USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 709 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 54 ASN : amide:sc= 0.92 K(o=1.7,f=1) USER MOD Set 1.2: A 57 THR OG1 : rot 180:sc= 0.798 USER MOD Set 2.1: A 2 GLN : amide:sc= 0.993 K(o=2.2,f=-1.9) USER MOD Set 2.2: A 14 LYS NZ :NH3+ -178:sc= 1.17 (180deg=0) USER MOD Set 3.1: A 10 GLN : amide:sc= 0.444 K(o=0.86,f=-0.34) USER MOD Set 3.2: B 289 TYR OH : rot 30:sc= 0.413 USER MOD Set 4.1: A 9 GLN : amide:sc= 0.711 K(o=1.3,f=0) USER MOD Set 4.2: A 11 GLN : amide:sc= 0.631 K(o=1.3,f=-1.2) USER MOD Single : A 1 MET CE :methyl -174:sc= -0.212 (180deg=-0.286) USER MOD Single : A 1 MET N :NH3+ -163:sc= 2.17 (180deg=1.8) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 148:sc= 0.0277 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.298 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -170:sc= 0.0557 USER MOD Single : A 24 LYS NZ :NH3+ 172:sc= 2.21 (180deg=2.11) USER MOD Single : A 27 LYS NZ :NH3+ 176:sc= 1.03 (180deg=1.02) USER MOD Single : A 29 LYS NZ :NH3+ 149:sc= 1.01 (180deg=0.38) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -117:sc= 0.172 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 1.03 K(o=1,f=-3.2!) USER MOD Single : A 45 LYS NZ :NH3+ 169:sc= 0.446 (180deg=0.403) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -156:sc= 1.24 (180deg=1.04) USER MOD Single : A 62 TYR OH : rot 166:sc= 0.389 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 73 MET CE :methyl 168:sc= -0.314 (180deg=-0.384) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : B 291 MET CE :methyl 165:sc= 0 (180deg=-0.197) USER MOD Single : B 292 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 293 MET CE :methyl -175:sc= -0.194 (180deg=-0.25) USER MOD Single : B 294 SER OG : rot -33:sc= 0.87 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.796 1.501 3.390 1.00 0.00 N ATOM 2 CA MET A 1 7.937 1.219 1.941 1.00 0.00 C ATOM 3 C MET A 1 7.106 0.001 1.584 1.00 0.00 C ATOM 4 O MET A 1 7.301 -1.085 2.125 1.00 0.00 O ATOM 5 CB MET A 1 9.397 1.000 1.517 1.00 0.00 C ATOM 6 CG MET A 1 9.565 0.883 -0.005 1.00 0.00 C ATOM 7 SD MET A 1 11.242 0.473 -0.568 1.00 0.00 S ATOM 8 CE MET A 1 11.116 -1.335 -0.720 1.00 0.00 C ATOM 0 H1 MET A 1 8.114 2.471 3.587 1.00 0.00 H new ATOM 0 H2 MET A 1 6.799 1.400 3.668 1.00 0.00 H new ATOM 0 H3 MET A 1 8.376 0.830 3.932 1.00 0.00 H new ATOM 0 HA MET A 1 7.580 2.096 1.400 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.004 1.828 1.882 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.776 0.094 1.990 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.879 0.120 -0.373 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.266 1.827 -0.461 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.096 -1.750 -0.955 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.760 -1.755 0.221 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.416 -1.585 -1.517 1.00 0.00 H new ATOM 20 N GLN A 2 6.164 0.180 0.671 1.00 0.00 N ATOM 21 CA GLN A 2 5.189 -0.835 0.279 1.00 0.00 C ATOM 22 C GLN A 2 5.761 -1.761 -0.805 1.00 0.00 C ATOM 23 O GLN A 2 5.579 -1.538 -2.003 1.00 0.00 O ATOM 24 CB GLN A 2 3.853 -0.195 -0.119 1.00 0.00 C ATOM 25 CG GLN A 2 3.308 0.858 0.862 1.00 0.00 C ATOM 26 CD GLN A 2 2.096 1.576 0.277 1.00 0.00 C ATOM 27 OE1 GLN A 2 0.959 1.132 0.381 1.00 0.00 O ATOM 28 NE2 GLN A 2 2.287 2.704 -0.374 1.00 0.00 N ATOM 0 H GLN A 2 6.051 1.059 0.166 1.00 0.00 H new ATOM 0 HA GLN A 2 4.980 -1.466 1.143 1.00 0.00 H new ATOM 0 HB2 GLN A 2 3.970 0.271 -1.098 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.109 -0.984 -0.228 1.00 0.00 H new ATOM 0 HG2 GLN A 2 3.032 0.377 1.801 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.088 1.583 1.093 1.00 0.00 H new ATOM 0 HE21 GLN A 2 3.228 3.085 -0.468 1.00 0.00 H new ATOM 0 HE22 GLN A 2 1.494 3.197 -0.784 1.00 0.00 H new ATOM 37 N VAL A 3 6.476 -2.804 -0.381 1.00 0.00 N ATOM 38 CA VAL A 3 6.950 -3.892 -1.249 1.00 0.00 C ATOM 39 C VAL A 3 5.746 -4.677 -1.772 1.00 0.00 C ATOM 40 O VAL A 3 5.020 -5.307 -1.000 1.00 0.00 O ATOM 41 CB VAL A 3 7.924 -4.831 -0.505 1.00 0.00 C ATOM 42 CG1 VAL A 3 8.420 -5.965 -1.411 1.00 0.00 C ATOM 43 CG2 VAL A 3 9.176 -4.078 -0.051 1.00 0.00 C ATOM 0 H VAL A 3 6.749 -2.922 0.595 1.00 0.00 H new ATOM 0 HA VAL A 3 7.498 -3.456 -2.084 1.00 0.00 H new ATOM 0 HB VAL A 3 7.365 -5.226 0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 3 9.103 -6.605 -0.852 1.00 0.00 H new ATOM 0 HG12 VAL A 3 7.570 -6.554 -1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.940 -5.543 -2.271 1.00 0.00 H new ATOM 0 HG21 VAL A 3 9.844 -4.764 0.470 1.00 0.00 H new ATOM 0 HG22 VAL A 3 9.687 -3.664 -0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 3 8.890 -3.269 0.621 1.00 0.00 H new ATOM 53 N THR A 4 5.532 -4.667 -3.086 1.00 0.00 N ATOM 54 CA THR A 4 4.539 -5.538 -3.729 1.00 0.00 C ATOM 55 C THR A 4 5.109 -6.939 -3.878 1.00 0.00 C ATOM 56 O THR A 4 6.270 -7.120 -4.254 1.00 0.00 O ATOM 57 CB THR A 4 4.202 -5.053 -5.137 1.00 0.00 C ATOM 58 OG1 THR A 4 3.607 -3.772 -5.094 1.00 0.00 O ATOM 59 CG2 THR A 4 3.239 -5.988 -5.875 1.00 0.00 C ATOM 0 H THR A 4 6.035 -4.062 -3.734 1.00 0.00 H new ATOM 0 HA THR A 4 3.647 -5.526 -3.103 1.00 0.00 H new ATOM 0 HB THR A 4 5.150 -5.028 -5.675 1.00 0.00 H new ATOM 0 HG1 THR A 4 3.400 -3.477 -6.005 1.00 0.00 H new ATOM 0 HG21 THR A 4 3.037 -5.591 -6.870 1.00 0.00 H new ATOM 0 HG22 THR A 4 3.688 -6.977 -5.964 1.00 0.00 H new ATOM 0 HG23 THR A 4 2.305 -6.062 -5.318 1.00 0.00 H new ATOM 67 N LEU A 5 4.258 -7.933 -3.647 1.00 0.00 N ATOM 68 CA LEU A 5 4.572 -9.350 -3.712 1.00 0.00 C ATOM 69 C LEU A 5 3.769 -10.048 -4.806 1.00 0.00 C ATOM 70 O LEU A 5 2.626 -9.681 -5.089 1.00 0.00 O ATOM 71 CB LEU A 5 4.262 -9.986 -2.347 1.00 0.00 C ATOM 72 CG LEU A 5 4.866 -9.251 -1.139 1.00 0.00 C ATOM 73 CD1 LEU A 5 4.586 -10.062 0.117 1.00 0.00 C ATOM 74 CD2 LEU A 5 6.367 -9.059 -1.283 1.00 0.00 C ATOM 0 H LEU A 5 3.284 -7.761 -3.398 1.00 0.00 H new ATOM 0 HA LEU A 5 5.629 -9.467 -3.953 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.180 -10.033 -2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.628 -11.013 -2.349 1.00 0.00 H new ATOM 0 HG LEU A 5 4.408 -8.264 -1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 5 5.010 -9.551 0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 5 3.509 -10.168 0.249 1.00 0.00 H new ATOM 0 HD13 LEU A 5 5.038 -11.049 0.021 1.00 0.00 H new ATOM 0 HD21 LEU A 5 6.752 -8.536 -0.408 1.00 0.00 H new ATOM 0 HD22 LEU A 5 6.852 -10.032 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.575 -8.472 -2.177 1.00 0.00 H new ATOM 86 N LYS A 6 4.359 -11.110 -5.346 1.00 0.00 N ATOM 87 CA LYS A 6 3.744 -12.083 -6.253 1.00 0.00 C ATOM 88 C LYS A 6 4.069 -13.507 -5.799 1.00 0.00 C ATOM 89 O LYS A 6 5.194 -13.779 -5.378 1.00 0.00 O ATOM 90 CB LYS A 6 4.173 -11.786 -7.697 1.00 0.00 C ATOM 91 CG LYS A 6 3.428 -12.692 -8.685 1.00 0.00 C ATOM 92 CD LYS A 6 3.281 -12.026 -10.057 1.00 0.00 C ATOM 93 CE LYS A 6 2.328 -12.858 -10.915 1.00 0.00 C ATOM 94 NZ LYS A 6 3.018 -14.011 -11.556 1.00 0.00 N ATOM 0 H LYS A 6 5.336 -11.330 -5.153 1.00 0.00 H new ATOM 0 HA LYS A 6 2.658 -11.995 -6.224 1.00 0.00 H new ATOM 0 HB2 LYS A 6 3.972 -10.741 -7.933 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.248 -11.935 -7.800 1.00 0.00 H new ATOM 0 HG2 LYS A 6 3.965 -13.634 -8.793 1.00 0.00 H new ATOM 0 HG3 LYS A 6 2.441 -12.931 -8.288 1.00 0.00 H new ATOM 0 HD2 LYS A 6 2.898 -11.012 -9.944 1.00 0.00 H new ATOM 0 HD3 LYS A 6 4.253 -11.947 -10.543 1.00 0.00 H new ATOM 0 HE2 LYS A 6 1.509 -13.224 -10.296 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.887 -12.225 -11.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 2.352 -14.804 -11.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 3.361 -13.731 -12.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 3.823 -14.305 -10.967 1.00 0.00 H new ATOM 108 N THR A 7 3.084 -14.399 -5.849 1.00 0.00 N ATOM 109 CA THR A 7 3.188 -15.785 -5.362 1.00 0.00 C ATOM 110 C THR A 7 3.436 -16.780 -6.501 1.00 0.00 C ATOM 111 O THR A 7 3.231 -16.475 -7.680 1.00 0.00 O ATOM 112 CB THR A 7 1.932 -16.200 -4.571 1.00 0.00 C ATOM 113 OG1 THR A 7 0.864 -16.511 -5.440 1.00 0.00 O ATOM 114 CG2 THR A 7 1.422 -15.133 -3.598 1.00 0.00 C ATOM 0 H THR A 7 2.166 -14.180 -6.237 1.00 0.00 H new ATOM 0 HA THR A 7 4.049 -15.812 -4.695 1.00 0.00 H new ATOM 0 HB THR A 7 2.252 -17.069 -3.996 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.080 -16.773 -4.914 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.537 -15.504 -3.082 1.00 0.00 H new ATOM 0 HG22 THR A 7 2.199 -14.905 -2.868 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.167 -14.229 -4.151 1.00 0.00 H new ATOM 122 N LEU A 8 3.807 -18.018 -6.154 1.00 0.00 N ATOM 123 CA LEU A 8 3.882 -19.144 -7.098 1.00 0.00 C ATOM 124 C LEU A 8 2.507 -19.543 -7.673 1.00 0.00 C ATOM 125 O LEU A 8 2.429 -20.085 -8.776 1.00 0.00 O ATOM 126 CB LEU A 8 4.526 -20.356 -6.406 1.00 0.00 C ATOM 127 CG LEU A 8 5.931 -20.134 -5.821 1.00 0.00 C ATOM 128 CD1 LEU A 8 6.475 -21.440 -5.251 1.00 0.00 C ATOM 129 CD2 LEU A 8 6.943 -19.681 -6.860 1.00 0.00 C ATOM 0 H LEU A 8 4.067 -18.271 -5.201 1.00 0.00 H new ATOM 0 HA LEU A 8 4.493 -18.815 -7.938 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.867 -20.682 -5.601 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.579 -21.173 -7.125 1.00 0.00 H new ATOM 0 HG LEU A 8 5.811 -19.361 -5.062 1.00 0.00 H new ATOM 0 HD11 LEU A 8 7.470 -21.271 -4.840 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.812 -21.797 -4.463 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.532 -22.187 -6.043 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.914 -19.542 -6.385 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.026 -20.437 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.616 -18.739 -7.300 1.00 0.00 H new ATOM 141 N GLN A 9 1.422 -19.232 -6.954 1.00 0.00 N ATOM 142 CA GLN A 9 0.028 -19.373 -7.400 1.00 0.00 C ATOM 143 C GLN A 9 -0.439 -18.196 -8.288 1.00 0.00 C ATOM 144 O GLN A 9 -1.616 -18.121 -8.644 1.00 0.00 O ATOM 145 CB GLN A 9 -0.897 -19.552 -6.179 1.00 0.00 C ATOM 146 CG GLN A 9 -0.499 -20.744 -5.290 1.00 0.00 C ATOM 147 CD GLN A 9 -1.606 -21.205 -4.336 1.00 0.00 C ATOM 148 OE1 GLN A 9 -1.831 -22.394 -4.144 1.00 0.00 O ATOM 149 NE2 GLN A 9 -2.334 -20.323 -3.682 1.00 0.00 N ATOM 0 H GLN A 9 1.493 -18.860 -6.007 1.00 0.00 H new ATOM 0 HA GLN A 9 -0.028 -20.264 -8.026 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -0.882 -18.640 -5.582 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -1.922 -19.690 -6.524 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -0.211 -21.580 -5.928 1.00 0.00 H new ATOM 0 HG3 GLN A 9 0.380 -20.471 -4.706 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -2.172 -19.325 -3.819 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -3.060 -20.638 -3.038 1.00 0.00 H new ATOM 158 N GLN A 10 0.470 -17.280 -8.658 1.00 0.00 N ATOM 159 CA GLN A 10 0.241 -16.093 -9.500 1.00 0.00 C ATOM 160 C GLN A 10 -0.705 -15.053 -8.863 1.00 0.00 C ATOM 161 O GLN A 10 -1.289 -14.221 -9.562 1.00 0.00 O ATOM 162 CB GLN A 10 -0.174 -16.497 -10.934 1.00 0.00 C ATOM 163 CG GLN A 10 0.733 -17.564 -11.579 1.00 0.00 C ATOM 164 CD GLN A 10 0.337 -17.893 -13.021 1.00 0.00 C ATOM 165 OE1 GLN A 10 -0.784 -17.685 -13.472 1.00 0.00 O ATOM 166 NE2 GLN A 10 1.240 -18.432 -13.812 1.00 0.00 N ATOM 0 H GLN A 10 1.443 -17.352 -8.360 1.00 0.00 H new ATOM 0 HA GLN A 10 1.197 -15.575 -9.575 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -1.197 -16.872 -10.912 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -0.174 -15.608 -11.564 1.00 0.00 H new ATOM 0 HG2 GLN A 10 1.765 -17.214 -11.562 1.00 0.00 H new ATOM 0 HG3 GLN A 10 0.696 -18.475 -10.981 1.00 0.00 H new ATOM 0 HE21 GLN A 10 2.180 -18.616 -13.462 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.000 -18.666 -14.775 1.00 0.00 H new ATOM 175 N GLN A 11 -0.816 -15.057 -7.531 1.00 0.00 N ATOM 176 CA GLN A 11 -1.557 -14.055 -6.756 1.00 0.00 C ATOM 177 C GLN A 11 -0.627 -12.890 -6.408 1.00 0.00 C ATOM 178 O GLN A 11 0.591 -13.067 -6.372 1.00 0.00 O ATOM 179 CB GLN A 11 -2.102 -14.687 -5.464 1.00 0.00 C ATOM 180 CG GLN A 11 -3.009 -15.896 -5.730 1.00 0.00 C ATOM 181 CD GLN A 11 -3.423 -16.573 -4.428 1.00 0.00 C ATOM 182 OE1 GLN A 11 -2.766 -17.484 -3.938 1.00 0.00 O ATOM 183 NE2 GLN A 11 -4.511 -16.164 -3.810 1.00 0.00 N ATOM 0 H GLN A 11 -0.383 -15.773 -6.948 1.00 0.00 H new ATOM 0 HA GLN A 11 -2.393 -13.688 -7.351 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -1.267 -14.996 -4.836 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -2.660 -13.936 -4.905 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -3.897 -15.575 -6.274 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -2.488 -16.612 -6.365 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -5.068 -15.407 -4.206 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -4.797 -16.604 -2.935 1.00 0.00 H new ATOM 192 N THR A 12 -1.173 -11.703 -6.140 1.00 0.00 N ATOM 193 CA THR A 12 -0.385 -10.513 -5.786 1.00 0.00 C ATOM 194 C THR A 12 -0.979 -9.751 -4.600 1.00 0.00 C ATOM 195 O THR A 12 -2.199 -9.668 -4.427 1.00 0.00 O ATOM 196 CB THR A 12 -0.177 -9.574 -6.989 1.00 0.00 C ATOM 197 OG1 THR A 12 -1.413 -9.221 -7.581 1.00 0.00 O ATOM 198 CG2 THR A 12 0.702 -10.199 -8.080 1.00 0.00 C ATOM 0 H THR A 12 -2.179 -11.535 -6.161 1.00 0.00 H new ATOM 0 HA THR A 12 0.594 -10.883 -5.480 1.00 0.00 H new ATOM 0 HB THR A 12 0.323 -8.692 -6.589 1.00 0.00 H new ATOM 0 HG1 THR A 12 -1.253 -8.623 -8.341 1.00 0.00 H new ATOM 0 HG21 THR A 12 0.816 -9.494 -8.904 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.683 -10.435 -7.666 1.00 0.00 H new ATOM 0 HG23 THR A 12 0.233 -11.112 -8.446 1.00 0.00 H new ATOM 206 N PHE A 13 -0.091 -9.205 -3.766 1.00 0.00 N ATOM 207 CA PHE A 13 -0.372 -8.508 -2.502 1.00 0.00 C ATOM 208 C PHE A 13 0.646 -7.373 -2.283 1.00 0.00 C ATOM 209 O PHE A 13 1.579 -7.218 -3.074 1.00 0.00 O ATOM 210 CB PHE A 13 -0.303 -9.519 -1.339 1.00 0.00 C ATOM 211 CG PHE A 13 -1.221 -10.725 -1.456 1.00 0.00 C ATOM 212 CD1 PHE A 13 -2.602 -10.585 -1.215 1.00 0.00 C ATOM 213 CD2 PHE A 13 -0.701 -11.988 -1.804 1.00 0.00 C ATOM 214 CE1 PHE A 13 -3.458 -11.695 -1.335 1.00 0.00 C ATOM 215 CE2 PHE A 13 -1.558 -13.098 -1.921 1.00 0.00 C ATOM 216 CZ PHE A 13 -2.938 -12.951 -1.691 1.00 0.00 C ATOM 0 H PHE A 13 0.909 -9.238 -3.966 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.370 -8.071 -2.543 1.00 0.00 H new ATOM 0 HB2 PHE A 13 0.724 -9.875 -1.252 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.539 -8.995 -0.413 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -3.005 -9.622 -0.937 1.00 0.00 H new ATOM 0 HD2 PHE A 13 0.358 -12.104 -1.981 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -4.517 -11.582 -1.153 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -1.156 -14.064 -2.188 1.00 0.00 H new ATOM 0 HZ PHE A 13 -3.596 -13.802 -1.788 1.00 0.00 H new ATOM 226 N LYS A 14 0.526 -6.599 -1.198 1.00 0.00 N ATOM 227 CA LYS A 14 1.556 -5.636 -0.765 1.00 0.00 C ATOM 228 C LYS A 14 1.842 -5.738 0.734 1.00 0.00 C ATOM 229 O LYS A 14 0.965 -6.097 1.521 1.00 0.00 O ATOM 230 CB LYS A 14 1.196 -4.202 -1.202 1.00 0.00 C ATOM 231 CG LYS A 14 -0.026 -3.608 -0.480 1.00 0.00 C ATOM 232 CD LYS A 14 -0.232 -2.139 -0.872 1.00 0.00 C ATOM 233 CE LYS A 14 -1.396 -1.541 -0.073 1.00 0.00 C ATOM 234 NZ LYS A 14 -1.518 -0.080 -0.303 1.00 0.00 N ATOM 0 H LYS A 14 -0.292 -6.620 -0.589 1.00 0.00 H new ATOM 0 HA LYS A 14 2.486 -5.899 -1.268 1.00 0.00 H new ATOM 0 HB2 LYS A 14 2.056 -3.555 -1.028 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.006 -4.199 -2.275 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.917 -4.184 -0.730 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.111 -3.685 0.599 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.679 -1.572 -0.682 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.437 -2.064 -1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -2.326 -2.034 -0.357 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -1.246 -1.732 0.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -2.293 0.299 0.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -0.627 0.388 -0.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.719 0.098 -1.308 1.00 0.00 H new ATOM 248 N ILE A 15 3.068 -5.389 1.116 1.00 0.00 N ATOM 249 CA ILE A 15 3.582 -5.357 2.487 1.00 0.00 C ATOM 250 C ILE A 15 4.338 -4.049 2.698 1.00 0.00 C ATOM 251 O ILE A 15 5.393 -3.817 2.109 1.00 0.00 O ATOM 252 CB ILE A 15 4.443 -6.612 2.770 1.00 0.00 C ATOM 253 CG1 ILE A 15 3.544 -7.832 3.062 1.00 0.00 C ATOM 254 CG2 ILE A 15 5.466 -6.428 3.903 1.00 0.00 C ATOM 255 CD1 ILE A 15 2.804 -7.837 4.408 1.00 0.00 C ATOM 0 H ILE A 15 3.774 -5.103 0.437 1.00 0.00 H new ATOM 0 HA ILE A 15 2.763 -5.386 3.206 1.00 0.00 H new ATOM 0 HB ILE A 15 5.021 -6.783 1.862 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.803 -7.907 2.266 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.160 -8.729 3.009 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.029 -7.352 4.039 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.151 -5.620 3.647 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.944 -6.182 4.828 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.208 -8.745 4.492 1.00 0.00 H new ATOM 0 HD12 ILE A 15 3.528 -7.802 5.222 1.00 0.00 H new ATOM 0 HD13 ILE A 15 2.150 -6.967 4.467 1.00 0.00 H new ATOM 267 N ASP A 16 3.771 -3.165 3.517 1.00 0.00 N ATOM 268 CA ASP A 16 4.478 -1.973 3.988 1.00 0.00 C ATOM 269 C ASP A 16 5.529 -2.386 5.037 1.00 0.00 C ATOM 270 O ASP A 16 5.174 -2.780 6.151 1.00 0.00 O ATOM 271 CB ASP A 16 3.508 -0.928 4.551 1.00 0.00 C ATOM 272 CG ASP A 16 4.245 0.369 4.939 1.00 0.00 C ATOM 273 OD1 ASP A 16 5.168 0.792 4.199 1.00 0.00 O ATOM 274 OD2 ASP A 16 3.901 0.970 5.984 1.00 0.00 O ATOM 0 H ASP A 16 2.818 -3.252 3.871 1.00 0.00 H new ATOM 0 HA ASP A 16 4.983 -1.506 3.142 1.00 0.00 H new ATOM 0 HB2 ASP A 16 2.740 -0.705 3.810 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.999 -1.335 5.425 1.00 0.00 H new ATOM 279 N ILE A 17 6.808 -2.342 4.667 1.00 0.00 N ATOM 280 CA ILE A 17 7.981 -2.721 5.473 1.00 0.00 C ATOM 281 C ILE A 17 8.981 -1.554 5.554 1.00 0.00 C ATOM 282 O ILE A 17 9.042 -0.707 4.661 1.00 0.00 O ATOM 283 CB ILE A 17 8.610 -4.026 4.910 1.00 0.00 C ATOM 284 CG1 ILE A 17 9.907 -4.465 5.625 1.00 0.00 C ATOM 285 CG2 ILE A 17 8.884 -3.940 3.394 1.00 0.00 C ATOM 286 CD1 ILE A 17 9.723 -4.792 7.113 1.00 0.00 C ATOM 0 H ILE A 17 7.076 -2.021 3.737 1.00 0.00 H new ATOM 0 HA ILE A 17 7.673 -2.931 6.497 1.00 0.00 H new ATOM 0 HB ILE A 17 7.851 -4.783 5.105 1.00 0.00 H new ATOM 0 HG12 ILE A 17 10.309 -5.342 5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 17 10.649 -3.672 5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.323 -4.876 3.050 1.00 0.00 H new ATOM 0 HG22 ILE A 17 7.948 -3.762 2.865 1.00 0.00 H new ATOM 0 HG23 ILE A 17 9.575 -3.121 3.195 1.00 0.00 H new ATOM 0 HD11 ILE A 17 10.680 -5.091 7.541 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.352 -3.911 7.636 1.00 0.00 H new ATOM 0 HD13 ILE A 17 9.007 -5.606 7.221 1.00 0.00 H new ATOM 298 N ASP A 18 9.775 -1.484 6.624 1.00 0.00 N ATOM 299 CA ASP A 18 10.841 -0.480 6.771 1.00 0.00 C ATOM 300 C ASP A 18 12.060 -0.821 5.876 1.00 0.00 C ATOM 301 O ASP A 18 12.703 -1.846 6.112 1.00 0.00 O ATOM 302 CB ASP A 18 11.251 -0.389 8.245 1.00 0.00 C ATOM 303 CG ASP A 18 10.123 0.180 9.119 1.00 0.00 C ATOM 304 OD1 ASP A 18 9.871 1.407 9.059 1.00 0.00 O ATOM 305 OD2 ASP A 18 9.487 -0.596 9.874 1.00 0.00 O ATOM 0 H ASP A 18 9.700 -2.121 7.417 1.00 0.00 H new ATOM 0 HA ASP A 18 10.462 0.488 6.444 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.526 -1.380 8.607 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.135 0.241 8.338 1.00 0.00 H new ATOM 310 N PRO A 19 12.415 -0.017 4.851 1.00 0.00 N ATOM 311 CA PRO A 19 13.476 -0.365 3.895 1.00 0.00 C ATOM 312 C PRO A 19 14.892 -0.319 4.503 1.00 0.00 C ATOM 313 O PRO A 19 15.801 -0.975 3.995 1.00 0.00 O ATOM 314 CB PRO A 19 13.303 0.620 2.738 1.00 0.00 C ATOM 315 CG PRO A 19 12.711 1.857 3.406 1.00 0.00 C ATOM 316 CD PRO A 19 11.824 1.268 4.503 1.00 0.00 C ATOM 0 HA PRO A 19 13.381 -1.400 3.567 1.00 0.00 H new ATOM 0 HB2 PRO A 19 14.254 0.842 2.255 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.640 0.223 1.969 1.00 0.00 H new ATOM 0 HG2 PRO A 19 13.487 2.503 3.818 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.136 2.459 2.702 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.786 1.928 5.370 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.800 1.144 4.152 1.00 0.00 H new ATOM 324 N GLU A 20 15.100 0.416 5.602 1.00 0.00 N ATOM 325 CA GLU A 20 16.328 0.376 6.404 1.00 0.00 C ATOM 326 C GLU A 20 16.520 -0.967 7.141 1.00 0.00 C ATOM 327 O GLU A 20 17.648 -1.320 7.493 