USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 895 hydrogens (8 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 NoAdj-H: A 46 HIS HE2 : A 46 HIS NE2 : A 201 7BUZN :(H bumps) USER MOD Single : A 1 SER N :NH3+ -131:sc= 0.117 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0214 USER MOD Single : A 5 LYS NZ :NH3+ -170:sc= -0.029 (180deg=-0.229) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 9 THR OG1 : rot -74:sc= 1.93 USER MOD Single : A 15 GLN : amide:sc= -0.125 K(o=-0.13,f=-0.63) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -33:sc= -0.389 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 45 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.915) USER MOD Single : A 48 GLN : amide:sc= -1.53! C(o=-1.5!,f=-3.9!) USER MOD Single : A 52 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.5) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0815 USER MOD Single : A 63 LYS NZ :NH3+ -154:sc= 1.1 (180deg=0.299) USER MOD Single : A 64 GLN : amide:sc= -0.962 K(o=-0.96,f=-5.2!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.066 X(o=-0.066,f=-0.066) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 81 LYS NZ :NH3+ -169:sc= -0.0356 (180deg=-0.198) USER MOD Single : A 84 LYS NZ :NH3+ 143:sc= 2.25 (180deg=0.302) USER MOD Single : A 86 SER OG : rot -90:sc= 0.911 USER MOD Single : A 89 GLN : amide:sc= 0.29 K(o=0.29,f=-0.43) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 99 GLN : amide:sc= 0.264 X(o=0.26,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0736) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -166:sc=-0.000409 (180deg=-0.357) USER MOD Single : A 109 ASN : amide:sc= 0.343 K(o=0.34,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.092 -7.970 -4.316 1.00 0.00 N ATOM 2 CA SER A 1 1.060 -6.931 -4.303 1.00 0.00 C ATOM 3 C SER A 1 0.743 -6.472 -5.722 1.00 0.00 C ATOM 4 O SER A 1 1.401 -6.889 -6.675 1.00 0.00 O ATOM 5 CB SER A 1 1.539 -5.743 -3.460 1.00 0.00 C ATOM 6 OG SER A 1 2.817 -5.285 -3.899 1.00 0.00 O ATOM 0 H1 SER A 1 1.785 -8.772 -3.729 1.00 0.00 H new ATOM 0 H2 SER A 1 2.245 -8.295 -5.292 1.00 0.00 H new ATOM 0 H3 SER A 1 2.979 -7.583 -3.937 1.00 0.00 H new ATOM 0 HA SER A 1 0.151 -7.343 -3.865 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.815 -4.931 -3.526 1.00 0.00 H new ATOM 0 HB3 SER A 1 1.594 -6.036 -2.411 1.00 0.00 H new ATOM 0 HG SER A 1 3.100 -4.526 -3.347 1.00 0.00 H new ATOM 14 N GLU A 2 -0.299 -5.643 -5.847 1.00 0.00 N ATOM 15 CA GLU A 2 -0.712 -5.017 -7.117 1.00 0.00 C ATOM 16 C GLU A 2 -1.365 -6.002 -8.092 1.00 0.00 C ATOM 17 O GLU A 2 -1.931 -5.589 -9.106 1.00 0.00 O ATOM 18 CB GLU A 2 0.456 -4.276 -7.783 1.00 0.00 C ATOM 19 CG GLU A 2 1.157 -3.282 -6.862 1.00 0.00 C ATOM 20 CD GLU A 2 0.219 -2.236 -6.282 1.00 0.00 C ATOM 21 OE1 GLU A 2 -0.609 -2.584 -5.413 1.00 0.00 O ATOM 22 OE2 GLU A 2 0.329 -1.052 -6.668 1.00 0.00 O1- ATOM 0 H GLU A 2 -0.891 -5.381 -5.059 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.479 -4.288 -6.856 1.00 0.00 H new ATOM 0 HB2 GLU A 2 1.184 -5.006 -8.136 1.00 0.00 H new ATOM 0 HB3 GLU A 2 0.085 -3.746 -8.660 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.632 -3.826 -6.046 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.951 -2.781 -7.416 1.00 0.00 H new ATOM 29 N PHE A 3 -1.306 -7.290 -7.780 1.00 0.00 N ATOM 30 CA PHE A 3 -1.942 -8.302 -8.617 1.00 0.00 C ATOM 31 C PHE A 3 -3.452 -8.153 -8.563 1.00 0.00 C ATOM 32 O PHE A 3 -4.159 -8.522 -9.503 1.00 0.00 O ATOM 33 CB PHE A 3 -1.519 -9.715 -8.207 1.00 0.00 C ATOM 34 CG PHE A 3 -0.123 -10.080 -8.641 1.00 0.00 C ATOM 35 CD1 PHE A 3 0.966 -9.822 -7.825 1.00 0.00 C ATOM 36 CD2 PHE A 3 0.095 -10.684 -9.869 1.00 0.00 C ATOM 37 CE1 PHE A 3 2.246 -10.159 -8.227 1.00 0.00 C ATOM 38 CE2 PHE A 3 1.371 -11.022 -10.275 1.00 0.00 C ATOM 39 CZ PHE A 3 2.448 -10.759 -9.452 1.00 0.00 C ATOM 0 H PHE A 3 -0.827 -7.659 -6.958 1.00 0.00 H new ATOM 0 HA PHE A 3 -1.611 -8.148 -9.644 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -1.588 -9.805 -7.123 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -2.221 -10.432 -8.632 1.00 0.00 H new ATOM 0 HD1 PHE A 3 0.814 -9.353 -6.864 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -0.744 -10.893 -10.517 1.00 0.00 H new ATOM 0 HE1 PHE A 3 3.087 -9.952 -7.582 1.00 0.00 H new ATOM 0 HE2 PHE A 3 1.526 -11.491 -11.235 1.00 0.00 H new ATOM 0 HZ PHE A 3 3.447 -11.023 -9.767 1.00 0.00 H new ATOM 49 N GLU A 4 -3.938 -7.606 -7.451 1.00 0.00 N ATOM 50 CA GLU A 4 -5.349 -7.304 -7.293 1.00 0.00 C ATOM 51 C GLU A 4 -5.775 -6.321 -8.379 1.00 0.00 C ATOM 52 O GLU A 4 -6.757 -6.542 -9.086 1.00 0.00 O ATOM 53 CB GLU A 4 -5.605 -6.696 -5.910 1.00 0.00 C ATOM 54 CG GLU A 4 -7.052 -6.299 -5.662 1.00 0.00 C ATOM 55 CD GLU A 4 -7.225 -5.510 -4.384 1.00 0.00 C ATOM 56 OE1 GLU A 4 -7.558 -6.111 -3.344 1.00 0.00 O ATOM 57 OE2 GLU A 4 -7.027 -4.282 -4.411 1.00 0.00 O1- ATOM 0 H GLU A 4 -3.365 -7.363 -6.643 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.929 -8.223 -7.383 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.301 -7.414 -5.148 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -4.973 -5.816 -5.789 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.412 -5.706 -6.503 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.669 -7.196 -5.618 1.00 0.00 H new ATOM 64 N LYS A 5 -5.003 -5.244 -8.514 1.00 0.00 N ATOM 65 CA LYS A 5 -5.259 -4.231 -9.527 1.00 0.00 C ATOM 66 C LYS A 5 -5.065 -4.830 -10.906 1.00 0.00 C ATOM 67 O LYS A 5 -5.832 -4.567 -11.819 1.00 0.00 O ATOM 68 CB LYS A 5 -4.313 -3.042 -9.353 1.00 0.00 C ATOM 69 CG LYS A 5 -4.238 -2.515 -7.940 1.00 0.00 C ATOM 70 CD LYS A 5 -3.383 -1.267 -7.856 1.00 0.00 C ATOM 71 CE LYS A 5 -3.217 -0.807 -6.419 1.00 0.00 C ATOM 72 NZ LYS A 5 -4.523 -0.602 -5.743 1.00 0.00 N1+ ATOM 0 H LYS A 5 -4.190 -5.053 -7.928 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.286 -3.882 -9.416 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.314 -3.337 -9.673 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.634 -2.236 -10.013 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.243 -2.294 -7.580 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.827 -3.284 -7.286 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.404 -1.465 -8.292 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.839 -0.471 -8.444 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.636 -1.546 -5.867 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.650 0.123 -6.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -4.370 -0.130 -4.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -5.134 -0.010 -6.