958 1.00 0.00 O ATOM 0 H GLY A 84 22.307 -0.896 -3.973 1.00 0.00 H new ATOM 0 HA2 GLY A 84 22.268 0.298 -6.277 1.00 0.00 H new ATOM 0 HA3 GLY A 84 23.903 0.746 -5.834 1.00 0.00 H new ATOM 1290 N PRO A 85 24.827 -1.743 -5.716 1.00 0.00 N ATOM 1291 CA PRO A 85 25.444 -3.015 -6.104 1.00 0.00 C ATOM 1292 C PRO A 85 24.712 -4.217 -5.517 1.00 0.00 C ATOM 1293 O PRO A 85 23.734 -4.064 -4.785 1.00 0.00 O ATOM 1294 CB PRO A 85 26.858 -2.915 -5.526 1.00 0.00 C ATOM 1295 CG PRO A 85 26.734 -1.964 -4.385 1.00 0.00 C ATOM 1296 CD PRO A 85 25.670 -0.978 -4.781 1.00 0.00 C ATOM 0 HA PRO A 85 25.420 -3.167 -7.183 1.00 0.00 H new ATOM 0 HB2 PRO A 85 27.219 -3.888 -5.193 1.00 0.00 H new ATOM 0 HB3 PRO A 85 27.565 -2.550 -6.271 1.00 0.00 H new ATOM 0 HG2 PRO A 85 26.460 -2.487 -3.469 1.00 0.00 H new ATOM 0 HG3 PRO A 85 27.681 -1.460 -4.193 1.00 0.00 H new ATOM 0 HD2 PRO A 85 25.101 -0.632 -3.918 1.00 0.00 H new ATOM 0 HD3 PRO A 85 26.097 -0.095 -5.256 1.00 0.00 H new ATOM 1304 N SER A 86 25.193 -5.413 -5.842 1.00 0.00 N ATOM 1305 CA SER A 86 24.582 -6.642 -5.349 1.00 0.00 C ATOM 1306 C SER A 86 25.007 -6.921 -3.910 1.00 0.00 C ATOM 1307 O SER A 86 26.044 -6.440 -3.453 1.00 0.00 O ATOM 1308 CB SER A 86 24.965 -7.822 -6.244 1.00 0.00 C ATOM 1309 OG SER A 86 25.438 -7.374 -7.502 1.00 0.00 O ATOM 0 H SER A 86 26.004 -5.557 -6.444 1.00 0.00 H new ATOM 0 HA SER A 86 23.500 -6.515 -5.372 1.00 0.00 H new ATOM 0 HB2 SER A 86 25.734 -8.419 -5.754 1.00 0.00 H new ATOM 0 HB3 SER A 86 24.100 -8.470 -6.387 1.00 0.00 H new ATOM 0 HG SER A 86 25.678 -8.146 -8.055 1.00 0.00 H new ATOM 1315 N SER A 87 24.198 -7.702 -3.202 1.00 0.00 N ATOM 1316 CA SER A 87 24.487 -8.043 -1.814 1.00 0.00 C ATOM 1317 C SER A 87 24.702 -6.785 -0.978 1.00 0.00 C ATOM 1318 O SER A 87 24.474 -5.670 -1.446 1.00 0.00 O ATOM 1319 CB SER A 87 25.724 -8.939 -1.734 1.00 0.00 C ATOM 1320 OG SER A 87 25.525 -10.003 -0.819 1.00 0.00 O ATOM 0 H SER A 87 23.337 -8.111 -3.566 1.00 0.00 H new ATOM 0 HA SER A 87 23.629 -8.582 -1.413 1.00 0.00 H new ATOM 0 HB2 SER A 87 25.950 -9.342 -2.721 1.00 0.00 H new ATOM 0 HB3 SER A 87 26.586 -8.347 -1.427 1.00 0.00 H new ATOM 0 HG SER A 87 26.329 -10.562 -0.787 1.00 0.00 H new ATOM 1326 N GLY A 88 25.142 -6.973 0.262 1.00 0.00 N ATOM 1327 CA GLY A 88 25.381 -5.845 1.144 1.00 0.00 C ATOM 1328 C GLY A 88 26.579 -6.059 2.047 1.00 0.00 C ATOM 1329 O GLY A 88 27.264 -7.077 1.950 1.00 0.00 O ATOM 0 H GLY A 88 25.337 -7.886 0.672 1.00 0.00 H new ATOM 0 HA2 GLY A 88 25.536 -4.947 0.546 1.00 0.00 H new ATOM 0 HA3 GLY A 88 24.495 -5.672 1.755 1.00 0.00 H new TER 1333 GLY A 88