1.00 0.00 O ATOM 328 CB GLU A 20 16.295 1.508 7.444 1.00 0.00 C ATOM 329 CG GLU A 20 16.597 2.897 6.867 1.00 0.00 C ATOM 330 CD GLU A 20 15.516 3.456 5.925 1.00 0.00 C ATOM 331 OE1 GLU A 20 14.310 3.397 6.266 1.00 0.00 O ATOM 332 OE2 GLU A 20 15.887 3.981 4.846 1.00 0.00 O ATOM 0 H GLU A 20 14.405 1.068 5.966 1.00 0.00 H new ATOM 0 HA GLU A 20 17.163 0.497 5.714 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.311 1.527 7.913 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.018 1.287 8.229 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.735 3.595 7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.542 2.852 6.326 1.00 0.00 H new ATOM 339 N GLU A 21 15.441 -1.725 7.371 1.00 0.00 N ATOM 340 CA GLU A 21 15.488 -3.084 7.921 1.00 0.00 C ATOM 341 C GLU A 21 15.803 -4.132 6.831 1.00 0.00 C ATOM 342 O GLU A 21 16.072 -3.819 5.665 1.00 0.00 O ATOM 343 CB GLU A 21 14.186 -3.417 8.677 1.00 0.00 C ATOM 344 CG GLU A 21 13.849 -2.464 9.832 1.00 0.00 C ATOM 345 CD GLU A 21 14.897 -2.518 10.962 1.00 0.00 C ATOM 346 OE1 GLU A 21 14.986 -3.555 11.664 1.00 0.00 O ATOM 347 OE2 GLU A 21 15.634 -1.523 11.166 1.00 0.00 O ATOM 0 H GLU A 21 14.493 -1.404 7.176 1.00 0.00 H new ATOM 0 HA GLU A 21 16.307 -3.123 8.640 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.359 -3.411 7.967 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.261 -4.430 9.071 1.00 0.00 H new ATOM 0 HG2 GLU A 21 13.781 -1.445 9.451 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.869 -2.719 10.236 1.00 0.00 H new ATOM 354 N THR A 22 15.825 -5.405 7.225 1.00 0.00 N ATOM 355 CA THR A 22 16.319 -6.507 6.395 1.00 0.00 C ATOM 356 C THR A 22 15.245 -7.288 5.642 1.00 0.00 C ATOM 357 O THR A 22 14.039 -7.114 5.827 1.00 0.00 O ATOM 358 CB THR A 22 17.181 -7.456 7.232 1.00 0.00 C ATOM 359 OG1 THR A 22 16.358 -8.084 8.191 1.00 0.00 O ATOM 360 CG2 THR A 22 18.321 -6.755 7.969 1.00 0.00 C ATOM 0 H THR A 22 15.496 -5.706 8.142 1.00 0.00 H new ATOM 0 HA THR A 22 16.918 -6.031 5.618 1.00 0.00 H new ATOM 0 HB THR A 22 17.631 -8.168 6.540 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.916 -8.571 8.833 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.889 -7.488 8.541 1.00 0.00 H new ATOM 0 HG22 THR A 22 18.978 -6.270 7.247 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.910 -6.006 8.646 1.00 0.00 H new ATOM 368 N VAL A 23 15.696 -8.204 4.787 1.00 0.00 N ATOM 369 CA VAL A 23 14.852 -9.206 4.122 1.00 0.00 C ATOM 370 C VAL A 23 14.141 -10.090 5.158 1.00 0.00 C ATOM 371 O VAL A 23 12.958 -10.387 5.016 1.00 0.00 O ATOM 372 CB VAL A 23 15.734 -10.053 3.188 1.00 0.00 C ATOM 373 CG1 VAL A 23 14.994 -11.231 2.545 1.00 0.00 C ATOM 374 CG2 VAL A 23 16.340 -9.196 2.070 1.00 0.00 C ATOM 0 H VAL A 23 16.680 -8.275 4.529 1.00 0.00 H new ATOM 0 HA VAL A 23 14.081 -8.706 3.536 1.00 0.00 H new ATOM 0 HB VAL A 23 16.517 -10.457 3.830 1.00 0.00 H new ATOM 0 HG11 VAL A 23 15.678 -11.782 1.900 1.00 0.00 H new ATOM 0 HG12 VAL A 23 14.617 -11.893 3.325 1.00 0.00 H new ATOM 0 HG13 VAL A 23 14.159 -10.857 1.952 1.00 0.00 H new ATOM 0 HG21 VAL A 23 16.958 -9.822 1.426 1.00 0.00 H new ATOM 0 HG22 VAL A 23 15.540 -8.748 1.481 1.00 0.00 H new ATOM 0 HG23 VAL A 23 16.953 -8.408 2.507 1.00 0.00 H new ATOM 384 N LYS A 24 14.823 -10.466 6.245 1.00 0.00 N ATOM 385 CA LYS A 24 14.238 -11.134 7.418 1.00 0.00 C ATOM 386 C LYS A 24 13.135 -10.301 8.082 1.00 0.00 C ATOM 387 O LYS A 24 12.112 -10.869 8.455 1.00 0.00 O ATOM 388 CB LYS A 24 15.397 -11.483 8.357 1.00 0.00 C ATOM 389 CG LYS A 24 15.043 -12.171 9.683 1.00 0.00 C ATOM 390 CD LYS A 24 16.284 -12.880 10.256 1.00 0.00 C ATOM 391 CE LYS A 24 17.516 -11.963 10.391 1.00 0.00 C ATOM 392 NZ LYS A 24 18.777 -12.741 10.437 1.00 0.00 N ATOM 0 H LYS A 24 15.827 -10.311 6.338 1.00 0.00 H new ATOM 0 HA LYS A 24 13.722 -12.047 7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.088 -12.129 7.815 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.934 -10.563 8.587 1.00 0.00 H new ATOM 0 HG2 LYS A 24 14.673 -11.435 10.397 1.00 0.00 H new ATOM 0 HG3 LYS A 24 14.242 -12.893 9.525 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.038 -13.289 11.236 1.00 0.00 H new ATOM 0 HD3 LYS A 24 16.539 -13.723 9.614 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.547 -11.269 9.551 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.425 -11.363 11.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.588 -12.091 10.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.818 -13.284 11.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.811 -13.395 9.629 1.00 0.00 H new ATOM 406 N ALA A 25 13.276 -8.975 8.163 1.00 0.00 N ATOM 407 CA ALA A 25 12.195 -8.082 8.599 1.00 0.00 C ATOM 408 C ALA A 25 10.992 -8.068 7.625 1.00 0.00 C ATOM 409 O ALA A 25 9.848 -8.126 8.072 1.00 0.00 O ATOM 410 CB ALA A 25 12.750 -6.681 8.860 1.00 0.00 C ATOM 0 H ALA A 25 14.142 -8.489 7.929 1.00 0.00 H new ATOM 0 HA ALA A 25 11.796 -8.474 9.535 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.942 -6.024 9.183 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.511 -6.730 9.639 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.193 -6.289 7.944 1.00 0.00 H new ATOM 416 N LEU A 26 11.210 -8.054 6.303 1.00 0.00 N ATOM 417 CA LEU A 26 10.157 -8.258 5.299 1.00 0.00 C ATOM 418 C LEU A 26 9.402 -9.576 5.555 1.00 0.00 C ATOM 419 O LEU A 26 8.182 -9.571 5.724 1.00 0.00 O ATOM 420 CB LEU A 26 10.787 -8.138 3.892 1.00 0.00 C ATOM 421 CG LEU A 26 9.939 -8.609 2.701 1.00 0.00 C ATOM 422 CD1 LEU A 26 8.563 -7.963 2.724 1.00 0.00 C ATOM 423 CD2 LEU A 26 10.630 -8.225 1.393 1.00 0.00 C ATOM 0 H LEU A 26 12.132 -7.899 5.896 1.00 0.00 H new ATOM 0 HA LEU A 26 9.391 -7.486 5.372 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.050 -7.093 3.727 1.00 0.00 H new ATOM 0 HB3 LEU A 26 11.718 -8.705 3.889 1.00 0.00 H new ATOM 0 HG LEU A 26 9.830 -9.691 2.773 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.982 -8.313 1.870 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.050 -8.233 3.647 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.669 -6.879 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 26 10.026 -8.561 0.550 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.747 -7.142 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.611 -8.698 1.347 1.00 0.00 H new ATOM 435 N LYS A 27 10.124 -10.692 5.670 1.00 0.00 N ATOM 436 CA LYS A 27 9.568 -11.999 6.069 1.00 0.00 C ATOM 437 C LYS A 27 8.782 -11.964 7.388 1.00 0.00 C ATOM 438 O LYS A 27 7.713 -12.568 7.455 1.00 0.00 O ATOM 439 CB LYS A 27 10.648 -13.094 6.085 1.00 0.00 C ATOM 440 CG LYS A 27 11.242 -13.363 4.690 1.00 0.00 C ATOM 441 CD LYS A 27 11.947 -14.722 4.589 1.00 0.00 C ATOM 442 CE LYS A 27 13.201 -14.854 5.461 1.00 0.00 C ATOM 443 NZ LYS A 27 13.659 -16.268 5.493 1.00 0.00 N ATOM 0 H LYS A 27 11.127 -10.720 5.487 1.00 0.00 H new ATOM 0 HA LYS A 27 8.839 -12.252 5.299 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.447 -12.800 6.765 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.219 -14.016 6.477 1.00 0.00 H new ATOM 0 HG2 LYS A 27 10.445 -13.317 3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.952 -12.573 4.445 1.00 0.00 H new ATOM 0 HD2 LYS A 27 11.242 -15.505 4.868 1.00 0.00 H new ATOM 0 HD3 LYS A 27 12.223 -14.898 3.549 1.00 0.00 H new ATOM 0 HE2 LYS A 27 13.994 -14.216 5.069 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.987 -14.511 6.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.547 -16.333 6.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.934 -16.858 5.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.817 -16.604 4.521 1.00 0.00 H new ATOM 457 N GLU A 28 9.252 -11.234 8.405 1.00 0.00 N ATOM 458 CA GLU A 28 8.524 -10.937 9.657 1.00 0.00 C ATOM 459 C GLU A 28 7.149 -10.310 9.386 1.00 0.00 C ATOM 460 O GLU A 28 6.135 -10.777 9.906 1.00 0.00 O ATOM 461 CB GLU A 28 9.408 -10.118 10.631 1.00 0.00 C ATOM 462 CG GLU A 28 8.936 -8.723 11.102 1.00 0.00 C ATOM 463 CD GLU A 28 7.771 -8.756 12.117 1.00 0.00 C ATOM 464 OE1 GLU A 28 7.820 -9.545 13.092 1.00 0.00 O ATOM 465 OE2 GLU A 28 6.818 -7.953 11.972 1.00 0.00 O ATOM 0 H GLU A 28 10.182 -10.816 8.385 1.00 0.00 H new ATOM 0 HA GLU A 28 8.310 -11.879 10.162 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.563 -10.727 11.521 1.00 0.00 H new ATOM 0 HB3 GLU A 28 10.382 -9.990 10.158 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.780 -8.199 11.552 1.00 0.00 H new ATOM 0 HG3 GLU A 28 8.628 -8.143 10.232 1.00 0.00 H new ATOM 472 N LYS A 29 7.098 -9.276 8.542 1.00 0.00 N ATOM 473 CA LYS A 29 5.883 -8.536 8.203 1.00 0.00 C ATOM 474 C LYS A 29 4.910 -9.367 7.356 1.00 0.00 C ATOM 475 O LYS A 29 3.704 -9.317 7.593 1.00 0.00 O ATOM 476 CB LYS A 29 6.332 -7.222 7.548 1.00 0.00 C ATOM 477 CG LYS A 29 5.291 -6.100 7.569 1.00 0.00 C ATOM 478 CD LYS A 29 4.804 -5.734 8.984 1.00 0.00 C ATOM 479 CE LYS A 29 4.309 -4.286 9.131 1.00 0.00 C ATOM 480 NZ LYS A 29 3.356 -3.880 8.066 1.00 0.00 N ATOM 0 H LYS A 29 7.926 -8.922 8.063 1.00 0.00 H new ATOM 0 HA LYS A 29 5.299 -8.307 9.094 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.232 -6.871 8.052 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.605 -7.425 6.512 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.716 -5.213 7.100 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.434 -6.400 6.966 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.997 -6.411 9.264 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.618 -5.900 9.689 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.828 -4.171 10.102 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.166 -3.613 9.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.685 -3.183 8.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.880 -3.458 7.