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.981 -1.523 -5.585 1.00 0.00 H new ATOM 86 N LEU A 6 -3.994 -5.602 -11.046 1.00 0.00 N ATOM 87 CA LEU A 6 -3.698 -6.308 -12.292 1.00 0.00 C ATOM 88 C LEU A 6 -4.930 -7.078 -12.777 1.00 0.00 C ATOM 89 O LEU A 6 -5.359 -6.915 -13.921 1.00 0.00 O ATOM 90 CB LEU A 6 -2.517 -7.263 -12.087 1.00 0.00 C ATOM 91 CG LEU A 6 -1.945 -7.914 -13.348 1.00 0.00 C ATOM 92 CD1 LEU A 6 -1.331 -6.865 -14.263 1.00 0.00 C ATOM 93 CD2 LEU A 6 -0.913 -8.964 -12.977 1.00 0.00 C ATOM 0 H LEU A 6 -3.309 -5.757 -10.306 1.00 0.00 H new ATOM 0 HA LEU A 6 -3.429 -5.576 -13.054 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -1.716 -6.715 -11.591 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.831 -8.054 -11.406 1.00 0.00 H new ATOM 0 HG LEU A 6 -2.760 -8.400 -13.884 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -0.930 -7.349 -15.154 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -2.095 -6.144 -14.554 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.527 -6.349 -13.737 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.515 -9.419 -13.884 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.102 -8.496 -12.419 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.381 -9.732 -12.361 1.00 0.00 H new ATOM 105 N ARG A 7 -5.498 -7.899 -11.905 1.00 0.00 N ATOM 106 CA ARG A 7 -6.715 -8.638 -12.227 1.00 0.00 C ATOM 107 C ARG A 7 -7.905 -7.690 -12.451 1.00 0.00 C ATOM 108 O ARG A 7 -8.662 -7.847 -13.408 1.00 0.00 O ATOM 109 CB ARG A 7 -7.040 -9.649 -11.112 1.00 0.00 C ATOM 110 CG ARG A 7 -8.397 -10.325 -11.263 1.00 0.00 C ATOM 111 CD ARG A 7 -8.464 -11.202 -12.505 1.00 0.00 C ATOM 112 NE ARG A 7 -9.836 -11.340 -12.982 1.00 0.00 N ATOM 113 CZ ARG A 7 -10.438 -12.485 -13.295 1.00 0.00 C ATOM 114 NH1 ARG A 7 -9.808 -13.645 -13.157 1.00 0.00 N1+ ATOM 115 NH2 ARG A 7 -11.686 -12.465 -13.742 1.00 0.00 N ATOM 0 H ARG A 7 -5.136 -8.072 -10.967 1.00 0.00 H new ATOM 0 HA ARG A 7 -6.539 -9.180 -13.156 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -6.265 -10.415 -11.093 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -7.006 -9.137 -10.150 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -8.600 -10.931 -10.380 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -9.177 -9.565 -11.314 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -7.845 -10.771 -13.291 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -8.054 -12.187 -12.280 1.00 0.00 H new ATOM 0 HE ARG A 7 -10.381 -10.484 -13.085 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -8.850 -13.667 -12.807 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -10.282 -14.515 -13.401 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -12.177 -11.577 -13.844 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -12.155 -13.338 -13.984 1.00 0.00 H new ATOM 129 N GLN A 8 -8.045 -6.708 -11.573 1.00 0.00 N ATOM 130 CA GLN A 8 -9.155 -5.752 -11.651 1.00 0.00 C ATOM 131 C GLN A 8 -9.138 -4.969 -12.973 1.00 0.00 C ATOM 132 O GLN A 8 -10.173 -4.831 -13.627 1.00 0.00 O ATOM 133 CB GLN A 8 -9.105 -4.794 -10.460 1.00 0.00 C ATOM 134 CG GLN A 8 -10.284 -3.843 -10.373 1.00 0.00 C ATOM 135 CD GLN A 8 -10.214 -2.945 -9.156 1.00 0.00 C ATOM 136 OE1 GLN A 8 -9.672 -3.322 -8.112 1.00 0.00 O ATOM 137 NE2 GLN A 8 -10.760 -1.757 -9.275 1.00 0.00 N ATOM 0 H GLN A 8 -7.406 -6.547 -10.795 1.00 0.00 H new ATOM 0 HA GLN A 8 -10.087 -6.316 -11.618 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -9.056 -5.378 -9.541 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -8.186 -4.210 -10.516 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.319 -3.229 -11.273 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.210 -4.418 -10.344 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -11.198 -1.483 -10.154 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -10.746 -1.108 -8.488 1.00 0.00 H new ATOM 146 N THR A 9 -7.971 -4.471 -13.374 1.00 0.00 N ATOM 147 CA THR A 9 -7.836 -3.783 -14.655 1.00 0.00 C ATOM 148 C THR A 9 -8.053 -4.744 -15.819 1.00 0.00 C ATOM 149 O THR A 9 -8.365 -4.329 -16.936 1.00 0.00 O ATOM 150 CB THR A 9 -6.451 -3.112 -14.794 1.00 0.00 C ATOM 151 OG1 THR A 9 -5.414 -4.060 -14.484 1.00 0.00 O ATOM 152 CG2 THR A 9 -6.336 -1.911 -13.866 1.00 0.00 C ATOM 0 H THR A 9 -7.108 -4.531 -12.833 1.00 0.00 H new ATOM 0 HA THR A 9 -8.603 -3.009 -14.683 1.00 0.00 H new ATOM 0 HB THR A 9 -6.339 -2.770 -15.823 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.391 -4.214 -13.517 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.353 -1.455 -13.981 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.106 -1.182 -14.118 1.00 0.00 H new ATOM 0 HG23 THR A 9 -6.467 -2.235 -12.834 1.00 0.00 H new ATOM 160 N GLY A 10 -7.899 -6.029 -15.542 1.00 0.00 N ATOM 161 CA GLY A 10 -8.124 -7.030 -16.550 1.00 0.00 C ATOM 162 C GLY A 10 -9.599 -7.202 -16.776 1.00 0.00 C ATOM 163 O GLY A 10 -10.069 -7.187 -17.910 1.00 0.00 O ATOM 0 H GLY A 10 -7.621 -6.393 -14.631 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.636 -6.739 -17.480 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -7.681 -7.977 -16.241 1.00 0.00 H new ATOM 167 N ASP A 11 -10.331 -7.359 -15.677 1.00 0.00 N ATOM 168 CA ASP A 11 -11.786 -7.455 -15.717 1.00 0.00 C ATOM 169 C ASP A 11 -12.386 -6.219 -16.370 1.00 0.00 C ATOM 170 O ASP A 11 -13.317 -6.321 -17.168 1.00 0.00 O ATOM 171 CB ASP A 11 -12.361 -7.632 -14.307 1.00 0.00 C ATOM 172 CG ASP A 11 -12.187 -9.036 -13.766 1.00 0.00 C ATOM 173 OD1 ASP A 11 -12.887 -9.958 -14.239 1.00 0.00 O ATOM 174 OD2 ASP A 11 -11.368 -9.226 -12.850 1.00 0.00 O1- ATOM 0 H ASP A 11 -9.935 -7.423 -14.739 1.00 0.00 H new ATOM 0 HA ASP A 11 -12.048 -8.330 -16.311 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.876 -6.926 -13.632 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.422 -7.383 -14.320 1.00 0.00 H new ATOM 179 N GLU A 12 -11.839 -5.051 -16.033 1.00 0.00 N ATOM 180 CA GLU A 12 -12.290 -3.803 -16.608 1.00 0.00 C ATOM 181 C GLU A 12 -12.073 -3.804 -18.123 1.00 0.00 C ATOM 182 O GLU A 12 -12.959 -3.406 -18.888 1.00 0.00 O ATOM 183 CB GLU A 12 -11.570 -2.621 -15.955 1.00 0.00 C ATOM 184 CG GLU A 12 -11.937 -1.287 -16.563 1.00 0.00 C ATOM 185 CD GLU A 12 -11.400 -0.107 -15.786 1.00 0.00 C ATOM 186 OE1 GLU A 12 -10.175 0.134 -15.814 1.00 0.00 O ATOM 187 OE2 GLU A 12 -12.208 0.598 -15.148 1.00 0.00 O1- ATOM 0 H GLU A 12 -11.079 -4.953 -15.360 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.358 -3.698 -16.417 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -11.805 -2.604 -14.891 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -10.493 -2.768 -16.041 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -11.557 -1.244 -17.584 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -13.023 -1.210 -16.623 1.00 0.00 H new ATOM 194 N LEU A 13 -10.899 -4.261 -18.551 1.00 0.00 N ATOM 195 CA LEU A 13 -10.592 -4.369 -19.971 1.00 0.00 C ATOM 196 C LEU A 13 -11.564 -5.328 -20.661 1.00 0.00 C ATOM 197 O LEU A 13 -12.005 -5.073 -21.778 1.00 0.00 O ATOM 198 CB LEU A 13 -9.144 -4.838 -20.170 1.00 0.00 C ATOM 199 CG LEU A 13 -8.656 -4.926 -21.621 1.00 0.00 C ATOM 200 CD1 LEU A 13 -8.699 -3.560 -22.289 1.00 0.00 C ATOM 201 CD2 LEU A 13 -7.250 -5.502 -21.674 1.00 0.00 C ATOM 0 H LEU A 13 -10.146 -4.562 -17.933 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.704 -3.384 -20.423 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.486 -4.159 -19.627 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.036 -5.821 -19.712 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.324 -5.592 -22.167 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.348 -3.647 -23.317 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.722 -3.185 -22.285 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.057 -2.868 -21.744 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -6.919 -5.558 -22.711 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -6.573 -4.860 -21.110 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.250 -6.501 -21.239 1.00 0.00 H new ATOM 213 N VAL A 14 -11.902 -6.428 -19.986 1.00 0.00 N ATOM 214 CA VAL A 14 -12.879 -7.380 -20.515 1.00 0.00 C ATOM 215 C VAL A 14 -14.231 -6.693 -20.707 1.00 0.00 C ATOM 216 O VAL A 14 -14.878 -6.848 -21.742 1.00 0.00 O ATOM 217 CB VAL A 14 -13.051 -8.613 -19.584 1.00 0.00 C ATOM 218 CG1 VAL A 14 -14.130 -9.550 -20.113 1.00 0.00 C ATOM 219 CG2 VAL A 14 -11.733 -9.360 -19.435 1.00 0.00 C ATOM 0 H VAL A 14 -11.516 -6.681 -19.076 1.00 0.00 H new ATOM 0 HA VAL A 14 -12.503 -7.733 -21.475 1.00 0.00 H new ATOM 0 HB VAL A 14 -13.361 -8.252 -18.604 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -14.230 -10.404 -19.443 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -15.080 -9.018 -20.167 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -13.853 -9.899 -21.108 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -11.874 -10.220 -18.780 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -11.396 -9.701 -20.414 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.984 -8.695 -19.005 1.00 0.00 H new ATOM 229 N GLN A 15 -14.639 -5.924 -19.702 1.00 0.00 N ATOM 230 CA GLN A 15 -15.889 -5.164 -19.773 1.00 0.00 C ATOM 231 C GLN A 15 -15.878 -4.228 -20.980 1.00 0.00 C ATOM 232 O GLN A 15 -16.855 -4.152 -21.727 1.00 0.00 O ATOM 233 CB GLN A 15 -16.113 -4.356 -18.492 1.00 0.00 C ATOM 234 CG GLN A 15 -16.243 -5.203 -17.239 1.00 0.00 C ATOM 235 CD GLN A 15 -17.401 -6.177 -17.303 1.00 0.00 C ATOM 236 OE1 GLN A 15 -18.427 -5.909 -17.937 1.00 0.00 O ATOM 237 NE2 GLN A 15 -17.248 -7.309 -16.648 1.00 0.00 N ATOM 0 H GLN A 15 -14.125 -5.809 -18.829 1.00 0.00 H new ATOM 0 HA GLN A 15 -16.707 -5.876 -19.882 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -15.283 -3.662 -18.364 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -17.016 -3.756 -18.607 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -15.317 -5.757 -17.083 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -16.372 -4.549 -16.376 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -16.384 -7.490 -16.137 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -17.994 -8.005 -16.652 1.00 0.00 H new ATOM 246 N ALA A 16 -14.766 -3.526 -21.174 1.00 0.00 N ATOM 247 CA ALA A 16 -14.616 -2.632 -22.315 1.00 0.00 C ATOM 248 C ALA A 16 -14.632 -3.409 -23.624 1.00 0.00 C ATOM 249 O ALA A 16 -15.177 -2.946 -24.623 1.00 0.00 O ATOM 250 CB ALA A 16 -13.336 -1.834 -22.196 1.00 0.00 C ATOM 0 H ALA A 16 -13.956 -3.560 -20.555 1.00 0.00 H new ATOM 0 HA ALA A 16 -15.461 -1.944 -22.317 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -13.239 -1.171 -23.056 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -13.361 -1.241 -21.282 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -12.485 -2.514 -22.164 1.00 0.00 H new ATOM 256 N PHE A 17 -14.040 -4.592 -23.607 1.00 0.00 N ATOM 257 CA PHE A 17 -14.006 -5.453 -24.778 1.00 0.00 C ATOM 258 C PHE A 17 -15.426 -5.884 -25.144 1.00 0.00 C ATOM 259 O PHE A 17 -15.787 -5.955 -26.321 1.00 0.00 O ATOM 260 CB PHE A 17 -13.118 -6.674 -24.524 1.00 0.00 C ATOM 261 CG PHE A 17 -12.926 -7.548 -25.731 1.00 0.00 C ATOM 262 CD1 PHE A 17 -12.059 -7.167 -26.742 1.00 0.00 C ATOM 263 CD2 PHE A 17 -13.607 -8.748 -25.854 1.00 0.00 C ATOM 264 CE1 PHE A 17 -11.873 -7.966 -27.851 1.00 0.00 C ATOM 265 CE2 PHE A 17 -13.425 -9.551 -26.961 1.00 0.00 C ATOM 266 CZ PHE A 17 -12.556 -9.158 -27.962 1.00 0.00 C ATOM 0 H PHE A 17 -13.573 -4.980 -22.788 1.00 0.00 H new ATOM 0 HA PHE A 17 -13.581 -4.897 -25.613 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -12.143 -6.335 -24.174 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -13.556 -7.269 -23.722 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -11.522 -6.233 -26.661 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -14.288 -9.058 -25.075 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -11.193 -7.658 -28.631 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.960 -10.485 -27.046 1.00 0.00 H new ATOM 0 HZ PHE A 17 -12.413 -9.784 -28.830 1.00 0.00 H new ATOM 276 N GLN A 18 -16.227 -6.167 -24.126 1.00 0.00 N ATOM 277 CA GLN A 18 -17.621 -6.526 -24.322 1.00 0.00 C ATOM 278 C GLN A 18 -18.380 -5.354 -24.937 1.00 0.00 C ATOM 279 O GLN A 18 -19.250 -5.539 -25.794 1.00 0.00 O ATOM 280 CB GLN A 18 -18.260 -6.940 -22.998 1.00 0.00 C ATOM 281 CG GLN A 18 -17.723 -8.250 -22.446 1.00 0.00 C ATOM 282 CD GLN A 18 -18.346 -8.619 -21.116 1.00 0.00 C ATOM 283 OE1 GLN A 18 -17.823 -8.284 -20.054 1.00 0.00 O ATOM 284 NE2 GLN A 18 -19.481 -9.282 -21.165 1.00 0.00 N ATOM 0 H GLN A 18 -15.931 -6.154 -23.150 1.00 0.00 H new ATOM 0 HA GLN A 18 -17.671 -7.374 -25.005 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -18.096 -6.152 -22.263 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -19.338 -7.028 -23.136 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -17.911 -9.047 -23.165 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -16.642 -8.175 -22.329 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -19.882 -9.541 -22.066 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -19.960 -9.537 -20.302 1.00 0.00 H new ATOM 293 N ARG A 19 -18.037 -4.145 -24.502 1.00 0.00 N ATOM 294 CA ARG A 19 -18.628 -2.931 -25.050 1.00 0.00 C ATOM 295 C ARG A 19 -18.191 -2.754 -26.498 1.00 0.00 C ATOM 296 O ARG A 19 -18.958 -2.287 -27.339 1.00 0.00 O ATOM 297 CB ARG A 19 -18.224 -1.713 -24.213 1.00 0.00 C ATOM 298 CG ARG A 19 -18.719 -1.775 -22.778 1.00 0.00 C ATOM 299 CD ARG A 19 -18.151 -0.647 -21.931 1.00 0.00 C ATOM 300 NE ARG A 19 -18.601 -0.748 -20.542 1.00 0.00 N ATOM 301 CZ ARG A 19 -17.793 -0.785 -19.476 1.00 0.00 C ATOM 302 NH1 ARG A 19 -16.478 -0.672 -19.619 1.00 0.00 N1+ ATOM 303 NH2 ARG A 19 -18.307 -0.924 -18.266 1.00 0.00 N ATOM 0 H ARG A 19 -17.349 -3.981 -23.767 1.00 0.00 H new ATOM 0 HA ARG A 19 -19.714 -3.020 -25.018 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -17.137 -1.627 -24.211 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -18.614 -0.811 -24.685 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -19.808 -1.724 -22.767 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -18.441 -2.733 -22.339 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.062 -0.676 -21.966 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.458 0.313 -22.346 1.00 0.00 H new ATOM 0 HE ARG A 19 -19.606 -0.794 -20.374 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -16.074 -0.556 -20.548 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -15.871 -0.702 -18.799 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -19.317 -1.003 -18.147 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -17.694 -0.953 -17.452 1.00 0.00 H new ATOM 317 N LEU A 20 -16.950 -3.150 -26.779 1.00 0.00 N ATOM 318 CA LEU A 20 -16.393 -3.084 -28.122 1.00 0.00 C ATOM 319 C LEU A 20 -17.193 -3.982 -29.057 1.00 0.00 C ATOM 320 O LEU A 20 -17.447 -3.629 -30.204 1.00 0.00 O ATOM 321 CB LEU A 20 -14.922 -3.526 -28.101 1.00 0.00 C ATOM 322 CG LEU A 20 -14.194 -3.527 -29.448 1.00 0.00 C ATOM 323 CD1 LEU A 20 -14.064 -2.116 -29.990 1.00 0.00 C ATOM 324 CD2 LEU A 20 -12.825 -4.178 -29.314 1.00 0.00 C ATOM 0 H LEU A 20 -16.307 -3.524 -26.081 1.00 0.00 H new ATOM 0 HA LEU A 20 -16.448 -2.056 -28.481 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -14.378 -2.872 -27.419 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -14.873 -4.532 -27.685 1.00 0.00 H new ATOM 0 HG LEU A 20 -14.784 -4.110 -30.155 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -13.544 -2.141 -30.948 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.056 -1.686 -30.127 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -13.499 -1.506 -29.285 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -12.322 -4.170 -30.281 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -12.228 -3.624 -28.590 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -12.943 -5.207 -28.975 1.00 0.00 H new ATOM 336 N ARG A 21 -17.592 -5.144 -28.549 1.00 0.00 N ATOM 337 CA ARG A 21 -18.398 -6.080 -29.319 1.00 0.00 C ATOM 338 C ARG A 21 -19.745 -5.480 -29.660 1.00 0.00 C ATOM 339 O ARG A 21 -20.183 -5.539 -30.803 1.00 0.00 O ATOM 340 CB ARG A 21 -18.610 -7.384 -28.554 1.00 0.00 C ATOM 341 CG ARG A 21 -17.524 -8.421 -28.762 1.00 0.00 C ATOM 342 CD ARG A 21 -17.380 -8.790 -30.234 1.00 0.00 C ATOM 343 NE ARG A 21 -18.681 -9.011 -30.895 1.00 0.00 N ATOM 344 CZ ARG A 21 -18.964 -10.053 -31.677 1.00 0.00 C ATOM 345 NH1 ARG A 21 -18.101 -11.061 -31.804 1.00 0.00 N1+ ATOM 346 NH2 ARG A 21 -20.130 -10.100 -32.304 1.00 0.00 N ATOM 0 H ARG A 21 -17.369 -5.459 -27.605 1.00 0.00 H new ATOM 0 HA ARG A 21 -17.854 -6.292 -30.240 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -18.680 -7.158 -27.490 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -19.566 -7.814 -28.852 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -16.575 -8.036 -28.388 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -17.757 -9.315 -28.183 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -16.844 -7.995 -30.753 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -16.775 -9.692 -30.321 1.00 0.00 H new ATOM 0 HE ARG A 21 -19.414 -8.319 -30.743 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -17.214 -11.040 -31.300 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -18.327 -11.854 -32.405 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -20.803 -9.343 -32.187 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -20.355 -10.894 -32.904 1.00 0.00 H new ATOM 360 N GLU A 22 -20.382 -4.880 -28.668 1.00 0.00 N ATOM 361 CA GLU A 22 -21.681 -4.295 -28.852 1.00 0.00 C ATOM 362 C GLU A 22 -21.612 -3.186 -29.897 1.00 0.00 C ATOM 363 O GLU A 22 -22.364 -3.189 -30.861 1.00 0.00 O ATOM 364 CB GLU A 22 -22.183 -3.746 -27.523 1.00 0.00 C ATOM 365 CG GLU A 22 -23.641 -3.385 -27.530 1.00 0.00 C ATOM 366 CD GLU A 22 -24.089 -2.753 -26.235 1.00 0.00 C ATOM 367 OE1 GLU A 22 -24.192 -3.474 -25.217 1.00 0.00 O ATOM 368 OE2 GLU A 22 -24.342 -1.530 -26.224 1.00 0.00 O1- ATOM 0 H GLU A 22 -20.009 -4.790 -27.723 1.00 0.00 H new ATOM 0 HA GLU A 22 -22.375 -5.057 -29.206 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -22.005 -4.487 -26.744 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -21.600 -2.863 -27.262 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -23.837 -2.697 -28.353 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -24.232 -4.281 -27.716 1.00 0.00 H new ATOM 375 N ILE A 23 -20.687 -2.264 -29.714 1.00 0.00 N ATOM 376 CA ILE A 23 -20.469 -1.188 -30.673 1.00 0.00 C ATOM 377 C ILE A 23 -20.168 -1.726 -32.072 1.00 0.00 C ATOM 378 O ILE A 23 -20.613 -1.160 -33.074 1.00 0.00 O ATOM 379 CB ILE A 23 -19.326 -0.269 -30.210 1.00 0.00 C ATOM 380 CG1 ILE A 23 -19.734 0.459 -28.933 1.00 0.00 C ATOM 381 CG2 ILE A 23 -18.946 0.720 -31.301 1.00 0.00 C ATOM 382 CD1 ILE A 23 -18.654 1.336 -28.363 1.00 0.00 C ATOM 0 H ILE A 23 -20.067 -2.235 -28.904 1.00 0.00 H new ATOM 0 HA ILE A 23 -21.393 -0.612 -30.724 1.00 0.00 H new ATOM 0 HB ILE A 23 -18.448 -0.880 -30.001 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -20.614 1.069 -29.139 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -20.025 -0.277 -28.183 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -18.136 1.358 -30.948 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -18.620 0.176 -32.187 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -19.810 1.336 -31.551 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -19.019 1.820 -27.457 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -17.781 0.729 -28.124 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -18.379 2.096 -29.094 1.00 0.00 H new ATOM 394 N PHE A 24 -19.442 -2.829 -32.132 1.00 0.00 N ATOM 395 CA PHE A 24 -19.073 -3.414 -33.408 1.00 0.00 C ATOM 396 C PHE A 24 -20.317 -3.961 -34.095 1.00 0.00 C ATOM 397 O PHE A 24 -20.562 -3.693 -35.269 1.00 0.00 O ATOM 398 CB PHE A 24 -18.032 -4.527 -33.222 1.00 0.00 C ATOM 399 CG PHE A 24 -17.475 -5.061 -34.517 1.00 0.00 C ATOM 400 CD1 PHE A 24 -16.360 -4.477 -35.097 1.00 0.00 C ATOM 401 CD2 PHE A 24 -18.067 -6.142 -35.154 1.00 0.00 C ATOM 402 CE1 PHE A 24 -15.845 -4.960 -36.284 1.00 0.00 C ATOM 403 CE2 PHE A 24 -17.556 -6.629 -36.343 1.00 0.00 C ATOM 404 CZ PHE A 24 -16.443 -6.037 -36.908 1.00 0.00 C ATOM 0 H PHE A 24 -19.098 -3.335 -31.316 1.00 0.00 H new ATOM 0 HA PHE A 24 -18.626 -2.640 -34.032 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -17.211 -4.146 -32.614 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -18.486 -5.348 -32.667 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -15.888 -3.634 -34.615 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -18.937 -6.609 -34.716 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -14.975 -4.496 -36.724 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -18.026 -7.471 -36.829 1.00 0.00 H new ATOM 0 HZ PHE A 24 -16.041 -6.416 -37.836 1.00 0.00 H new ATOM 414 N ASP A 25 -21.113 -4.709 -33.340 1.00 0.00 N ATOM 415 CA ASP A 25 -22.353 -5.285 -33.856 1.00 0.00 C ATOM 416 C ASP A 25 -23.358 -4.207 -34.262 1.00 0.00 C ATOM 417 O ASP A 25 -24.109 -4.383 -35.219 1.00 0.00 O ATOM 418 CB ASP A 25 -22.987 -6.240 -32.830 1.00 0.00 C ATOM 419 CG ASP A 25 -22.289 -7.590 -32.761 1.00 0.00 C ATOM 420 OD1 ASP A 25 -21.471 -7.806 -31.842 1.00 0.00 O ATOM 421 OD2 ASP A 25 -22.565 -8.448 -33.627 1.00 0.00 O1- ATOM 0 H ASP A 25 -20.922 -4.933 -32.363 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.091 -5.852 -34.750 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.962 -5.774 -31.845 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -24.036 -6.392 -33.084 1.00 0.00 H new ATOM 426 N LYS A 26 -23.359 -3.086 -33.546 1.00 0.00 N ATOM 427 CA LYS A 26 -24.287 -1.986 -33.842 1.00 0.00 C ATOM 428 C LYS A 26 -23.709 -1.006 -34.868 1.00 0.00 C ATOM 429 O LYS A 26 -24.396 -0.085 -35.305 1.00 0.00 O ATOM 430 CB LYS A 26 -24.698 -1.231 -32.561 1.00 0.00 C ATOM 431 CG LYS A 26 -25.721 -1.952 -31.665 1.00 0.00 C ATOM 432 CD LYS A 26 -25.239 -3.317 -31.200 1.00 0.00 C ATOM 433 CE LYS A 26 -26.153 -3.913 -30.142 1.00 0.00 C ATOM 434 NZ LYS A 26 -27.514 -4.182 -30.660 1.00 0.00 N1+ ATOM 0 H LYS A 26 -22.733 -2.911 -32.760 1.00 0.00 H new ATOM 0 HA LYS A 26 -25.177 -2.442 -34.276 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -23.802 -1.034 -31.973 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -25.110 -0.263 -32.847 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -25.936 -1.332 -30.795 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -26.657 -2.069 -32.211 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -25.184 -3.992 -32.054 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -24.230 -3.228 -30.799 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -25.718 -4.841 -29.771 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -26.218 -3.230 -29.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -28.100 -4.587 -29.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -27.942 -3.293 -30.