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.834 -4.715 7.730 1.00 0.00 H new ATOM 494 N ILE A 30 5.425 -10.195 6.442 1.00 0.00 N ATOM 495 CA ILE A 30 4.657 -11.212 5.701 1.00 0.00 C ATOM 496 C ILE A 30 4.050 -12.239 6.669 1.00 0.00 C ATOM 497 O ILE A 30 2.847 -12.483 6.622 1.00 0.00 O ATOM 498 CB ILE A 30 5.534 -11.897 4.625 1.00 0.00 C ATOM 499 CG1 ILE A 30 5.932 -10.897 3.519 1.00 0.00 C ATOM 500 CG2 ILE A 30 4.788 -13.082 3.976 1.00 0.00 C ATOM 501 CD1 ILE A 30 7.152 -11.322 2.691 1.00 0.00 C ATOM 0 H ILE A 30 6.413 -10.180 6.187 1.00 0.00 H new ATOM 0 HA ILE A 30 3.838 -10.714 5.183 1.00 0.00 H new ATOM 0 HB ILE A 30 6.431 -12.262 5.126 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.084 -10.758 2.849 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.138 -9.930 3.977 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.426 -13.546 3.224 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.536 -13.816 4.741 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.874 -12.722 3.504 1.00 0.00 H new ATOM 0 HD11 ILE A 30 7.362 -10.563 1.937 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.016 -11.432 3.346 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.945 -12.273 2.200 1.00 0.00 H new ATOM 513 N GLU A 31 4.853 -12.824 7.563 1.00 0.00 N ATOM 514 CA GLU A 31 4.397 -13.782 8.582 1.00 0.00 C ATOM 515 C GLU A 31 3.304 -13.176 9.482 1.00 0.00 C ATOM 516 O GLU A 31 2.266 -13.802 9.702 1.00 0.00 O ATOM 517 CB GLU A 31 5.610 -14.283 9.389 1.00 0.00 C ATOM 518 CG GLU A 31 5.247 -15.289 10.491 1.00 0.00 C ATOM 519 CD GLU A 31 5.402 -14.672 11.898 1.00 0.00 C ATOM 520 OE1 GLU A 31 4.453 -14.021 12.394 1.00 0.00 O ATOM 521 OE2 GLU A 31 6.474 -14.856 12.525 1.00 0.00 O ATOM 0 H GLU A 31 5.856 -12.644 7.602 1.00 0.00 H new ATOM 0 HA GLU A 31 3.936 -14.637 8.088 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.322 -14.747 8.707 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.112 -13.428 9.841 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.220 -15.626 10.352 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.886 -16.168 10.406 1.00 0.00 H new ATOM 528 N SER A 32 3.494 -11.932 9.933 1.00 0.00 N ATOM 529 CA SER A 32 2.517 -11.157 10.708 1.00 0.00 C ATOM 530 C SER A 32 1.176 -10.992 9.973 1.00 0.00 C ATOM 531 O SER A 32 0.115 -11.274 10.537 1.00 0.00 O ATOM 532 CB SER A 32 3.116 -9.789 11.057 1.00 0.00 C ATOM 533 OG SER A 32 2.251 -9.063 11.916 1.00 0.00 O ATOM 0 H SER A 32 4.359 -11.419 9.764 1.00 0.00 H new ATOM 0 HA SER A 32 2.301 -11.711 11.622 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.085 -9.924 11.538 1.00 0.00 H new ATOM 0 HB3 SER A 32 3.290 -9.220 10.144 1.00 0.00 H new ATOM 0 HG SER A 32 2.653 -8.195 12.127 1.00 0.00 H new ATOM 539 N GLU A 33 1.201 -10.559 8.708 1.00 0.00 N ATOM 540 CA GLU A 33 0.003 -10.327 7.889 1.00 0.00 C ATOM 541 C GLU A 33 -0.721 -11.629 7.495 1.00 0.00 C ATOM 542 O GLU A 33 -1.926 -11.766 7.719 1.00 0.00 O ATOM 543 CB GLU A 33 0.405 -9.528 6.636 1.00 0.00 C ATOM 544 CG GLU A 33 -0.781 -9.010 5.808 1.00 0.00 C ATOM 545 CD GLU A 33 -1.698 -8.056 6.601 1.00 0.00 C ATOM 546 OE1 GLU A 33 -1.212 -7.022 7.121 1.00 0.00 O ATOM 547 OE2 GLU A 33 -2.920 -8.325 6.701 1.00 0.00 O ATOM 0 H GLU A 33 2.070 -10.356 8.214 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.708 -9.760 8.490 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.018 -8.680 6.942 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.028 -10.159 6.002 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.403 -8.493 4.926 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.367 -9.858 5.453 1.00 0.00 H new ATOM 554 N LYS A 34 -0.001 -12.579 6.880 1.00 0.00 N ATOM 555 CA LYS A 34 -0.560 -13.799 6.265 1.00 0.00 C ATOM 556 C LYS A 34 -0.774 -14.959 7.250 1.00 0.00 C ATOM 557 O LYS A 34 -1.547 -15.875 6.966 1.00 0.00 O ATOM 558 CB LYS A 34 0.349 -14.261 5.109 1.00 0.00 C ATOM 559 CG LYS A 34 0.673 -13.193 4.045 1.00 0.00 C ATOM 560 CD LYS A 34 -0.555 -12.561 3.374 1.00 0.00 C ATOM 561 CE LYS A 34 -1.325 -13.580 2.521 1.00 0.00 C ATOM 562 NZ LYS A 34 -2.454 -12.947 1.790 1.00 0.00 N ATOM 0 H LYS A 34 1.014 -12.521 6.793 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.550 -13.527 5.898 1.00 0.00 H new ATOM 0 HB2 LYS A 34 1.287 -14.623 5.531 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.126 -15.108 4.614 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.262 -12.403 4.511 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.298 -13.645 3.275 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -1.217 -12.152 4.138 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -0.238 -11.727 2.747 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -0.645 -14.044 1.807 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.707 -14.375 3.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.352 -13.358 2.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.455 -11.923 1.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.345 -13.117 0.770 1.00 0.00 H new ATOM 576 N GLY A 35 -0.109 -14.908 8.402 1.00 0.00 N ATOM 577 CA GLY A 35 -0.104 -15.919 9.467 1.00 0.00 C ATOM 578 C GLY A 35 1.021 -16.955 9.320 1.00 0.00 C ATOM 579 O GLY A 35 1.393 -17.342 8.206 1.00 0.00 O ATOM 0 H GLY A 35 0.480 -14.109 8.636 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.005 -15.420 10.431 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.064 -16.435 9.473 1.00 0.00 H new ATOM 583 N LYS A 36 1.527 -17.462 10.456 1.00 0.00 N ATOM 584 CA LYS A 36 2.621 -18.455 10.531 1.00 0.00 C ATOM 585 C LYS A 36 2.285 -19.787 9.853 1.00 0.00 C ATOM 586 O LYS A 36 3.175 -20.450 9.329 1.00 0.00 O ATOM 587 CB LYS A 36 3.001 -18.737 11.996 1.00 0.00 C ATOM 588 CG LYS A 36 3.454 -17.495 12.776 1.00 0.00 C ATOM 589 CD LYS A 36 3.786 -17.792 14.245 1.00 0.00 C ATOM 590 CE LYS A 36 2.538 -18.120 15.078 1.00 0.00 C ATOM 591 NZ LYS A 36 2.886 -18.359 16.503 1.00 0.00 N ATOM 0 H LYS A 36 1.180 -17.188 11.375 1.00 0.00 H new ATOM 0 HA LYS A 36 3.457 -18.007 9.993 1.00 0.00 H new ATOM 0 HB2 LYS A 36 2.144 -19.179 12.504 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.801 -19.478 12.017 1.00 0.00 H new ATOM 0 HG2 LYS A 36 4.332 -17.069 12.291 1.00 0.00 H new ATOM 0 HG3 LYS A 36 2.669 -16.740 12.733 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.482 -18.630 14.294 1.00 0.00 H new ATOM 0 HD3 LYS A 36 4.293 -16.931 14.680 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.826 -17.298 15.009 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.047 -19.003 14.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 2.022 -18.578 17.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.547 -19.159 16.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.333 -17.507 16.899 1.00 0.00 H new ATOM 605 N ASP A 37 1.012 -20.183 9.853 1.00 0.00 N ATOM 606 CA ASP A 37 0.533 -21.415 9.210 1.00 0.00 C ATOM 607 C ASP A 37 0.685 -21.381 7.678 1.00 0.00 C ATOM 608 O ASP A 37 0.977 -22.406 7.058 1.00 0.00 O ATOM 609 CB ASP A 37 -0.942 -21.645 9.567 1.00 0.00 C ATOM 610 CG ASP A 37 -1.136 -21.945 11.062 1.00 0.00 C ATOM 611 OD1 ASP A 37 -0.890 -23.100 11.486 1.00 0.00 O ATOM 612 OD2 ASP A 37 -1.538 -21.027 11.816 1.00 0.00 O ATOM 0 H ASP A 37 0.269 -19.651 10.306 1.00 0.00 H new ATOM 0 HA ASP A 37 1.150 -22.232 9.584 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.522 -20.762 9.297 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -1.332 -22.475 8.978 1.00 0.00 H new ATOM 617 N ALA A 38 0.494 -20.206 7.068 1.00 0.00 N ATOM 618 CA ALA A 38 0.606 -19.993 5.626 1.00 0.00 C ATOM 619 C ALA A 38 2.051 -19.672 5.196 1.00 0.00 C ATOM 620 O ALA A 38 2.571 -20.289 4.264 1.00 0.00 O ATOM 621 CB ALA A 38 -0.364 -18.874 5.227 1.00 0.00 C ATOM 0 H ALA A 38 0.251 -19.357 7.579 1.00 0.00 H new ATOM 0 HA ALA A 38 0.341 -20.914 5.106 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.296 -18.699 4.153 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -1.382 -19.167 5.483 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -0.104 -17.960 5.761 1.00 0.00 H new ATOM 627 N PHE A 39 2.696 -18.712 5.870 1.00 0.00 N ATOM 628 CA PHE A 39 4.019 -18.179 5.521 1.00 0.00 C ATOM 629 C PHE A 39 4.896 -17.963 6.776 1.00 0.00 C ATOM 630 O PHE A 39 5.079 -16.823 7.213 1.00 0.00 O ATOM 631 CB PHE A 39 3.840 -16.888 4.697 1.00 0.00 C ATOM 632 CG PHE A 39 3.284 -17.093 3.297 1.00 0.00 C ATOM 633 CD1 PHE A 39 4.147 -17.413 2.230 1.00 0.00 C ATOM 634 CD2 PHE A 39 1.905 -16.956 3.054 1.00 0.00 C ATOM 635 CE1 PHE A 39 3.636 -17.586 0.931 1.00 0.00 C ATOM 636 CE2 PHE A 39 1.392 -17.127 1.755 1.00 0.00 C ATOM 637 CZ PHE A 39 2.258 -17.439 0.693 1.00 0.00 C ATOM 0 H PHE A 39 2.299 -18.271 6.700 1.00 0.00 H new ATOM 0 HA PHE A 39 4.553 -18.907 4.910 1.00 0.00 H new ATOM 0 HB2 PHE A 39 3.176 -16.216 5.241 1.00 0.00 H new ATOM 0 HB3 PHE A 39 4.805 -16.388 4.619 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.206 -17.526 2.410 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.237 -16.718 3.869 1.00 0.00 H new ATOM 0 HE1 PHE A 39 4.302 -17.832 0.117 1.00 0.00 H new ATOM 0 HE2 PHE A 39 0.333 -17.018 1.574 1.00 0.00 H new ATOM 0 HZ PHE A 39 1.865 -17.566 -0.305 1.00 0.00 H new ATOM 647 N PRO A 40 5.486 -19.024 7.361 1.00 0.00 N ATOM 648 CA PRO A 40 6.441 -18.890 8.465 1.00 0.00 C ATOM 649 C PRO A 40 7.770 -18.304 7.957 1.00 0.00 C ATOM 650 O PRO A 40 8.170 -18.573 6.825 1.00 0.00 O ATOM 651 CB PRO A 40 6.617 -20.314 9.004 1.00 0.00 C ATOM 652 CG PRO A 40 6.381 -21.200 7.780 1.00 0.00 C ATOM 653 CD PRO A 40 5.377 -20.414 6.937 1.00 0.00 C ATOM 0 HA PRO A 40 6.093 -18.210 9.243 1.00 0.00 H new ATOM 0 HB2 PRO A 40 7.613 -20.464 9.420 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.904 -20.532 9.799 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.307 -21.379 7.233 1.00 0.00 H new ATOM 0 HG3 PRO A 40 5.985 -22.175 8.064 1.00 0.00 H new ATOM 0 HD2 PRO A 40 5.598 -20.515 5.874 1.00 0.00 H new ATOM 0 HD3 PRO A 40 4.365 -20.788 7.089 1.00 0.00 H new ATOM 661 N VAL A 41 8.490 -17.537 8.783 1.00 0.00 N ATOM 662 CA VAL A 41 9.737 -16.830 8.392 1.00 0.00 C ATOM 663 C VAL A 41 10.796 -17.774 7.817 1.00 0.00 C ATOM 664 O VAL A 41 11.427 -17.465 6.805 1.00 0.00 O ATOM 665 CB VAL A 41 10.332 -16.052 9.586 1.00 0.00 C ATOM 666 CG1 VAL A 41 11.681 -15.392 9.262 1.00 0.00 C ATOM 667 CG2 VAL A 41 9.359 -14.962 10.037 1.00 0.00 C ATOM 0 H VAL A 41 8.228 -17.381 9.757 1.00 0.00 H new ATOM 0 HA VAL A 41 9.454 -16.130 7.606 1.00 0.00 H new ATOM 0 HB VAL A 41 10.497 -16.784 10.376 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.047 -14.861 10.141 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.401 -16.158 8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 41 11.553 -14.688 8.440 1.00 0.00 H new ATOM 0 HG21 VAL A 41 9.787 -14.418 10.879 1.00 0.00 H new ATOM 0 HG22 VAL A 41 9.179 -14.271 9.213 1.00 0.00 H new ATOM 0 HG23 VAL A 41 8.417 -15.418 10.340 1.00 0.00 H new ATOM 677 N ALA A 42 11.007 -18.919 8.465 1.00 0.00 N ATOM 678 CA ALA A 42 12.001 -19.909 8.044 1.00 0.00 C ATOM 679 C ALA A 42 11.635 -20.605 6.712 1.00 0.00 C ATOM 680 O ALA A 42 12.495 -20.809 5.849 1.00 0.00 O ATOM 681 CB ALA A 42 12.179 -20.927 9.178 1.00 0.00 C ATOM 0 H ALA A 42 10.491 -19.189 9.302 1.00 0.00 H new ATOM 0 HA ALA A 42 12.942 -19.394 7.849 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.916 -21.674 8.884 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.521 -20.414 10.077 1.00 0.00 H new ATOM 0 HB3 ALA A 42 11.227 -21.417 9.380 1.00 0.00 H new ATOM 687 N GLY A 43 10.353 -20.950 6.527 1.00 0.00 N ATOM 688 CA GLY A 43 9.835 -21.588 5.308 1.00 0.00 C ATOM 689 C GLY A 43 9.773 -20.628 4.117 1.00 0.00 C ATOM 690 O GLY A 43 10.122 -21.002 2.996 1.00 0.00 O ATOM 0 H GLY A 43 9.634 -20.791 7.233 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.467 -22.438 5.051 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.837 -21.981 5.505 1.00 0.00 H new ATOM 694 N GLN A 44 9.385 -19.373 4.353 1.00 0.00 N ATOM 695 CA GLN A 44 9.419 -18.299 3.362 1.00 0.00 C ATOM 696 C GLN A 44 10.802 -18.132 2.707 1.00 0.00 C ATOM 697 O GLN A 44 11.838 -18.171 3.379 1.00 0.00 O ATOM 698 CB GLN A 44 9.072 -16.962 4.023 1.00 0.00 C ATOM 699 CG GLN A 44 7.590 -16.627 4.191 1.00 0.00 C ATOM 700 CD GLN A 44 7.488 -15.232 4.802 1.00 0.00 C ATOM 701 OE1 GLN A 44 7.911 -14.253 4.211 1.00 0.00 O ATOM 702 NE2 GLN A 44 6.981 -15.070 6.003 1.00 0.00 N ATOM 0 H GLN A 44 9.030 -19.070 5.260 1.00 0.00 H new ATOM 0 HA GLN A 44 8.694 -18.575 2.597 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.536 -16.943 5.009 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.533 -16.167 3.438 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.080 -16.659 3.228 1.00 0.00 H new ATOM 0 HG3 GLN A 44 7.104 -17.361 4.834 1.00 0.00 H new ATOM 0 HE21 GLN A 44 6.621 -15.874 6.517 1.00 0.00 H new ATOM 0 HE22 GLN A 44 6.948 -14.140 6.421 1.00 0.00 H new ATOM 711 N LYS A 45 10.800 -17.853 1.402 1.00 0.00 N ATOM 712 CA LYS A 45 11.952 -17.428 0.594 1.00 0.00 C ATOM 713 C LYS A 45 11.560 -16.185 -0.201 1.00 0.00 C ATOM 714 O LYS A 45 10.391 -15.996 -0.550 1.00 0.00 O ATOM 715 CB LYS A 45 12.441 -18.528 -0.366 1.00 0.00 C ATOM 716 CG LYS A 45 12.722 -19.885 0.283 1.00 0.00 C ATOM 717 CD LYS A 45 13.925 -19.890 1.238 1.00 0.00 C ATOM 718 CE LYS A 45 14.066 -21.263 1.908 1.00 0.00 C ATOM 719 NZ LYS A 45 13.020 -21.497 2.940 1.00 0.00 N ATOM 0 H LYS A 45 9.947 -17.921 0.846 1.00 0.00 H new ATOM 0 HA LYS A 45 12.777 -17.212 1.273 1.00 0.00 H new ATOM 0 HB2 LYS A 45 11.693 -18.665 -1.146 1.00 0.00 H new ATOM 0 HB3 LYS A 45 13.352 -18.182 -0.855 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.836 -20.203 0.832 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.892 -20.622 -0.502 1.00 0.00 H new ATOM 0 HD2 LYS A 45 14.835 -19.651 0.689 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.799 -19.118 1.997 1.00 0.00 H new ATOM 0 HE2 LYS A 45 14.006 -22.043 1.149 1.00 0.00 H new ATOM 0 HE3 LYS A 45 15.051 -21.341 2.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.037 -22.495 3.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.205 -20.892 3.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.086 -21.267 2.545 1.00 0.00 H new ATOM 733 N LEU A 46 12.560 -15.366 -0.495 1.00 0.00 N ATOM 734 CA LEU A 46 12.434 -14.025 -1.056 1.00 0.00 C ATOM 735 C LEU A 46 13.366 -13.876 -2.259 1.00 0.00 C ATOM 736 O LEU A 46 14.583 -13.969 -2.108 1.00 0.00 O ATOM 737 CB LEU A 46 12.735 -12.991 0.058 1.00 0.00 C ATOM 738 CG LEU A 46 11.550 -12.096 0.448 1.00 0.00 C ATOM 739 CD1 LEU A 46 11.169 -11.207 -0.727 1.00 0.00 C ATOM 740 CD2 LEU A 46 10.319 -12.880 0.905 1.00 0.00 C ATOM 0 H LEU A 46 13.533 -15.632 -0.341 1.00 0.00 H new ATOM 0 HA LEU A 46 11.420 -13.849 -1.417 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.076 -13.524 0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 46 13.559 -12.356 -0.269 1.00 0.00 H new ATOM 0 HG LEU A 46 11.881 -11.499 1.297 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.328 -10.573 -0.446 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.019 -10.582 -1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.887 -11.828 -1.577 1.00 0.00 H new ATOM 0 HD21 LEU A 46 9.521 -12.185 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 46 9.984 -13.533 0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.574 -13.482 1.777 1.00 0.00 H new ATOM 752 N ILE A 47 12.803 -13.697 -3.454 1.00 0.00 N ATOM 753 CA ILE A 47 13.526 -13.729 -4.732 1.00 0.00 C ATOM 754 C ILE A 47 13.250 -12.451 -5.533 1.00 0.00 C ATOM 755 O ILE A 47 12.093 -12.107 -5.790 1.00 0.00 O ATOM 756 CB ILE A 47 13.178 -15.030 -5.495 1.00 0.00 C ATOM 757 CG1 ILE A 47 13.629 -16.291 -4.715 1.00 0.00 C ATOM 758 CG2 ILE A 47 13.865 -15.111 -6.857 1.00 0.00 C ATOM 759 CD1 ILE A 47 12.462 -17.036 -4.091 1.00 0.00 C ATOM 0 H ILE A 47 11.805 -13.521 -3.566 1.00 0.00 H new ATOM 0 HA ILE A 47 14.602 -13.747 -4.558 1.00 0.00 H new ATOM 0 HB ILE A 47 12.095 -15.001 -5.612 1.00 0.00 H new ATOM 0 HG12 ILE A 47 14.164 -16.960 -5.389 1.00 0.00 H new ATOM 0 HG13 ILE A 47 14.330 -15.999 -3.933 1.00 0.00 H new ATOM 0 HG21 ILE A 47 13.587 -16.043 -7.350 1.00 0.00 H new ATOM 0 HG22 ILE A 47 13.553 -14.267 -7.473 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.946 -15.081 -6.722 1.00 0.00 H new ATOM 0 HD11 ILE A 47 12.833 -17.911 -3.557 1.00 0.00 H new ATOM 0 HD12 ILE A 47 11.941 -16.379 -3.394 1.00 0.00 H new ATOM 0 HD13 ILE A 47 11.773 -17.354 -4.874 1.00 0.00 H new ATOM 771 N TYR A 48 14.319 -11.745 -5.917 1.00 0.00 N ATOM 772 CA TYR A 48 14.272 -10.556 -6.773 1.00 0.00 C ATOM 773 C TYR A 48 15.296 -10.633 -7.910 1.00 0.00 C ATOM 774 O TYR A 48 16.386 -11.175 -7.726 1.00 0.00 O ATOM 775 CB TYR A 48 14.483 -9.279 -5.952 1.00 0.00 C ATOM 776 CG TYR A 48 14.118 -7.985 -6.665 1.00 0.00 C ATOM 777 CD1 TYR A 48 12.851 -7.827 -7.266 1.00 0.00 C ATOM 778 CD2 TYR A 48 15.046 -6.925 -6.715 1.00 0.00 C ATOM 779 CE1 TYR A 48 12.515 -6.622 -7.912 1.00 0.00 C ATOM 780 CE2 TYR A 48 14.709 -5.717 -7.356 1.00 0.00 C ATOM 781 CZ TYR A 48 13.443 -5.560 -7.954 1.00 0.00 C ATOM 782 OH TYR A 48 13.118 -4.385 -8.560 1.00 0.00 O ATOM 0 H TYR A 48 15.267 -11.992 -5.633 1.00 0.00 H new ATOM 0 HA TYR A 48 13.279 -10.523 -7.220 1.00 0.00 H new ATOM 0 HB2 TYR A 48 13.893 -9.351 -5.039 1.00 0.00 H new ATOM 0 HB3 TYR A 48 15.530 -9.227 -5.652 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.135 -8.635 -7.230 1.00 0.00 H new ATOM 0 HD2 TYR A 48 16.019 -7.040 -6.260 1.00 0.00 H new ATOM 0 HE1 TYR A 48 11.546 -6.510 -8.376 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.424 -4.908 -7.389 1.00 0.00 H new ATOM 0 HH TYR A 48 13.873 -3.764 -8.495 1.00 0.00 H new ATOM 792 N ALA A 49 14.977 -10.057 -9.075 1.00 0.00 N ATOM 793 CA ALA A 49 15.876 -9.973 -10.233 1.00 0.00 C ATOM 794 C ALA A 49 16.521 -11.324 -10.655 1.00 0.00 C ATOM 795 O ALA A 49 17.628 -11.362 -11.197 1.00 0.00 O ATOM 796 CB ALA A 49 16.884 -8.849 -9.948 1.00 0.00 C ATOM 0 H ALA A 49 14.067 -9.627 -9.243 1.00 0.00 H new ATOM 0 HA ALA A 49 15.296 -9.727 -11.122 1.00 0.00 H new ATOM 0 HB1 ALA A 49 17.572 -8.755 -10.788 1.00 0.00 H new ATOM 0 HB2 ALA A 49 16.351 -7.909 -9.809 1.00 0.00 H new ATOM 0 HB3 ALA A 49 17.446 -9.085 -9.044 1.00 0.00 H new ATOM 802 N GLY A 50 15.833 -12.440 -10.389 1.00 0.00 N ATOM 803 CA GLY A 50 16.270 -13.817 -10.639 1.00 0.00 C ATOM 804 C GLY A 50 17.220 -14.420 -9.590 1.00 0.00 C ATOM 805 O GLY A 50 17.818 -15.462 -9.858 1.00 0.00 O ATOM 0 H GLY A 50 14.904 -12.404 -9.970 1.00 0.00 H new ATOM 0 HA2 GLY A 50 15.386 -14.451 -10.708 1.00 0.00 H new ATOM 0 HA3 GLY A 50 16.764 -13.851 -11.610 1.00 0.00 H new ATOM 809 N LYS A 51 17.384 -13.794 -8.414 1.00 0.00 N ATOM 810 CA LYS A 51 18.283 -14.218 -7.318 1.00 0.00 C ATOM 811 C LYS A 51 17.591 -14.175 -5.951 1.00 0.00 C ATOM 812 O LYS A 51 16.835 -13.248 -5.657 1.00 0.00 O ATOM 813 CB LYS A 51 19.530 -13.320 -7.297 1.00 0.00 C ATOM 814 CG LYS A 51 20.428 -13.632 -8.500 1.00 0.00 C ATOM 815 CD LYS A 51 21.800 -12.963 -8.391 1.00 0.00 C ATOM 816 CE LYS A 51 22.667 -13.538 -9.511 1.00 0.00 C ATOM 817 NZ LYS A 51 24.059 -13.020 -9.460 1.00 0.00 N ATOM 0 H LYS A 51 16.873 -12.941 -8.187 1.00 0.00 H new ATOM 0 HA LYS A 51 18.568 -15.253 -7.508 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.232 -12.272 -7.318 1.00 0.00 H new ATOM 0 HB3 LYS A 51 20.083 -13.475 -6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 51 20.558 -14.711 -8.583 1.00 0.00 H new ATOM 0 HG3 LYS A 51 19.936 -13.299 -9.414 1.00 0.00 H new ATOM 0 HD2 LYS A 51 21.711 -11.881 -8.489 1.00 0.00 H new ATOM 0 HD3 LYS A 51 22.248 -13.159 -7.417 1.00 0.00 H new ATOM 0 HE2 LYS A 51 22.682 -14.625 -9.436 1.00 0.00 H new ATOM 0 HE3 LYS A 51 22.224 -13.291 -10.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 24.613 -13.435 -10.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 24.048 -11.985 -9.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 24.492 -13.277 -8.550 1.00 0.00 H new ATOM 831 N ILE A 52 17.855 -15.161 -5.092 1.00 0.00 N ATOM 832 CA ILE A 52 17.370 -15.168 -3.703 1.00 0.00 C ATOM 833 C ILE A 52 18.101 -14.100 -2.877 1.00 0.00 C ATOM 834 O ILE A 52 19.333 -14.034 -2.866 1.00 0.00 O ATOM 835 CB ILE A 52 17.513 -16.564 -3.064 1.00 0.00 C ATOM 836 CG1 ILE A 52 17.060 -17.645 -4.073 1.00 0.00 C ATOM 837 CG2 ILE A 52 16.723 -16.611 -1.746 1.00 0.00 C ATOM 838 CD1 ILE A 52 16.469 -18.917 -3.488 1.00 0.00 C ATOM 0 H ILE A 52 18.412 -15.980 -5.336 1.00 0.00 H new ATOM 0 HA ILE A 52 16.307 -14.926 -3.713 1.00 0.00 H new ATOM 0 HB ILE A 52 18.556 -16.768 -2.821 1.00 0.00 H new ATOM 0 HG12 ILE A 52 16.320 -17.201 -4.739 1.00 0.00 H new ATOM 0 HG13 ILE A 52 17.918 -17.919 -4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 52 16.825 -17.598 -1.296 1.00 0.00 H new ATOM 0 HG22 ILE A 52 17.113 -15.858 -1.061 1.00 0.00 H new ATOM 0 HG23 ILE A 52 15.670 -16.410 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 52 16.191 -19.594 -4.296 1.00 0.00 H new ATOM 0 HD12 ILE A 52 17.207 -19.400 -2.847 1.00 0.00 H new ATOM 0 HD13 ILE A 52 15.585 -18.671 -2.901 1.00 0.00 H new ATOM 850 N LEU A 53 17.331 -13.259 -2.190 1.00 0.00 N ATOM 851 CA LEU A 53 17.811 -12.223 -1.280 1.00 0.00 C ATOM 852 C LEU A 53 18.365 -12.842 0.019 1.00 0.00 C ATOM 853 O LEU A 53 17.759 -13.755 0.588 1.00 0.00 O ATOM 854 CB LEU A 53 16.649 -11.270 -0.956 1.00 0.00 C ATOM 855 CG LEU A 53 15.873 -10.677 -2.145 1.00 0.00 C ATOM 856 CD1 LEU A 53 14.844 -9.677 -1.619 1.00 0.00 C ATOM 857 CD2 LEU A 53 16.804 -9.956 -3.109 1.00 0.00 C ATOM 0 H LEU A 53 