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -27.458 -4.854 -31.451 1.00 0.00 H new ATOM 448 N GLY A 27 -22.453 -1.216 -35.252 1.00 0.00 N ATOM 449 CA GLY A 27 -21.810 -0.357 -36.241 1.00 0.00 C ATOM 450 C GLY A 27 -21.766 1.122 -35.861 1.00 0.00 C ATOM 451 O GLY A 27 -21.804 1.988 -36.742 1.00 0.00 O ATOM 0 H GLY A 27 -21.864 -1.969 -34.896 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.791 -0.709 -36.401 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -22.336 -0.460 -37.190 1.00 0.00 H new ATOM 455 N ASP A 28 -21.712 1.428 -34.573 1.00 0.00 N ATOM 456 CA ASP A 28 -21.686 2.826 -34.150 1.00 0.00 C ATOM 457 C ASP A 28 -20.251 3.352 -34.105 1.00 0.00 C ATOM 458 O ASP A 28 -19.595 3.331 -33.066 1.00 0.00 O ATOM 459 CB ASP A 28 -22.385 3.016 -32.807 1.00 0.00 C ATOM 460 CG ASP A 28 -22.678 4.480 -32.528 1.00 0.00 C ATOM 461 OD1 ASP A 28 -21.734 5.261 -32.343 1.00 0.00 O ATOM 462 OD2 ASP A 28 -23.870 4.857 -32.501 1.00 0.00 O1- ATOM 0 H ASP A 28 -21.686 0.746 -33.815 1.00 0.00 H new ATOM 0 HA ASP A 28 -22.237 3.408 -34.889 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -23.317 2.450 -32.799 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -21.760 2.612 -32.011 1.00 0.00 H new ATOM 467 N ASP A 29 -19.768 3.794 -35.262 1.00 0.00 N ATOM 468 CA ASP A 29 -18.397 4.318 -35.415 1.00 0.00 C ATOM 469 C ASP A 29 -18.094 5.481 -34.477 1.00 0.00 C ATOM 470 O ASP A 29 -16.947 5.668 -34.066 1.00 0.00 O ATOM 471 CB ASP A 29 -18.144 4.761 -36.858 1.00 0.00 C ATOM 472 CG ASP A 29 -17.891 3.611 -37.801 1.00 0.00 C ATOM 473 OD1 ASP A 29 -18.859 3.106 -38.409 1.00 0.00 O ATOM 474 OD2 ASP A 29 -16.716 3.218 -37.959 1.00 0.00 O1- ATOM 0 H ASP A 29 -20.309 3.803 -36.126 1.00 0.00 H new ATOM 0 HA ASP A 29 -17.731 3.496 -35.151 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -19.004 5.329 -37.212 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -17.287 5.434 -36.879 1.00 0.00 H new ATOM 479 N ASP A 30 -19.105 6.256 -34.143 1.00 0.00 N ATOM 480 CA ASP A 30 -18.914 7.409 -33.266 1.00 0.00 C ATOM 481 C ASP A 30 -18.602 6.959 -31.853 1.00 0.00 C ATOM 482 O ASP A 30 -17.652 7.437 -31.230 1.00 0.00 O ATOM 483 CB ASP A 30 -20.144 8.309 -33.272 1.00 0.00 C ATOM 484 CG ASP A 30 -20.398 8.930 -34.623 1.00 0.00 C ATOM 485 OD1 ASP A 30 -19.679 9.875 -34.991 1.00 0.00 O ATOM 486 OD2 ASP A 30 -21.330 8.482 -35.322 1.00 0.00 O1- ATOM 0 H ASP A 30 -20.064 6.116 -34.459 1.00 0.00 H new ATOM 0 HA ASP A 30 -18.068 7.982 -33.646 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -21.017 7.728 -32.973 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -20.017 9.098 -32.531 1.00 0.00 H new ATOM 491 N SER A 31 -19.394 6.025 -31.362 1.00 0.00 N ATOM 492 CA SER A 31 -19.214 5.478 -30.033 1.00 0.00 C ATOM 493 C SER A 31 -17.896 4.705 -29.967 1.00 0.00 C ATOM 494 O SER A 31 -17.219 4.677 -28.934 1.00 0.00 O ATOM 495 CB SER A 31 -20.397 4.558 -29.698 1.00 0.00 C ATOM 496 OG SER A 31 -20.405 3.407 -30.510 1.00 0.00 O ATOM 0 H SER A 31 -20.180 5.625 -31.874 1.00 0.00 H new ATOM 0 HA SER A 31 -19.177 6.287 -29.303 1.00 0.00 H new ATOM 0 HB2 SER A 31 -20.345 4.264 -28.650 1.00 0.00 H new ATOM 0 HB3 SER A 31 -21.331 5.103 -29.830 1.00 0.00 H new ATOM 0 HG SER A 31 -20.050 3.629 -31.396 1.00 0.00 H new ATOM 502 N LEU A 32 -17.534 4.113 -31.098 1.00 0.00 N ATOM 503 CA LEU A 32 -16.328 3.322 -31.224 1.00 0.00 C ATOM 504 C LEU A 32 -15.088 4.173 -30.966 1.00 0.00 C ATOM 505 O LEU A 32 -14.184 3.750 -30.257 1.00 0.00 O ATOM 506 CB LEU A 32 -16.271 2.709 -32.628 1.00 0.00 C ATOM 507 CG LEU A 32 -15.140 1.722 -32.897 1.00 0.00 C ATOM 508 CD1 LEU A 32 -15.239 0.526 -31.968 1.00 0.00 C ATOM 509 CD2 LEU A 32 -15.170 1.273 -34.349 1.00 0.00 C ATOM 0 H LEU A 32 -18.078 4.172 -31.959 1.00 0.00 H new ATOM 0 HA LEU A 32 -16.347 2.527 -30.479 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.217 2.202 -32.817 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.194 3.521 -33.351 1.00 0.00 H new ATOM 0 HG LEU A 32 -14.191 2.223 -32.706 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.423 -0.166 -32.177 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.174 0.863 -30.933 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.192 0.021 -32.126 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.358 0.569 -34.529 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.124 0.789 -34.561 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.050 2.139 -35.000 1.00 0.00 H new ATOM 521 N GLU A 33 -15.069 5.379 -31.524 1.00 0.00 N ATOM 522 CA GLU A 33 -13.935 6.287 -31.354 1.00 0.00 C ATOM 523 C GLU A 33 -13.671 6.592 -29.883 1.00 0.00 C ATOM 524 O GLU A 33 -12.522 6.592 -29.439 1.00 0.00 O ATOM 525 CB GLU A 33 -14.169 7.591 -32.121 1.00 0.00 C ATOM 526 CG GLU A 33 -14.006 7.459 -33.623 1.00 0.00 C ATOM 527 CD GLU A 33 -12.593 7.083 -34.014 1.00 0.00 C ATOM 528 OE1 GLU A 33 -12.301 5.882 -34.106 1.00 0.00 O ATOM 529 OE2 GLU A 33 -11.764 7.993 -34.232 1.00 0.00 O1- ATOM 0 H GLU A 33 -15.825 5.752 -32.098 1.00 0.00 H new ATOM 0 HA GLU A 33 -13.056 5.785 -31.758 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.174 7.953 -31.905 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -13.473 8.346 -31.755 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -14.698 6.704 -33.997 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -14.275 8.402 -34.100 1.00 0.00 H new ATOM 536 N GLN A 34 -14.730 6.852 -29.135 1.00 0.00 N ATOM 537 CA GLN A 34 -14.593 7.166 -27.722 1.00 0.00 C ATOM 538 C GLN A 34 -14.162 5.941 -26.921 1.00 0.00 C ATOM 539 O GLN A 34 -13.243 6.016 -26.105 1.00 0.00 O ATOM 540 CB GLN A 34 -15.901 7.712 -27.161 1.00 0.00 C ATOM 541 CG GLN A 34 -15.783 8.201 -25.727 1.00 0.00 C ATOM 542 CD GLN A 34 -17.113 8.586 -25.127 1.00 0.00 C ATOM 543 OE1 GLN A 34 -18.033 8.991 -25.835 1.00 0.00 O ATOM 544 NE2 GLN A 34 -17.216 8.486 -23.818 1.00 0.00 N ATOM 0 H GLN A 34 -15.690 6.852 -29.480 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.820 7.929 -27.631 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -16.243 8.533 -27.790 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.662 6.934 -27.211 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -15.328 7.420 -25.118 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -15.113 9.060 -25.695 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -16.427 8.145 -23.269 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -18.085 8.750 -23.353 1.00 0.00 H new ATOM 553 N VAL A 35 -14.805 4.813 -27.174 1.00 0.00 N ATOM 554 CA VAL A 35 -14.516 3.593 -26.442 1.00 0.00 C ATOM 555 C VAL A 35 -13.134 3.037 -26.783 1.00 0.00 C ATOM 556 O VAL A 35 -12.452 2.498 -25.915 1.00 0.00 O ATOM 557 CB VAL A 35 -15.620 2.529 -26.655 1.00 0.00 C ATOM 558 CG1 VAL A 35 -15.210 1.174 -26.091 1.00 0.00 C ATOM 559 CG2 VAL A 35 -16.910 3.000 -25.998 1.00 0.00 C ATOM 0 H VAL A 35 -15.532 4.718 -27.883 1.00 0.00 H new ATOM 0 HA VAL A 35 -14.506 3.851 -25.383 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.774 2.406 -27.727 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -16.010 0.453 -26.259 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.303 0.832 -26.589 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.024 1.267 -25.021 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.689 2.252 -26.147 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.744 3.143 -24.930 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.223 3.943 -26.446 1.00 0.00 H new ATOM 569 N LEU A 36 -12.707 3.188 -28.034 1.00 0.00 N ATOM 570 CA LEU A 36 -11.376 2.734 -28.432 1.00 0.00 C ATOM 571 C LEU A 36 -10.309 3.455 -27.628 1.00 0.00 C ATOM 572 O LEU A 36 -9.281 2.868 -27.285 1.00 0.00 O ATOM 573 CB LEU A 36 -11.142 2.930 -29.933 1.00 0.00 C ATOM 574 CG LEU A 36 -11.779 1.879 -30.849 1.00 0.00 C ATOM 575 CD1 LEU A 36 -11.670 2.302 -32.300 1.00 0.00 C ATOM 576 CD2 LEU A 36 -11.114 0.524 -30.649 1.00 0.00 C ATOM 0 H LEU A 36 -13.254 3.615 -28.781 1.00 0.00 H new ATOM 0 HA LEU A 36 -11.312 1.666 -28.224 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -11.524 3.911 -30.216 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.068 2.941 -30.116 1.00 0.00 H new ATOM 0 HG LEU A 36 -12.834 1.794 -30.588 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -12.128 1.544 -32.935 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.184 3.253 -32.442 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.620 2.414 -32.568 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -11.579 -0.210 -31.307 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.052 0.601 -30.884 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.234 0.209 -29.612 1.00 0.00 H new ATOM 588 N GLU A 37 -10.566 4.720 -27.302 1.00 0.00 N ATOM 589 CA GLU A 37 -9.643 5.477 -26.480 1.00 0.00 C ATOM 590 C GLU A 