16.313 -13.282 -2.255 1.00 0.00 H new ATOM 0 HA LEU A 53 18.621 -11.674 -1.760 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.940 -11.804 -0.323 1.00 0.00 H new ATOM 0 HB3 LEU A 53 17.044 -10.444 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 53 15.386 -11.494 -2.677 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.289 -9.252 -2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.153 -10.186 -0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 53 15.355 -8.879 -1.079 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.225 -9.549 -3.938 1.00 0.00 H new ATOM 0 HD22 LEU A 53 17.311 -9.144 -2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.544 -10.658 -3.494 1.00 0.00 H new ATOM 869 N ASN A 54 19.498 -12.341 0.515 1.00 0.00 N ATOM 870 CA ASN A 54 20.097 -12.788 1.777 1.00 0.00 C ATOM 871 C ASN A 54 19.287 -12.280 2.985 1.00 0.00 C ATOM 872 O ASN A 54 19.106 -11.070 3.126 1.00 0.00 O ATOM 873 CB ASN A 54 21.546 -12.284 1.840 1.00 0.00 C ATOM 874 CG ASN A 54 22.314 -12.911 2.992 1.00 0.00 C ATOM 875 OD1 ASN A 54 22.364 -14.122 3.153 1.00 0.00 O ATOM 876 ND2 ASN A 54 22.925 -12.116 3.838 1.00 0.00 N ATOM 0 H ASN A 54 20.031 -11.607 0.049 1.00 0.00 H new ATOM 0 HA ASN A 54 20.086 -13.877 1.817 1.00 0.00 H new ATOM 0 HB2 ASN A 54 22.051 -12.511 0.901 1.00 0.00 H new ATOM 0 HB3 ASN A 54 21.549 -11.199 1.949 1.00 0.00 H new ATOM 0 HD21 ASN A 54 23.439 -12.509 4.626 1.00 0.00 H new ATOM 0 HD22 ASN A 54 22.886 -11.105 3.707 1.00 0.00 H new ATOM 883 N ASP A 55 18.813 -13.172 3.864 1.00 0.00 N ATOM 884 CA ASP A 55 17.915 -12.827 4.983 1.00 0.00 C ATOM 885 C ASP A 55 18.451 -11.697 5.883 1.00 0.00 C ATOM 886 O ASP A 55 17.705 -10.801 6.278 1.00 0.00 O ATOM 887 CB ASP A 55 17.558 -14.078 5.808 1.00 0.00 C ATOM 888 CG ASP A 55 18.672 -14.535 6.770 1.00 0.00 C ATOM 889 OD1 ASP A 55 19.578 -15.279 6.328 1.00 0.00 O ATOM 890 OD2 ASP A 55 18.639 -14.153 7.967 1.00 0.00 O ATOM 0 H ASP A 55 19.042 -14.165 3.821 1.00 0.00 H new ATOM 0 HA ASP A 55 17.005 -12.435 4.529 1.00 0.00 H new ATOM 0 HB2 ASP A 55 16.655 -13.875 6.384 1.00 0.00 H new ATOM 0 HB3 ASP A 55 17.323 -14.895 5.126 1.00 0.00 H new ATOM 895 N ASP A 56 19.752 -11.716 6.182 1.00 0.00 N ATOM 896 CA ASP A 56 20.398 -10.777 7.104 1.00 0.00 C ATOM 897 C ASP A 56 20.831 -9.453 6.436 1.00 0.00 C ATOM 898 O ASP A 56 21.202 -8.501 7.125 1.00 0.00 O ATOM 899 CB ASP A 56 21.590 -11.492 7.759 1.00 0.00 C ATOM 900 CG ASP A 56 21.901 -10.919 9.149 1.00 0.00 C ATOM 901 OD1 ASP A 56 21.059 -11.106 10.064 1.00 0.00 O ATOM 902 OD2 ASP A 56 22.992 -10.330 9.345 1.00 0.00 O ATOM 0 H ASP A 56 20.398 -12.397 5.783 1.00 0.00 H new ATOM 0 HA ASP A 56 19.668 -10.482 7.858 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.374 -12.557 7.844 1.00 0.00 H new ATOM 0 HB3 ASP A 56 22.468 -11.395 7.121 1.00 0.00 H new ATOM 907 N THR A 57 20.772 -9.372 5.102 1.00 0.00 N ATOM 908 CA THR A 57 21.098 -8.175 4.309 1.00 0.00 C ATOM 909 C THR A 57 19.883 -7.240 4.202 1.00 0.00 C ATOM 910 O THR A 57 18.728 -7.680 4.214 1.00 0.00 O ATOM 911 CB THR A 57 21.641 -8.597 2.928 1.00 0.00 C ATOM 912 OG1 THR A 57 22.837 -9.326 3.127 1.00 0.00 O ATOM 913 CG2 THR A 57 22.019 -7.444 2.009 1.00 0.00 C ATOM 0 H THR A 57 20.487 -10.162 4.523 1.00 0.00 H new ATOM 0 HA THR A 57 21.880 -7.608 4.814 1.00 0.00 H new ATOM 0 HB THR A 57 20.834 -9.158 2.458 1.00 0.00 H new ATOM 0 HG1 THR A 57 23.198 -9.605 2.260 1.00 0.00 H new ATOM 0 HG21 THR A 57 22.390 -7.839 1.063 1.00 0.00 H new ATOM 0 HG22 THR A 57 21.142 -6.823 1.824 1.00 0.00 H new ATOM 0 HG23 THR A 57 22.796 -6.843 2.481 1.00 0.00 H new ATOM 921 N ALA A 58 20.130 -5.927 4.137 1.00 0.00 N ATOM 922 CA ALA A 58 19.073 -4.918 4.092 1.00 0.00 C ATOM 923 C ALA A 58 18.347 -4.837 2.735 1.00 0.00 C ATOM 924 O ALA A 58 18.898 -5.198 1.696 1.00 0.00 O ATOM 925 CB ALA A 58 19.644 -3.572 4.528 1.00 0.00 C ATOM 0 H ALA A 58 21.072 -5.536 4.114 1.00 0.00 H new ATOM 0 HA ALA A 58 18.295 -5.222 4.793 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.859 -2.816 4.496 1.00 0.00 H new ATOM 0 HB2 ALA A 58 20.029 -3.652 5.544 1.00 0.00 H new ATOM 0 HB3 ALA A 58 20.452 -3.285 3.855 1.00 0.00 H new ATOM 931 N LEU A 59 17.113 -4.323 2.728 1.00 0.00 N ATOM 932 CA LEU A 59 16.276 -4.232 1.519 1.00 0.00 C ATOM 933 C LEU A 59 16.842 -3.267 0.460 1.00 0.00 C ATOM 934 O LEU A 59 16.789 -3.550 -0.741 1.00 0.00 O ATOM 935 CB LEU A 59 14.845 -3.838 1.940 1.00 0.00 C ATOM 936 CG LEU A 59 14.122 -4.946 2.727 1.00 0.00 C ATOM 937 CD1 LEU A 59 12.810 -4.432 3.304 1.00 0.00 C ATOM 938 CD2 LEU A 59 13.768 -6.137 1.839 1.00 0.00 C ATOM 0 H LEU A 59 16.660 -3.955 3.565 1.00 0.00 H new ATOM 0 HA LEU A 59 16.266 -5.209 1.035 1.00 0.00 H new ATOM 0 HB2 LEU A 59 14.887 -2.936 2.550 1.00 0.00 H new ATOM 0 HB3 LEU A 59 14.265 -3.594 1.050 1.00 0.00 H new ATOM 0 HG LEU A 59 14.810 -5.252 3.515 1.00 0.00 H new ATOM 0 HD11 LEU A 59 12.317 -5.232 3.856 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.010 -3.598 3.976 1.00 0.00 H new ATOM 0 HD13 LEU A 59 12.162 -4.098 2.494 1.00 0.00 H new ATOM 0 HD21 LEU A 59 13.259 -6.896 2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 59 13.112 -5.808 1.033 1.00 0.00 H new ATOM 0 HD23 LEU A 59 14.680 -6.559 1.416 1.00 0.00 H new ATOM 950 N LYS A 60 17.439 -2.153 0.899 1.00 0.00 N ATOM 951 CA LYS A 60 18.057 -1.121 0.041 1.00 0.00 C ATOM 952 C LYS A 60 19.277 -1.614 -0.751 1.00 0.00 C ATOM 953 O LYS A 60 19.590 -1.040 -1.793 1.00 0.00 O ATOM 954 CB LYS A 60 18.404 0.110 0.899 1.00 0.00 C ATOM 955 CG LYS A 60 17.121 0.819 1.373 1.00 0.00 C ATOM 956 CD LYS A 60 17.347 1.793 2.536 1.00 0.00 C ATOM 957 CE LYS A 60 18.008 3.099 2.083 1.00 0.00 C ATOM 958 NZ LYS A 60 18.160 4.037 3.223 1.00 0.00 N ATOM 0 H LYS A 60 17.511 -1.933 1.892 1.00 0.00 H new ATOM 0 HA LYS A 60 17.323 -0.852 -0.718 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.997 -0.196 1.761 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.016 0.802 0.321 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.687 1.363 0.534 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.392 0.067 1.677 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.391 2.018 3.009 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.972 1.315 3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.985 2.886 1.649 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.407 3.564 1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.215 5.012 2.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.342 3.947 3.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.030 3.810 3.745 1.00 0.00 H new ATOM 972 N GLU A 61 19.909 -2.717 -0.341 1.00 0.00 N ATOM 973 CA GLU A 61 21.002 -3.376 -1.080 1.00 0.00 C ATOM 974 C GLU A 61 20.558 -3.972 -2.427 1.00 0.00 C ATOM 975 O GLU A 61 21.389 -4.204 -3.309 1.00 0.00 O ATOM 976 CB GLU A 61 21.593 -4.502 -0.218 1.00 0.00 C ATOM 977 CG GLU A 61 22.262 -3.978 1.064 1.00 0.00 C ATOM 978 CD GLU A 61 23.489 -3.092 0.769 1.00 0.00 C ATOM 979 OE1 GLU A 61 24.585 -3.637 0.491 1.00 0.00 O ATOM 980 OE2 GLU A 61 23.370 -1.844 0.819 1.00 0.00 O ATOM 0 H GLU A 61 19.674 -3.191 0.531 1.00 0.00 H new ATOM 0 HA GLU A 61 21.741 -2.604 -1.294 1.00 0.00 H new ATOM 0 HB2 GLU A 61 20.802 -5.202 0.050 1.00 0.00 H new ATOM 0 HB3 GLU A 61 22.325 -5.057 -0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 61 21.536 -3.407 1.642 1.00 0.00 H new ATOM 0 HG3 GLU A 61 22.568 -4.822 1.682 1.00 0.00 H new ATOM 987 N TYR A 62 19.251 -4.182 -2.602 1.00 0.00 N ATOM 988 CA TYR A 62 18.630 -4.783 -3.786 1.00 0.00 C ATOM 989 C TYR A 62 17.757 -3.784 -4.563 1.00 0.00 C ATOM 990 O TYR A 62 17.168 -4.136 -5.585 1.00 0.00 O ATOM 991 CB TYR A 62 17.851 -6.023 -3.333 1.00 0.00 C ATOM 992 CG TYR A 62 18.725 -7.064 -2.657 1.00 0.00 C ATOM 993 CD1 TYR A 62 19.597 -7.849 -3.438 1.00 0.00 C ATOM 994 CD2 TYR A 62 18.659 -7.261 -1.262 1.00 0.00 C ATOM 995 CE1 TYR A 62 20.378 -8.853 -2.834 1.00 0.00 C ATOM 996 CE2 TYR A 62 19.436 -8.267 -0.655 1.00 0.00 C ATOM 997 CZ TYR A 62 20.293 -9.070 -1.440 1.00 0.00 C ATOM 998 OH TYR A 62 21.019 -10.060 -0.853 1.00 0.00 O ATOM 0 H TYR A 62 18.566 -3.927 -1.891 1.00 0.00 H new ATOM 0 HA TYR A 62 19.403 -5.080 -4.495 1.00 0.00 H new ATOM 0 HB2 TYR A 62 17.063 -5.718 -2.645 1.00 0.00 H new ATOM 0 HB3 TYR A 62 17.363 -6.473 -4.197 1.00 0.00 H new ATOM 0 HD1 TYR A 62 19.666 -7.680 -4.502 1.00 0.00 H new ATOM 0 HD2 TYR A 62 18.013 -6.640 -0.659 1.00 0.00 H new ATOM 0 HE1 TYR A 62 21.041 -9.457 -3.435 1.00 0.00 H new ATOM 0 HE2 TYR A 62 19.376 -8.425 0.412 1.00 0.00 H new ATOM 0 HH TYR A 62 21.022 -9.931 0.118 1.00 0.00 H new ATOM 1008 N LYS A 63 17.704 -2.527 -4.093 1.00 0.00 N ATOM 1009 CA LYS A 63 16.994 -1.372 -4.669 1.00 0.00 C ATOM 1010 C LYS A 63 15.537 -1.670 -5.079 1.00 0.00 C ATOM 1011 O LYS A 63 15.047 -1.153 -6.087 1.00 0.00 O ATOM 1012 CB LYS A 63 17.838 -0.752 -5.804 1.00 0.00 C ATOM 1013 CG LYS A 63 19.245 -0.325 -5.350 1.00 0.00 C ATOM 1014 CD LYS A 63 20.013 0.347 -6.496 1.00 0.00 C ATOM 1015 CE LYS A 63 21.417 0.750 -6.029 1.00 0.00 C ATOM 1016 NZ LYS A 63 22.201 1.372 -7.128 1.00 0.00 N ATOM 0 H LYS A 63 18.193 -2.272 -3.235 1.00 0.00 H new ATOM 0 HA LYS A 63 16.885 -0.627 -3.880 1.00 0.00 H new ATOM 0 HB2 LYS A 63 17.929 -1.473 -6.616 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.314 0.115 -6.205 1.00 0.00 H new ATOM 0 HG2 LYS A 63 19.166 0.363 -4.508 1.00 0.00 H new ATOM 0 HG3 LYS A 63 19.798 -1.196 -4.999 1.00 0.00 H new ATOM 0 HD2 LYS A 63 20.086 -0.335 -7.343 1.00 0.00 H new ATOM 0 HD3 LYS A 63 19.470 1.227 -6.840 1.00 0.00 H new ATOM 0 HE2 LYS A 63 21.338 1.449 -5.197 1.00 0.00 H new ATOM 0 HE3 LYS A 63 21.944 -0.129 -5.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 23.145 1.632 -6.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 22.297 0.695 -7.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 21.710 2.225 -7.465 1.00 0.00 H new ATOM 1030 N ILE A 64 14.844 -2.502 -4.293 1.00 0.00 N ATOM 1031 CA ILE A 64 13.422 -2.837 -4.472 1.00 0.00 C ATOM 1032 C ILE A 64 12.588 -1.544 -4.451 1.00 0.00 C ATOM 1033 O ILE A 64 12.817 -0.661 -3.623 1.00 0.00 O ATOM 1034 CB ILE A 64 12.922 -3.855 -3.417 1.00 0.00 C ATOM 1035 CG1 ILE A 64 13.899 -5.038 -3.209 1.00 0.00 C ATOM 1036 CG2 ILE A 64 11.539 -4.397 -3.835 1.00 0.00 C ATOM 1037 CD1 ILE A 64 13.482 -5.955 -2.056 1.00 0.00 C ATOM 0 H ILE A 64 15.266 -2.974 -3.493 1.00 0.00 H new ATOM 0 HA ILE A 64 13.302 -3.324 -5.440 1.00 0.00 H new ATOM 0 HB ILE A 64 12.855 -3.323 -2.468 1.00 0.00 H new ATOM 0 HG12 ILE A 64 13.958 -5.621 -4.128 1.00 0.00 H new ATOM 0 HG13 ILE A 64 14.898 -4.648 -3.014 1.00 0.00 H new ATOM 0 HG21 ILE A 64 11.189 -5.113 -3.091 1.00 0.00 H new ATOM 0 HG22 ILE A 64 10.831 -3.571 -3.905 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.619 -4.890 -4.804 1.00 0.00 H new ATOM 0 HD11 ILE A 64 14.203 -6.766 -1.957 1.00 0.00 H new ATOM 0 HD12 ILE A 64 13.450 -5.382 -1.129 1.00 0.00 H new ATOM 0 HD13 ILE A 64 12.495 -6.370 -2.260 1.00 0.00 H new ATOM 1049 N ASP A 65 11.633 -1.430 -5.371 1.00 0.00 N ATOM 1050 CA ASP A 65 10.767 -0.257 -5.549 1.00 0.00 C ATOM 1051 C ASP A 65 9.294 -0.601 -5.269 1.00 0.00 C ATOM 1052 O ASP A 65 8.884 -1.761 -5.348 1.00 0.00 O ATOM 1053 CB ASP A 65 10.961 0.291 -6.970 1.00 0.00 C ATOM 1054 CG ASP A 65 10.256 1.640 -7.169 1.00 0.00 C ATOM 1055 OD1 ASP A 65 10.840 2.690 -6.811 1.00 0.00 O ATOM 1056 OD2 ASP A 65 9.101 1.639 -7.652 1.00 0.00 O ATOM 0 H ASP A 65 11.430 -2.175 -6.038 1.00 0.00 H new ATOM 0 HA ASP A 65 11.046 0.512 -4.829 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.026 0.406 -7.172 1.00 0.00 H new ATOM 0 HB3 ASP A 65 10.576 -0.429 -7.692 1.00 0.00 H new ATOM 1061 N GLU A 66 8.484 0.408 -4.947 1.00 0.00 N ATOM 1062 CA GLU A 66 7.068 0.233 -4.598 1.00 0.00 C ATOM 1063 C GLU A 66 6.164 -0.066 -5.815 1.00 0.00 C ATOM 1064 O GLU A 66 5.086 -0.642 -5.649 1.00 0.00 O ATOM 1065 CB GLU A 66 6.540 1.485 -3.876 1.00 0.00 C ATOM 1066 CG GLU A 66 7.309 1.797 -2.585 1.00 0.00 C ATOM 1067 CD GLU A 66 6.646 2.930 -1.780 1.00 0.00 C ATOM 1068 OE1 GLU A 66 6.569 4.080 -2.276 1.00 0.00 O ATOM 1069 OE2 GLU A 66 6.220 2.674 -0.628 1.00 0.00 O ATOM 0 H GLU A 66 8.792 1.380 -4.920 1.00 0.00 H new ATOM 0 HA GLU A 66 7.026 -0.638 -3.943 1.00 0.00 H new ATOM 0 HB2 GLU A 66 6.605 2.341 -4.548 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.485 1.345 -3.640 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.364 0.899 -1.970 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.333 2.078 -2.831 1.00 0.00 H new ATOM 1076 N LYS A 67 6.570 0.323 -7.037 1.00 0.00 N ATOM 1077 CA LYS A 67 5.818 0.088 -8.288 1.00 0.00 C ATOM 1078 C LYS A 67 6.106 -1.281 -8.917 1.00 0.00 C ATOM 1079 O LYS A 67 5.206 -1.887 -9.504 1.00 0.00 O ATOM 1080 CB LYS A 67 6.125 1.197 -9.312 1.00 0.00 C ATOM 1081 CG LYS A 67 5.844 2.629 -8.822 1.00 0.00 C ATOM 1082 CD LYS A 67 4.362 2.884 -8.510 1.00 0.00 C ATOM 1083 CE LYS A 67 4.177 4.343 -8.079 1.00 0.00 C ATOM 1084 NZ LYS A 67 2.750 4.661 -7.816 1.00 0.00 N ATOM 0 H LYS A 67 7.448 0.820 -7.188 1.00 0.00 H new ATOM 0 HA LYS A 67 4.762 0.104 -8.018 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.174 1.126 -9.598 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.536 1.014 -10.211 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.435 2.822 -7.927 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.175 3.337 -9.581 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.752 2.673 -9.388 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.025 2.214 -7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.764 4.534 -7.181 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.560 5.004 -8.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.664 5.656 -7.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.194 4.502 -8.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.392 4.048 -7.056 1.00 0.00 H new ATOM 1098 N ASN A 68 7.344 -1.767 -8.804 1.00 0.00 N ATOM 1099 CA ASN A 68 7.742 -3.124 -9.203 1.00 0.00 C ATOM 1100 C ASN A 68 7.309 -4.168 -8.147 1.00 0.00 C ATOM 1101 O ASN A 68 6.826 -3.805 -7.073 1.00 0.00 O ATOM 1102 CB ASN A 68 9.263 -3.144 -9.456 1.00 0.00 C ATOM 1103 CG ASN A 68 9.680 -2.247 -10.616 1.00 0.00 C ATOM 1104 OD1 ASN A 68 9.028 -2.167 -11.649 1.00 0.00 O ATOM 1105 ND2 ASN A 68 10.780 -1.539 -10.492 1.00 0.00 N ATOM 0 H ASN A 68 8.116 -1.219 -8.425 1.00 0.00 H new ATOM 0 HA ASN A 68 7.233 -3.399 -10.127 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.781 -2.826 -8.552 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.579 -4.167 -9.661 1.00 0.00 H new ATOM 0 HD21 ASN A 68 11.083 -0.930 -11.252 1.00 0.00 H new ATOM 0 HD22 ASN A 68 11.331 -1.598 -9.636 1.00 0.00 H new ATOM 1112 N PHE A 69 7.497 -5.465 -8.427 1.00 0.00 N ATOM 1113 CA PHE A 69 7.169 -6.560 -7.501 1.00 0.00 C ATOM 1114 C PHE A 69 8.354 -7.499 -7.223 1.00 0.00 C ATOM 1115 O PHE A 69 9.235 -7.696 -8.064 1.00 0.00 O ATOM 1116 CB PHE A 69 5.939 -7.338 -8.003 1.00 0.00 C ATOM 1117 CG PHE A 69 6.134 -8.157 -9.270 1.00 0.00 C ATOM 1118 CD1 PHE A 69 6.617 -9.479 -9.196 1.00 0.00 C ATOM 1119 CD2 PHE A 69 5.799 -7.613 -10.525 1.00 0.00 C ATOM 1120 CE1 PHE A 69 6.773 -10.247 -10.364 1.00 0.00 C ATOM 1121 CE2 PHE A 69 5.946 -8.383 -11.694 1.00 0.00 C ATOM 1122 CZ PHE A 69 6.433 -9.701 -11.614 1.00 0.00 C ATOM 0 H PHE A 69 7.886 -5.788 -9.313 1.00 0.00 H new ATOM 0 HA PHE A 69 6.928 -6.100 -6.543 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.610 -8.008 -7.209 1.00 0.00 H new ATOM 0 HB3 PHE A 69 5.131 -6.627 -8.175 1.00 0.00 H new ATOM 0 HD1 PHE A 69 6.869 -9.905 -8.236 1.00 0.00 H new ATOM 0 HD2 PHE A 69 5.428 -6.601 -10.591 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.154 -11.256 -10.301 1.00 0.00 H new ATOM 0 HE2 PHE A 69 5.685 -7.962 -12.654 1.00 0.00 H new ATOM 0 HZ PHE A 69 6.545 -10.292 -12.511 1.00 0.00 H new ATOM 1132 N VAL A 70 8.333 -8.112 -6.040 1.00 0.00 N ATOM 1133 CA VAL A 70 9.209 -9.207 -5.593 1.00 0.00 C ATOM 1134 C VAL A 70 8.445 -10.536 -5.690 1.00 0.00 C ATOM 1135 O VAL A 70 7.210 -10.538 -5.709 1.00 0.00 O ATOM 1136 CB VAL A 70 9.706 -8.901 -4.155 1.00 0.00 C ATOM 1137 CG1 VAL A 70 9.130 -9.804 -3.066 1.00 0.00 C ATOM 1138 CG2 VAL A 70 11.232 -8.966 -4.065 1.00 0.00 C ATOM 0 H VAL A 70 7.663 -7.844 -5.319 1.00 0.00 H new ATOM 0 HA VAL A 70 10.089 -9.293 -6.231 1.00 0.00 H new ATOM 0 HB VAL A 70 9.341 -7.891 -3.967 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.537 -9.512 -2.098 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.045 -9.705 -3.048 1.00 0.00 H new ATOM 0 HG13 VAL A 70 9.397 -10.840 -3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 70 11.546 -8.747 -3.045 1.00 0.00 H new ATOM 0 HG22 VAL A 70 11.571 -9.964 -4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 70 11.668 -8.233 -4.744 1.00 0.00 H new ATOM 1148 N VAL A 71 9.144 -11.672 -5.677 1.00 0.00 N ATOM 1149 CA VAL A 71 8.503 -12.995 -5.558 1.00 0.00 C ATOM 1150 C VAL A 71 8.699 -13.569 -4.158 1.00 0.00 C ATOM 1151 O VAL A 71 9.821 -13.659 -3.653 1.00 0.00 O ATOM 1152 CB VAL A 71 8.965 -13.981 -6.641 1.00 0.00 C ATOM 1153 CG1 VAL A 71 8.239 -15.328 -6.501 1.00 0.00 C ATOM 1154 CG2 VAL A 71 8.631 -13.445 -8.036 1.00 0.00 C ATOM 0 H VAL A 71 10.161 -11.708 -5.748 1.00 0.00 H new ATOM 0 HA VAL A 71 7.436 -12.845 -5.721 1.00 0.00 H new ATOM 0 HB VAL A 71 10.041 -14.106 -6.517 1.00 0.00 H new ATOM 0 HG11 VAL A 71 8.583 -16.009 -7.279 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.454 -15.757 -5.522 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.165 -15.175 -6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.966 -14.158 -8.789 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.554 -13.304 -8.123 1.00 0.00 H new ATOM 0 HG23 VAL A 71 9.135 -12.491 -8.189 1.00 0.00 H new ATOM 1164 N VAL A 72 7.585 -13.979 -3.550 1.00 0.00 N ATOM 1165 CA VAL A 72 7.522 -14.735 -2.294 1.00 0.00 C ATOM 1166 C VAL A 72 7.109 -16.184 -2.579 1.00 0.00 C ATOM 1167 O VAL A 72 6.176 -16.447 -3.343 1.00 0.00 O ATOM 1168 CB VAL A 72 6.599 -14.046 -1.267 1.00 0.00 C ATOM 1169 CG1 VAL A 72 5.159 -13.849 -1.761 1.00 0.00 C ATOM 1170 CG2 VAL A 72 6.579 -14.805 0.069 1.00 0.00 C ATOM 0 H VAL A 72 6.660 -13.786 -3.935 1.00 0.00 H new ATOM 0 HA VAL A 72 8.513 -14.755 -1.841 1.00 0.00 H new ATOM 0 HB VAL A 72 7.030 -13.055 -1.123 1.00 0.00 H new ATOM 0 HG11 VAL A 72 4.572 -13.359 -0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.164 -13.229 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.718 -14.819 -1.992 1.00 0.00 H new ATOM 0 HG21 VAL A 72 5.919 -14.292 0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.216 -15.820 -0.094 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.587 -14.842 0.482 1.00 0.00 H new ATOM 1180 N MET A 73 7.801 -17.136 -1.958 1.00 0.00 N ATOM 1181 CA MET A 73 7.431 -18.556 -1.928 1.00 0.00 C ATOM 1182 C MET A 73 7.632 -19.136 -0.531 1.00 0.00 C ATOM 1183 O MET A 73 8.250 -18.496 0.318 1.00 0.00 O ATOM 1184 CB MET A 73 8.183 -19.347 -3.003 1.00 0.00 C ATOM 1185 CG MET A 73 9.695 -19.440 -2.808 1.00 0.00 C ATOM 1186 SD MET A 73 10.535 -20.441 -4.066 1.00 0.00 S ATOM 1187 CE MET A 73 10.035 -22.117 -3.569 1.00 0.00 C ATOM 0 H MET A 73 8.661 -16.939 -1.446 1.00 0.00 H new ATOM 0 HA MET A 73 6.370 -18.642 -2.163 1.00 0.00 H new ATOM 0 HB2 MET A 73 7.775 -20.357 -3.039 1.00 0.00 H new ATOM 0 HB3 MET A 73 7.986 -18.889 -3.972 1.00 0.00 H new ATOM 0 HG2 MET A 73 10.116 -18.434 -2.817 1.00 0.00 H new ATOM 0 HG3 MET A 73 9.900 -19.863 -1.824 1.00 0.00 H new ATOM 0 HE1 MET A 73 10.291 -22.823 -4.359 1.00 0.00 H new ATOM 0 HE2 MET A 73 10.555 -22.395 -2.652 1.00 0.00 H new ATOM 0 HE3 MET A 73 8.959 -22.140 -3.397 1.00 0.00 H new ATOM 1197 N VAL A 74 7.128 -20.347 -0.293 1.00 0.00 N ATOM 1198 CA VAL A 74 7.260 -21.063 0.980 1.00 0.00 C ATOM 1199 C VAL A 74 7.667 -22.523 0.734 1.00 0.00 C ATOM 1200 O VAL A 74 6.927 -23.290 0.115 1.00 0.00 O ATOM 1201 CB VAL A 74 5.990 -20.896 1.844 1.00 0.00 C ATOM 1202 CG1 VAL A 74 4.676 -21.319 1.173 1.00 0.00 C ATOM 1203 CG2 VAL A 74 6.118 -21.621 3.188 1.00 0.00 C ATOM 0 H VAL A 74 6.605 -20.871 -0.994 1.00 0.00 H new ATOM 0 HA VAL A 74 8.067 -20.621 1.565 1.00 0.00 H new ATOM 0 HB VAL A 74 5.928 -19.818 1.994 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.848 -21.162 1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 74 4.518 -20.722 0.275 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.728 -22.374 0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.205 -21.480 3.766 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.276 -22.685 3.014 1.00 0.00 H new ATOM 0 HG23 VAL A 74 6.964 -21.215 3.742 1.00 0.00 H new ATOM 1872 N GLU B 283 12.042 -28.733 -5.494 1.00 0.00 N ATOM 1873 CA GLU B 283 12.156 -27.446 -4.782 1.00 0.00 C ATOM 1874 C GLU B 283 13.048 -26.431 -5.523 1.00 0.00 C ATOM 1875 O GLU B 283 12.721 -25.248 -5.600 1.00 0.00 O ATOM 1876 CB GLU B 283 