37 -9.639 4.926 -25.072 1.00 0.00 C ATOM 591 O GLU A 37 -8.595 4.807 -24.449 1.00 0.00 O ATOM 592 CB GLU A 37 -10.000 6.960 -26.446 1.00 0.00 C ATOM 593 CG GLU A 37 -9.828 7.676 -27.765 1.00 0.00 C ATOM 594 CD GLU A 37 -9.902 9.171 -27.609 1.00 0.00 C ATOM 595 OE1 GLU A 37 -11.025 9.717 -27.571 1.00 0.00 O ATOM 596 OE2 GLU A 37 -8.840 9.815 -27.518 1.00 0.00 O1- ATOM 0 H GLU A 37 -11.398 5.232 -27.594 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.651 5.380 -26.921 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.036 7.064 -26.123 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.381 7.453 -25.696 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.867 7.404 -28.202 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.600 7.345 -28.460 1.00 0.00 H new ATOM 603 N GLU A 38 -10.818 4.554 -24.584 1.00 0.00 N ATOM 604 CA GLU A 38 -10.951 4.006 -23.247 1.00 0.00 C ATOM 605 C GLU A 38 -10.211 2.686 -23.152 1.00 0.00 C ATOM 606 O GLU A 38 -9.455 2.458 -22.219 1.00 0.00 O ATOM 607 CB GLU A 38 -12.429 3.792 -22.907 1.00 0.00 C ATOM 608 CG GLU A 38 -13.220 5.076 -22.741 1.00 0.00 C ATOM 609 CD GLU A 38 -12.769 5.879 -21.545 1.00 0.00 C ATOM 610 OE1 GLU A 38 -13.064 5.466 -20.404 1.00 0.00 O ATOM 611 OE2 GLU A 38 -12.126 6.932 -21.736 1.00 0.00 O1- ATOM 0 H GLU A 38 -11.695 4.624 -25.100 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.521 4.712 -22.536 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.889 3.194 -23.694 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.499 3.214 -21.986 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.118 5.682 -23.641 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -14.278 4.837 -22.636 1.00 0.00 H new ATOM 618 N ILE A 39 -10.404 1.842 -24.158 1.00 0.00 N ATOM 619 CA ILE A 39 -9.765 0.534 -24.196 1.00 0.00 C ATOM 620 C ILE A 39 -8.251 0.691 -24.192 1.00 0.00 C ATOM 621 O ILE A 39 -7.554 0.052 -23.406 1.00 0.00 O ATOM 622 CB ILE A 39 -10.197 -0.279 -25.441 1.00 0.00 C ATOM 623 CG1 ILE A 39 -11.708 -0.525 -25.416 1.00 0.00 C ATOM 624 CG2 ILE A 39 -9.443 -1.607 -25.502 1.00 0.00 C ATOM 625 CD1 ILE A 39 -12.236 -1.223 -26.648 1.00 0.00 C ATOM 0 H ILE A 39 -11.000 2.042 -24.961 1.00 0.00 H new ATOM 0 HA ILE A 39 -10.082 -0.012 -23.307 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.952 0.298 -26.333 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -11.954 -1.123 -24.538 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -12.220 0.431 -25.305 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -9.759 -2.165 -26.383 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -8.372 -1.415 -25.560 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.659 -2.190 -24.607 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -13.313 -1.361 -26.554 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -12.023 -0.617 -27.529 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -11.753 -2.195 -26.751 1.00 0.00 H new ATOM 637 N GLU A 40 -7.755 1.565 -25.061 1.00 0.00 N ATOM 638 CA GLU A 40 -6.334 1.843 -25.148 1.00 0.00 C ATOM 639 C GLU A 40 -5.777 2.337 -23.806 1.00 0.00 C ATOM 640 O GLU A 40 -4.675 1.951 -23.404 1.00 0.00 O ATOM 641 CB GLU A 40 -6.076 2.867 -26.251 1.00 0.00 C ATOM 642 CG GLU A 40 -4.611 3.156 -26.495 1.00 0.00 C ATOM 643 CD GLU A 40 -4.399 4.132 -27.627 1.00 0.00 C ATOM 644 OE1 GLU A 40 -4.779 5.312 -27.479 1.00 0.00 O ATOM 645 OE2 GLU A 40 -3.844 3.735 -28.665 1.00 0.00 O1- ATOM 0 H GLU A 40 -8.326 2.095 -25.719 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.816 0.916 -25.394 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.524 2.508 -27.178 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.581 3.798 -25.993 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.166 3.557 -25.585 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.092 2.224 -26.720 1.00 0.00 H new ATOM 652 N GLU A 41 -6.548 3.162 -23.101 1.00 0.00 N ATOM 653 CA GLU A 41 -6.110 3.681 -21.813 1.00 0.00 C ATOM 654 C GLU A 41 -6.126 2.579 -20.758 1.00 0.00 C ATOM 655 O GLU A 41 -5.268 2.537 -19.876 1.00 0.00 O ATOM 656 CB GLU A 41 -6.975 4.859 -21.360 1.00 0.00 C ATOM 657 CG GLU A 41 -6.948 6.052 -22.304 1.00 0.00 C ATOM 658 CD GLU A 41 -5.544 6.523 -22.624 1.00 0.00 C ATOM 659 OE1 GLU A 41 -4.878 7.081 -21.723 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.105 6.354 -23.778 1.00 0.00 O1- ATOM 0 H GLU A 41 -7.470 3.481 -23.398 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.088 4.041 -21.933 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -8.005 4.519 -21.252 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.641 5.182 -20.374 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.456 5.786 -23.231 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -7.508 6.874 -21.858 1.00 0.00 H new ATOM 667 N LEU A 42 -7.099 1.671 -20.863 1.00 0.00 N ATOM 668 CA LEU A 42 -7.219 0.565 -19.918 1.00 0.00 C ATOM 669 C LEU A 42 -6.035 -0.366 -20.065 1.00 0.00 C ATOM 670 O LEU A 42 -5.521 -0.898 -19.077 1.00 0.00 O ATOM 671 CB LEU A 42 -8.519 -0.221 -20.141 1.00 0.00 C ATOM 672 CG LEU A 42 -9.820 0.581 -20.083 1.00 0.00 C ATOM 673 CD1 LEU A 42 -11.014 -0.336 -20.215 1.00 0.00 C ATOM 674 CD2 LEU A 42 -9.910 1.394 -18.808 1.00 0.00 C ATOM 0 H LEU A 42 -7.812 1.682 -21.592 1.00 0.00 H new ATOM 0 HA LEU A 42 -7.239 0.983 -18.911 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.461 -0.707 -21.115 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.572 -1.012 -19.393 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.821 1.277 -20.922 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -11.931 0.252 -20.172 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.965 -0.862 -21.168 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.008 -1.060 -19.400 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.846 1.952 -18.798 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.877 0.726 -17.947 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.072 2.090 -18.760 1.00 0.00 H new ATOM 686 N ILE A 43 -5.594 -0.547 -21.308 1.00 0.00 N ATOM 687 CA ILE A 43 -4.447 -1.385 -21.596 1.00 0.00 C ATOM 688 C ILE A 43 -3.221 -0.821 -20.898 1.00 0.00 C ATOM 689 O ILE A 43 -2.438 -1.564 -20.297 1.00 0.00 O ATOM 690 CB ILE A 43 -4.171 -1.472 -23.122 1.00 0.00 C ATOM 691 CG1 ILE A 43 -5.363 -2.105 -23.848 1.00 0.00 C ATOM 692 CG2 ILE A 43 -2.897 -2.271 -23.396 1.00 0.00 C ATOM 693 CD1 ILE A 43 -5.221 -2.125 -25.357 1.00 0.00 C ATOM 0 H ILE A 43 -6.020 -0.120 -22.130 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.664 -2.389 -21.231 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.031 -0.460 -23.501 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.493 -3.127 -23.491 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.269 -1.558 -23.585 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -2.722 -2.320 -24.471 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.051 -1.783 -22.912 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.009 -3.281 -23.000 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -6.103 -2.588 -25.799 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.123 -1.104 -25.727 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.335 -2.697 -25.632 1.00 0.00 H new ATOM 705 N GLN A 44 -3.075 0.503 -20.955 1.00 0.00 N ATOM 706 CA GLN A 44 -1.956 1.170 -20.314 1.00 0.00 C ATOM 707 C GLN A 44 -1.999 0.979 -18.810 1.00 0.00 C ATOM 708 O GLN A 44 -1.012 0.594 -18.214 1.00 0.00 O ATOM 709 CB GLN A 44 -1.961 2.662 -20.622 1.00 0.00 C ATOM 710 CG GLN A 44 -1.752 3.007 -22.079 1.00 0.00 C ATOM 711 CD GLN A 44 -1.717 4.502 -22.300 1.00 0.00 C ATOM 712 OE1 GLN A 44 -1.307 5.262 -21.418 1.00 0.00 O