12.660 -27.708 -3.356 1.00 0.00 C ATOM 1877 CG GLU B 283 12.584 -26.466 -2.463 1.00 0.00 C ATOM 1878 CD GLU B 283 12.939 -26.832 -1.012 1.00 0.00 C ATOM 1879 OE1 GLU B 283 12.045 -27.315 -0.275 1.00 0.00 O ATOM 1880 OE2 GLU B 283 14.113 -26.651 -0.603 1.00 0.00 O ATOM 0 HA GLU B 283 11.168 -26.988 -4.741 1.00 0.00 H new ATOM 0 HB2 GLU B 283 12.071 -28.508 -2.908 1.00 0.00 H new ATOM 0 HB3 GLU B 283 13.692 -28.057 -3.398 1.00 0.00 H new ATOM 0 HG2 GLU B 283 13.269 -25.702 -2.831 1.00 0.00 H new ATOM 0 HG3 GLU B 283 11.581 -26.041 -2.503 1.00 0.00 H new ATOM 1887 N GLU B 284 14.136 -26.897 -6.143 1.00 0.00 N ATOM 1888 CA GLU B 284 15.005 -26.074 -6.996 1.00 0.00 C ATOM 1889 C GLU B 284 14.301 -25.574 -8.273 1.00 0.00 C ATOM 1890 O GLU B 284 14.607 -24.486 -8.757 1.00 0.00 O ATOM 1891 CB GLU B 284 16.272 -26.858 -7.373 1.00 0.00 C ATOM 1892 CG GLU B 284 17.139 -27.184 -6.149 1.00 0.00 C ATOM 1893 CD GLU B 284 18.465 -27.843 -6.573 1.00 0.00 C ATOM 1894 OE1 GLU B 284 18.513 -29.090 -6.714 1.00 0.00 O ATOM 1895 OE2 GLU B 284 19.476 -27.121 -6.762 1.00 0.00 O ATOM 0 H GLU B 284 14.443 -27.867 -6.067 1.00 0.00 H new ATOM 0 HA GLU B 284 15.269 -25.192 -6.413 1.00 0.00 H new ATOM 0 HB2 GLU B 284 15.989 -27.785 -7.872 1.00 0.00 H new ATOM 0 HB3 GLU B 284 16.857 -26.278 -8.086 1.00 0.00 H new ATOM 0 HG2 GLU B 284 17.345 -26.271 -5.591 1.00 0.00 H new ATOM 0 HG3 GLU B 284 16.595 -27.851 -5.480 1.00 0.00 H new ATOM 1902 N GLU B 285 13.329 -26.322 -8.808 1.00 0.00 N ATOM 1903 CA GLU B 285 12.504 -25.896 -9.948 1.00 0.00 C ATOM 1904 C GLU B 285 11.406 -24.903 -9.523 1.00 0.00 C ATOM 1905 O GLU B 285 11.156 -23.933 -10.241 1.00 0.00 O ATOM 1906 CB GLU B 285 11.891 -27.119 -10.650 1.00 0.00 C ATOM 1907 CG GLU B 285 12.914 -27.994 -11.389 1.00 0.00 C ATOM 1908 CD GLU B 285 13.577 -27.258 -12.571 1.00 0.00 C ATOM 1909 OE1 GLU B 285 12.882 -26.952 -13.570 1.00 0.00 O ATOM 1910 OE2 GLU B 285 14.803 -26.994 -12.519 1.00 0.00 O ATOM 0 H GLU B 285 13.089 -27.250 -8.459 1.00 0.00 H new ATOM 0 HA GLU B 285 13.155 -25.376 -10.651 1.00 0.00 H new ATOM 0 HB2 GLU B 285 11.375 -27.729 -9.909 1.00 0.00 H new ATOM 0 HB3 GLU B 285 11.139 -26.777 -11.362 1.00 0.00 H new ATOM 0 HG2 GLU B 285 13.684 -28.317 -10.689 1.00 0.00 H new ATOM 0 HG3 GLU B 285 12.420 -28.893 -11.756 1.00 0.00 H new ATOM 1917 N GLN B 286 10.806 -25.075 -8.336 1.00 0.00 N ATOM 1918 CA GLN B 286 9.896 -24.085 -7.732 1.00 0.00 C ATOM 1919 C GLN B 286 10.624 -22.740 -7.535 1.00 0.00 C ATOM 1920 O GLN B 286 10.109 -21.682 -7.907 1.00 0.00 O ATOM 1921 CB GLN B 286 9.356 -24.592 -6.382 1.00 0.00 C ATOM 1922 CG GLN B 286 8.490 -25.859 -6.467 1.00 0.00 C ATOM 1923 CD GLN B 286 8.120 -26.390 -5.081 1.00 0.00 C ATOM 1924 OE1 GLN B 286 7.732 -25.657 -4.182 1.00 0.00 O ATOM 1925 NE2 GLN B 286 8.223 -27.679 -4.838 1.00 0.00 N ATOM 0 H GLN B 286 10.938 -25.909 -7.763 1.00 0.00 H new ATOM 0 HA GLN B 286 9.055 -23.939 -8.409 1.00 0.00 H new ATOM 0 HB2 GLN B 286 10.200 -24.790 -5.721 1.00 0.00 H new ATOM 0 HB3 GLN B 286 8.769 -23.798 -5.921 1.00 0.00 H new ATOM 0 HG2 GLN B 286 7.581 -25.640 -7.027 1.00 0.00 H new ATOM 0 HG3 GLN B 286 9.027 -26.630 -7.020 1.00 0.00 H new ATOM 0 HE21 GLN B 286 8.544 -28.312 -5.571 1.00 0.00 H new ATOM 0 HE22 GLN B 286 7.982 -28.045 -3.917 1.00 0.00 H new ATOM 1934 N ILE B 287 11.855 -22.788 -7.008 1.00 0.00 N ATOM 1935 CA ILE B 287 12.787 -21.655 -6.925 1.00 0.00 C ATOM 1936 C ILE B 287 13.081 -21.066 -8.315 1.00 0.00 C ATOM 1937 O ILE B 287 12.927 -19.861 -8.500 1.00 0.00 O ATOM 1938 CB ILE B 287 14.060 -22.067 -6.141 1.00 0.00 C ATOM 1939 CG1 ILE B 287 13.728 -22.121 -4.628 1.00 0.00 C ATOM 1940 CG2 ILE B 287 15.231 -21.105 -6.402 1.00 0.00 C ATOM 1941 CD1 ILE B 287 14.802 -22.756 -3.733 1.00 0.00 C ATOM 0 H ILE B 287 12.243 -23.646 -6.614 1.00 0.00 H new ATOM 0 HA ILE B 287 12.320 -20.847 -6.363 1.00 0.00 H new ATOM 0 HB ILE B 287 14.375 -23.052 -6.487 1.00 0.00 H new ATOM 0 HG12 ILE B 287 13.544 -21.105 -4.279 1.00 0.00 H new ATOM 0 HG13 ILE B 287 12.799 -22.676 -4.498 1.00 0.00 H new ATOM 0 HG21 ILE B 287 16.103 -21.430 -5.834 1.00 0.00 H new ATOM 0 HG22 ILE B 287 15.471 -21.104 -7.465 1.00 0.00 H new ATOM 0 HG23 ILE B 287 14.951 -20.098 -6.092 1.00 0.00 H new ATOM 0 HD11 ILE B 287 14.466 -22.742 -2.696 1.00 0.00 H new ATOM 0 HD12 ILE B 287 14.973 -23.786 -4.045 1.00 0.00 H new ATOM 0 HD13 ILE B 287 15.730 -22.191 -3.822 1.00 0.00 H new ATOM 1953 N ALA B 288 13.472 -21.866 -9.312 1.00 0.00 N ATOM 1954 CA ALA B 288 13.768 -21.357 -10.657 1.00 0.00 C ATOM 1955 C ALA B 288 12.560 -20.671 -11.338 1.00 0.00 C ATOM 1956 O ALA B 288 12.738 -19.678 -12.048 1.00 0.00 O ATOM 1957 CB ALA B 288 14.325 -22.499 -11.513 1.00 0.00 C ATOM 0 H ALA B 288 13.592 -22.874 -9.213 1.00 0.00 H new ATOM 0 HA ALA B 288 14.517 -20.572 -10.557 1.00 0.00 H new ATOM 0 HB1 ALA B 288 14.547 -22.129 -12.514 1.00 0.00 H new ATOM 0 HB2 ALA B 288 15.237 -22.884 -11.057 1.00 0.00 H new ATOM 0 HB3 ALA B 288 13.587 -23.299 -11.578 1.00 0.00 H new ATOM 1963 N TYR B 289 11.331 -21.138 -11.085 1.00 0.00 N ATOM 1964 CA TYR B 289 10.103 -20.453 -11.503 1.00 0.00 C ATOM 1965 C TYR B 289 9.980 -19.058 -10.855 1.00 0.00 C ATOM 1966 O TYR B 289 9.749 -18.069 -11.555 1.00 0.00 O ATOM 1967 CB TYR B 289 8.879 -21.341 -11.216 1.00 0.00 C ATOM 1968 CG TYR B 289 7.593 -20.819 -11.830 1.00 0.00 C ATOM 1969 CD1 TYR B 289 7.456 -20.781 -13.232 1.00 0.00 C ATOM 1970 CD2 TYR B 289 6.537 -20.370 -11.012 1.00 0.00 C ATOM 1971 CE1 TYR B 289 6.278 -20.278 -13.817 1.00 0.00 C ATOM 1972 CE2 TYR B 289 5.354 -19.872 -11.593 1.00 0.00 C ATOM 1973 CZ TYR B 289 5.225 -19.818 -12.997 1.00 0.00 C ATOM 1974 OH TYR B 289 4.086 -19.327 -13.560 1.00 0.00 O ATOM 0 H TYR B 289 11.160 -22.008 -10.581 1.00 0.00 H new ATOM 0 HA TYR B 289 10.149 -20.284 -12.579 1.00 0.00 H new ATOM 0 HB2 TYR B 289 9.072 -22.345 -11.595 1.00 0.00 H new ATOM 0 HB3 TYR B 289 8.748 -21.427 -10.137 1.00 0.00 H new ATOM 0 HD1 TYR B 289 8.258 -21.139 -13.861 1.00 0.00 H new ATOM 0 HD2 TYR B 289 6.635 -20.408 -9.937 1.00 0.00 H new ATOM 0 HE1 TYR B 289 6.180 -20.244 -14.892 1.00 0.00 H new ATOM 0 HE2 TYR B 289 4.545 -19.531 -10.963 1.00 0.00 H new ATOM 0 HH TYR B 289 3.932 -19.766 -14.422 1.00 0.00 H new ATOM 1984 N ALA B 290 10.215 -18.947 -9.540 1.00 0.00 N ATOM 1985 CA ALA B 290 10.304 -17.664 -8.837 1.00 0.00 C ATOM 1986 C ALA B 290 11.392 -16.728 -9.397 1.00 0.00 C ATOM 1987 O ALA B 290 11.135 -15.537 -9.589 1.00 0.00 O ATOM 1988 CB ALA B 290 10.520 -17.912 -7.340 1.00 0.00 C ATOM 0 H ALA B 290 10.350 -19.754 -8.931 1.00 0.00 H new ATOM 0 HA ALA B 290 9.358 -17.147 -8.998 1.00 0.00 H new ATOM 0 HB1 ALA B 290 10.586 -16.957 -6.819 1.00 0.00 H new ATOM 0 HB2 ALA B 290 9.683 -18.486 -6.942 1.00 0.00 H new ATOM 0 HB3 ALA B 290 11.445 -18.470 -7.193 1.00 0.00 H new ATOM 1994 N MET B 291 12.592 -17.247 -9.692 1.00 0.00 N ATOM 1995 CA MET B 291 13.677 -16.513 -10.333 1.00 0.00 C ATOM 1996 C MET B 291 13.209 -15.906 -11.659 1.00 0.00 C ATOM 1997 O MET B 291 13.237 -14.687 -11.790 1.00 0.00 O ATOM 1998 CB MET B 291 14.918 -17.405 -10.508 1.00 0.00 C ATOM 1999 CG MET B 291 15.528 -17.825 -9.164 1.00 0.00 C ATOM 2000 SD MET B 291 17.024 -18.839 -9.318 1.00 0.00 S ATOM 2001 CE MET B 291 17.678 -18.665 -7.635 1.00 0.00 C ATOM 0 H MET B 291 12.835 -18.215 -9.483 1.00 0.00 H new ATOM 0 HA MET B 291 13.969 -15.687 -9.684 1.00 0.00 H new ATOM 0 HB2 MET B 291 14.646 -18.295 -11.075 1.00 0.00 H new ATOM 0 HB3 MET B 291 15.667 -16.871 -11.093 1.00 0.00 H new ATOM 0 HG2 MET B 291 15.766 -16.930 -8.589 1.00 0.00 H new ATOM 0 HG3 MET B 291 14.782 -18.380 -8.596 1.00 0.00 H new ATOM 0 HE1 MET B 291 18.442 -19.423 -7.461 1.00 0.00 H new ATOM 0 HE2 MET B 291 18.116 -17.674 -7.516 1.00 0.00 H new ATOM 0 HE3 MET B 291 16.869 -18.793 -6.915 1.00 0.00 H new ATOM 2011 N GLN B 292 12.708 -16.708 -12.603 1.00 0.00 N ATOM 2012 CA GLN B 292 12.174 -16.221 -13.884 1.00 0.00 C ATOM 2013 C GLN B 292 11.102 -15.127 -13.706 1.00 0.00 C ATOM 2014 O GLN B 292 11.175 -14.083 -14.358 1.00 0.00 O ATOM 2015 CB GLN B 292 11.626 -17.420 -14.680 1.00 0.00 C ATOM 2016 CG GLN B 292 11.032 -17.047 -16.051 1.00 0.00 C ATOM 2017 CD GLN B 292 12.067 -16.486 -17.027 1.00 0.00 C ATOM 2018 OE1 GLN B 292 12.160 -15.290 -17.265 1.00 0.00 O ATOM 2019 NE2 GLN B 292 12.881 -17.321 -17.639 1.00 0.00 N ATOM 0 H GLN B 292 12.660 -17.722 -12.502 1.00 0.00 H new ATOM 0 HA GLN B 292 12.986 -15.749 -14.438 1.00 0.00 H new ATOM 0 HB2 GLN B 292 12.430 -18.141 -14.828 1.00 0.00 H new ATOM 0 HB3 GLN B 292 10.858 -17.916 -14.086 1.00 0.00 H new ATOM 0 HG2 GLN B 292 10.569 -17.930 -16.491 1.00 0.00 H new ATOM 0 HG3 GLN B 292 10.241 -16.311 -15.908 1.00 0.00 H new ATOM 0 HE21 GLN B 292 12.819 -18.322 -17.454 1.00 0.00 H new ATOM 0 HE22 GLN B 292 13.574 -16.967 -18.298 1.00 0.00 H new ATOM 2028 N MET B 293 10.119 -15.329 -12.820 1.00 0.00 N ATOM 2029 CA MET B 293 9.079 -14.323 -12.565 1.00 0.00 C ATOM 2030 C MET B 293 9.662 -12.996 -12.045 1.00 0.00 C ATOM 2031 O MET B 293 9.337 -11.930 -12.573 1.00 0.00 O ATOM 2032 CB MET B 293 8.024 -14.859 -11.586 1.00 0.00 C ATOM 2033 CG MET B 293 7.108 -15.913 -12.218 1.00 0.00 C ATOM 2034 SD MET B 293 5.634 -16.308 -11.232 1.00 0.00 S ATOM 2035 CE MET B 293 6.399 -16.927 -9.708 1.00 0.00 C ATOM 0 H MET B 293 10.021 -16.180 -12.267 1.00 0.00 H new ATOM 0 HA MET B 293 8.601 -14.117 -13.523 1.00 0.00 H new ATOM 0 HB2 MET B 293 8.525 -15.292 -10.720 1.00 0.00 H new ATOM 0 HB3 MET B 293 7.418 -14.029 -11.222 1.00 0.00 H new ATOM 0 HG2 MET B 293 6.791 -15.561 -13.200 1.00 0.00 H new ATOM 0 HG3 MET B 293 7.680 -16.827 -12.377 1.00 0.00 H new ATOM 0 HE1 MET B 293 5.624 -17.294 -9.035 1.00 0.00 H new ATOM 0 HE2 MET B 293 7.085 -17.739 -9.949 1.00 0.00 H new ATOM 0 HE3 MET B 293 6.948 -16.120 -9.223 1.00 0.00 H new ATOM 2045 N SER B 294 10.533 -13.040 -11.031 1.00 0.00 N ATOM 2046 CA SER B 294 11.165 -11.839 -10.460 1.00 0.00 C ATOM 2047 C SER B 294 12.147 -11.147 -11.415 1.00 0.00 C ATOM 2048 O SER B 294 12.238 -9.922 -11.422 1.00 0.00 O ATOM 2049 CB SER B 294 11.882 -12.172 -9.153 1.00 0.00 C ATOM 2050 OG SER B 294 13.105 -12.837 -9.398 1.00 0.00 O ATOM 0 H SER B 294 10.822 -13.908 -10.581 1.00 0.00 H new ATOM 0 HA SER B 294 10.349 -11.140 -10.275 1.00 0.00 H new ATOM 0 HB2 SER B 294 12.069 -11.255 -8.593 1.00 0.00 H new ATOM 0 HB3 SER B 294 11.241 -12.799 -8.533 1.00 0.00 H new ATOM 0 HG SER B 294 13.021 -13.390 -10.203 1.00 0.00 H new