ATOM 713 NE2 GLN A 44 -2.147 4.935 -23.459 1.00 0.00 N ATOM 0 H GLN A 44 -3.719 1.128 -21.439 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.044 0.722 -20.709 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -2.912 3.083 -20.296 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.180 3.143 -20.033 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -0.818 2.566 -22.427 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.553 2.570 -22.675 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.477 4.272 -24.160 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.151 5.935 -23.660 1.00 0.00 H new ATOM 722 N LYS A 45 -3.174 1.185 -18.211 1.00 0.00 N ATOM 723 CA LYS A 45 -3.326 1.080 -16.753 1.00 0.00 C ATOM 724 C LYS A 45 -3.000 -0.319 -16.266 1.00 0.00 C ATOM 725 O LYS A 45 -2.455 -0.503 -15.177 1.00 0.00 O ATOM 726 CB LYS A 45 -4.742 1.453 -16.314 1.00 0.00 C ATOM 727 CG LYS A 45 -5.152 2.879 -16.648 1.00 0.00 C ATOM 728 CD LYS A 45 -6.467 3.250 -15.972 1.00 0.00 C ATOM 729 CE LYS A 45 -7.578 2.270 -16.324 1.00 0.00 C ATOM 730 NZ LYS A 45 -8.859 2.605 -15.653 1.00 0.00 N1+ ATOM 0 H LYS A 45 -4.032 1.425 -18.708 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.622 1.783 -16.308 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -5.447 0.767 -16.783 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.825 1.308 -15.237 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.370 3.568 -16.330 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.253 2.987 -17.728 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.328 3.269 -14.891 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.760 4.256 -16.273 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.727 2.265 -17.404 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.274 1.263 -16.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -9.438 1.746 -15.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.665 2.995 -14.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -9.374 3.309 -16.219 1.00 0.00 H new ATOM 744 N HIS A 46 -3.329 -1.295 -17.078 1.00 0.00 N ATOM 745 CA HIS A 46 -3.093 -2.681 -16.754 1.00 0.00 C ATOM 746 C HIS A 46 -1.608 -3.009 -16.943 1.00 0.00 C ATOM 747 O HIS A 46 -0.995 -3.675 -16.114 1.00 0.00 O ATOM 748 CB HIS A 46 -3.986 -3.548 -17.655 1.00 0.00 C ATOM 749 CG HIS A 46 -3.812 -5.031 -17.529 1.00 0.00 C ATOM 750 ND1 HIS A 46 -4.236 -5.763 -16.441 1.00 0.00 N ATOM 751 CD2 HIS A 46 -3.316 -5.922 -18.408 1.00 0.00 C ATOM 752 CE1 HIS A 46 -4.007 -7.044 -16.666 1.00 0.00 C ATOM 753 NE2 HIS A 46 -3.447 -7.167 -17.860 1.00 0.00 N ATOM 0 H HIS A 46 -3.770 -1.149 -17.986 1.00 0.00 H new ATOM 0 HA HIS A 46 -3.343 -2.884 -15.713 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.027 -3.306 -17.441 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.801 -3.268 -18.692 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -4.659 -5.377 -15.597 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -2.890 -5.694 -19.374 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -4.237 -7.855 -15.990 1.00 0.00 H new ATOM 761 N ARG A 47 -1.045 -2.523 -18.047 1.00 0.00 N ATOM 762 CA ARG A 47 0.366 -2.732 -18.363 1.00 0.00 C ATOM 763 C ARG A 47 1.288 -2.028 -17.357 1.00 0.00 C ATOM 764 O ARG A 47 2.351 -2.542 -17.037 1.00 0.00 O ATOM 765 CB ARG A 47 0.662 -2.259 -19.791 1.00 0.00 C ATOM 766 CG ARG A 47 2.047 -2.633 -20.304 1.00 0.00 C ATOM 767 CD ARG A 47 2.160 -2.376 -21.799 1.00 0.00 C ATOM 768 NE ARG A 47 3.423 -2.866 -22.353 1.00 0.00 N ATOM 769 CZ ARG A 47 3.525 -3.848 -23.263 1.00 0.00 C ATOM 770 NH1 ARG A 47 2.442 -4.479 -23.701 1.00 0.00 N1+ ATOM 771 NH2 ARG A 47 4.706 -4.201 -23.734 1.00 0.00 N ATOM 0 H ARG A 47 -1.551 -1.976 -18.744 1.00 0.00 H new ATOM 0 HA ARG A 47 0.568 -3.801 -18.293 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.087 -2.680 -20.462 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.553 -1.175 -19.831 1.00 0.00 H new ATOM 0 HG2 ARG A 47 2.804 -2.055 -19.773 1.00 0.00 H new ATOM 0 HG3 ARG A 47 2.245 -3.685 -20.096 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.329 -2.859 -22.312 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.073 -1.306 -21.989 1.00 0.00 H new ATOM 0 HE ARG A 47 4.286 -2.431 -22.025 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.522 -4.219 -23.346 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.530 -5.224 -24.392 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.548 -3.727 -23.407 1.00 0.00 H new ATOM 0 HH22 ARG A 47 4.777 -4.948 -24.425 1.00 0.00 H new ATOM 785 N GLN A 48 0.853 -0.874 -16.834 1.00 0.00 N ATOM 786 CA GLN A 48 1.657 -0.104 -15.861 1.00 0.00 C ATOM 787 C GLN A 48 1.966 -0.946 -14.640 1.00 0.00 C ATOM 788 O GLN A 48 3.030 -0.822 -14.037 1.00 0.00 O ATOM 789 CB GLN A 48 0.907 1.155 -15.408 1.00 0.00 C ATOM 790 CG GLN A 48 0.674 2.183 -16.496 1.00 0.00 C ATOM 791 CD GLN A 48 -0.317 3.252 -16.075 1.00 0.00 C ATOM 792 OE1 GLN A 48 -1.201 3.009 -15.246 1.00 0.00 O ATOM 793 NE2 GLN A 48 -0.194 4.428 -16.649 1.00 0.00 N ATOM 0 H GLN A 48 -0.046 -0.450 -17.064 1.00 0.00 H new ATOM 0 HA GLN A 48 2.584 0.182 -16.357 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -0.057 0.858 -14.996 1.00 0.00 H new ATOM 0 HB3 GLN A 48 1.468 1.624 -14.599 1.00 0.00 H new ATOM 0 HG2 GLN A 48 1.622 2.653 -16.758 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.307 1.683 -17.393 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.549 4.589 -17.329 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -0.842 5.180 -16.415 1.00 0.00 H new ATOM 802 N LEU A 49 1.042 -1.819 -14.296 1.00 0.00 N ATOM 803 CA LEU A 49 1.187 -2.671 -13.140 1.00 0.00 C ATOM 804 C LEU A 49 2.229 -3.745 -13.404 1.00 0.00 C ATOM 805 O LEU A 49 2.968 -4.143 -12.502 1.00 0.00 O ATOM 806 CB LEU A 49 -0.160 -3.288 -12.799 1.00 0.00 C ATOM 807 CG LEU A 49 -1.241 -2.282 -12.405 1.00 0.00 C ATOM 808 CD1 LEU A 49 -2.606 -2.925 -12.445 1.00 0.00 C ATOM 809 CD2 LEU A 49 -0.960 -1.708 -11.023 1.00 0.00 C ATOM 0 H LEU A 49 0.172 -1.956 -14.810 1.00 0.00 H new ATOM 0 HA LEU A 49 1.528 -2.079 -12.290 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.511 -3.860 -13.658 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.024 -3.994 -11.980 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.227 -1.464 -13.126 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.362 -2.193 -12.161 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.810 -3.284 -13.454 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.634 -3.763 -11.749 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.740 -0.994 -10.760 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.945 -2.515 -10.290 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.006 -1.204 -11.028 1.00 0.00 H new ATOM 821 N PHE A 50 2.299 -4.191 -14.650 1.00 0.00 N ATOM 822 CA PHE A 50 3.284 -5.178 -15.050 1.00 0.00 C ATOM 823 C PHE A 50 4.647 -4.519 -15.206 1.00 0.00 C ATOM 824 O PHE A 50 5.676 -5.134 -14.956 1.00 0.00 O ATOM 825 CB PHE A 50 2.872 -5.868 -16.358 1.00 0.00 C ATOM 826 CG PHE A 50 3.915 -6.816 -16.889 1.00 0.00 C ATOM 827 CD1 PHE A 50 4.168 -8.018 -16.248 1.00 0.00 C ATOM 828 CD2 PHE A 50 4.648 -6.498 -18.021 1.00 0.00 C ATOM 829 CE1 PHE A 50 5.133 -8.885 -16.726 1.00 0.00 C ATOM 830 CE2 PHE A 50 5.612 -7.360 -18.504 1.00 0.00 C ATOM 831 CZ PHE A 50 5.855 -8.555 -17.855 1.00 0.00 C ATOM 0 H PHE A 50 1.682 -3.882 -15.401 1.00 0.00 H new ATOM 0 HA PHE A 50 3.343 -5.939 -14.272 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.944 -6.415 -16.194 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.665 -5.108 -17.111 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.605 -8.281 -15.365 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.463 -5.565 -18.532 1.00 0.00 H new ATOM 0 HE1 PHE A 50 5.321 -9.819 -16.217 1.00 0.00 H new ATOM 0 HE2 PHE A 50 6.175 -7.100 -19.388 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.609 -9.230 -18.231 1.00 0.00 H new ATOM 841 N ASP A 51 4.638 -3.246 -15.594 1.00 0.00 N ATOM 842 CA ASP A 51 5.872 -2.491 -15.768 1.00 0.00 C ATOM 843 C ASP A 51 6.509 -2.243 -14.422 1.00 0.00 C ATOM 844 O ASP A 51 7.726 -2.073 -14.317 1.00 0.00 O ATOM 845 CB ASP A 51 5.622 -1.153 -16.480 1.00 0.00 C ATOM 846 CG ASP A 51 5.402 -1.306 -17.972 1.00 0.00 C ATOM 847 OD1 ASP A 51 6.321 -1.785 -18.664 1.00 0.00 O ATOM 848 OD2 ASP A 51 4.322 -0.917 -18.465 1.00 0.00 O1- ATOM 0 H ASP A 51 3.789 -2.717 -15.793 1.00 0.00 H new ATOM 0 HA ASP A 51 6.543 -3.081 -16.393 1.00 0.00 H new ATOM 0 HB2 ASP A 51 4.751 -0.670 -16.038 1.00 0.00 H new ATOM 0 HB3 ASP A 51 6.473 -0.493 -16.310 1.00 0.00 H new ATOM 853 N ASN A 52 5.669 -2.213 -13.389 1.00 0.00 N ATOM 854 CA ASN A 52 6.131 -2.038 -12.022 1.00 0.00 C ATOM 855 C ASN A 52 7.105 -3.134 -11.646 1.00 0.00 C ATOM 856 O ASN A 52 8.286 -2.872 -11.408 1.00 0.00 O ATOM 857 CB ASN A 52 4.953 -2.036 -11.032 1.00 0.00 C ATOM 858 CG ASN A 52 4.149 -0.753 -11.063 1.00 0.00 C ATOM 859 OD1 ASN A 52 4.686 0.325 -11.298 1.00 0.00 O ATOM 860 ND2 ASN A 52 2.855 -0.859 -10.817 1.00 0.00 N ATOM 0 H ASN A 52 4.658 -2.309 -13.479 1.00 0.00 H new ATOM 0 HA ASN A 52 6.635 -1.073 -11.966 1.00 0.00 H new ATOM 0 HB2 ASN A 52 4.295 -2.875 -11.259 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.334 -2.194 -10.023 1.00 0.00 H new ATOM 0 HD21 ASN A 52 2.266 -0.026 -10.818 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.445 -1.773 -10.626 1.00 0.00 H new ATOM 867 N ARG A 53 6.623 -4.367 -11.596 1.00 0.00 N ATOM 868 CA ARG A 53 7.466 -5.475 -11.216 1.00 0.00 C ATOM 869 C ARG A 53 7.518 -6.540 -12.307 1.00 0.00 C ATOM 870 O ARG A 53 6.674 -7.432 -12.356 1.00 0.00 O ATOM 871 CB ARG A 53 6.954 -6.102 -9.916 1.00 0.00 C ATOM 872 CG ARG A 53 8.046 -6.537 -8.944 1.00 0.00 C ATOM 873 CD ARG A 53 8.937 -7.613 -9.536 1.00 0.00 C ATOM 874 NE ARG A 53 9.913 -8.112 -8.570 1.00 0.00 N ATOM 875 CZ ARG A 53 11.023 -8.775 -8.895 1.00 0.00 C ATOM 876 NH1 ARG A 53 11.334 -8.975 -10.165 1.00 0.00 N1+ ATOM 877 NH2 ARG A 53 11.829 -9.222 -7.948 1.00 0.00 N ATOM 0 H ARG A 53 5.658 -4.618 -11.813 1.00 0.00 H new ATOM 0 HA ARG A 53 8.474 -5.088 -11.068 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.305 -5.385 -9.414 1.00 0.00 H new ATOM 0 HB3 ARG A 53 6.341 -6.968 -10.164 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.653 -5.674 -8.670 1.00 0.00 H new ATOM 0 HG3 ARG A 53 7.588 -6.909 -8.027 1.00 0.00 H new ATOM 0 HD2 ARG A 53 8.321 -8.440 -9.888 1.00 0.00 H new ATOM 0 HD3 ARG A 53 9.460 -7.213 -10.405 1.00 0.00 H new ATOM 0 HE ARG A 53 9.733 -7.942 -7.581 1.00 0.00 H new ATOM 0 HH11 ARG A 53 10.723 -8.621 -10.901 1.00 0.00 H new ATOM 0 HH12 ARG A 53 12.185 -9.483 -10.408 1.00 0.00 H new ATOM 0 HH21 ARG A 53 11.602 -9.060 -6.967 1.00 0.00 H new ATOM 0 HH22 ARG A 53 12.678 -9.729 -8.198 1.00 0.00 H new ATOM 891 N GLN A 54 8.489 -6.428 -13.185 1.00 0.00 N ATOM 892 CA GLN A 54 8.723 -7.452 -14.186 1.00 0.00 C ATOM 893 C GLN A 54 9.679 -8.460 -13.569 1.00 0.00 C ATOM 894 O GLN A 54 10.170 -8.214 -12.463 1.00 0.00 O ATOM 895 CB GLN A 54 9.321 -6.834 -15.456 1.00 0.00 C ATOM 896 CG GLN A 54 8.461 -5.726 -16.054 1.00 0.00 C ATOM 897 CD GLN A 54 9.006 -5.179 -17.359 1.00 0.00 C ATOM 898 OE1 GLN A 54 10.212 -5.196 -17.601 1.00 0.00 O ATOM 899 NE2 GLN A 54 8.123 -4.679 -18.202 1.00 0.00 N ATOM 0 H GLN A 54 9.132 -5.638 -13.229 1.00 0.00 H new ATOM 0 HA GLN A 54 7.791 -7.936 -14.477 1.00 0.00 H new ATOM 0 HB2 GLN A 54 10.308 -6.433 -15.226 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.461 -7.617 -16.201 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.454 -6.108 -16.221 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.378 -4.912 -15.334 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.131 -4.684 -17.964 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.432 -4.288 -19.092 1.00 0.00 H new ATOM 908 N GLU A 55 9.944 -9.596 -14.231 1.00 0.00 N ATOM 909 CA GLU A 55 10.857 -10.618 -13.684 1.00 0.00 C ATOM 910 C GLU A 55 10.248 -11.323 -12.476 1.00 0.00 C ATOM 911 O GLU A 55 10.943 -11.664 -11.519 1.00 0.00 O ATOM 912 CB GLU A 55 12.235 -10.024 -13.340 1.00 0.00 C ATOM 913 CG GLU A 55 13.039 -9.606 -14.556 1.00 0.00 C ATOM 914 CD GLU A 55 13.267 -10.756 -15.508 1.00 0.00 C ATOM 915 OE1 GLU A 55 14.013 -11.690 -15.152 1.00 0.00 O ATOM 916 OE2 GLU A 55 12.695 -10.741 -16.612 1.00 0.00 O1- ATOM 0 H GLU A 55 9.544 -9.832 -15.139 1.00 0.00 H new ATOM 0 HA GLU A 55 11.006 -11.364 -14.464 1.00 0.00 H new ATOM 0 HB2 GLU A 55 12.096 -9.159 -12.692 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.806 -10.759 -12.773 1.00 0.00 H new ATOM 0 HG2 GLU A 55 12.517 -8.803 -15.077 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.001 -9.206 -14.234 1.00 0.00 H new ATOM 923 N ALA A 56 8.950 -11.563 -12.545 1.00 0.00 N ATOM 924 CA ALA A 56 8.234 -12.229 -11.470 1.00 0.00 C ATOM 925 C ALA A 56 7.473 -13.444 -11.999 1.00 0.00 C ATOM 926 O ALA A 56 6.422 -13.807 -11.463 1.00 0.00 O ATOM 927 CB ALA A 56 7.276 -11.251 -10.800 1.00 0.00 C ATOM 0 H ALA A 56 8.366 -11.304 -13.341 1.00 0.00 H new ATOM 0 HA ALA A 56 8.957 -12.577 -10.732 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.743 -11.757 -9.995 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.839 -10.413 -10.391 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.560 -10.883 -11.534 1.00 0.00 H new ATOM 933 N ALA A 57 8.029 -14.074 -13.048 1.00 0.00 N ATOM 934 CA ALA A 57 7.424 -15.250 -13.694 1.00 0.00 C ATOM 935 C ALA A 57 6.136 -14.872 -14.427 1.00 0.00 C ATOM 936 O ALA A 57 5.770 -13.695 -14.474 1.00 0.00 O ATOM 937 CB ALA A 57 7.176 -16.375 -12.686 1.00 0.00 C ATOM 0 H ALA A 57 8.910 -13.782 -13.471 1.00 0.00 H new ATOM 0 HA ALA A 57 8.133 -15.622 -14.433 1.00 0.00 H new ATOM 0 HB1 ALA A 57 6.729 -17.228 -13.196 1.00 0.00 H new ATOM 0 HB2 ALA A 57 8.122 -16.676 -12.237 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.500 -16.023 -11.907 1.00 0.00 H new ATOM 943 N ASP A 58 5.469 -15.874 -15.021 1.00 0.00 N ATOM 944 CA ASP A 58 4.219 -15.662 -15.771 1.00 0.00 C ATOM 945 C ASP A 58 4.471 -14.817 -17.004 1.00 0.00 C ATOM 946 O ASP A 58 3.729 -13.881 -17.309 1.00 0.00 O ATOM 947 CB ASP A 58 3.117 -15.041 -14.895 1.00 0.00 C ATOM 948 CG ASP A 58 2.529 -16.033 -13.919 1.00 0.00 C ATOM 949 OD1 ASP A 58 1.825 -16.968 -14.364 1.00 0.00 O ATOM 950 OD2 ASP A 58 2.764 -15.888 -12.697 1.00 0.00 O1- ATOM 0 H ASP A 58 5.777 -16.846 -14.996 1.00 0.00 H new ATOM 0 HA ASP A 58 3.861 -16.641 -16.089 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.528 -14.194 -14.345 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.325 -14.651 -15.534 1.00 0.00 H new ATOM 955 N THR A 59 5.499 -15.189 -17.742 1.00 0.00 N ATOM 956 CA THR A 59 5.898 -14.463 -18.917 1.00 0.00 C ATOM 957 C THR A 59 4.989 -14.771 -20.106 1.00 0.00 C ATOM 958 O THR A 59 4.878 -13.972 -21.027 1.00 0.00 O ATOM 959 CB THR A 59 7.359 -14.772 -19.274 1.00 0.00 C ATOM 960 OG1 THR A 59 7.664 -16.138 -18.925 1.00 0.00 O ATOM 961 CG2 THR A 59 8.304 -13.833 -18.539 1.00 0.00 C ATOM 0 H THR A 59 6.077 -16.004 -17.538 1.00 0.00 H new ATOM 0 HA THR A 59 5.805 -13.401 -18.691 1.00 0.00 H new ATOM 0 HB THR A 59 7.492 -14.628 -20.346 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.596 -16.334 -19.155 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.334 -14.070 -18.807 1.00 0.00 H new ATOM 0 HG22 THR A 59 8.084 -12.803 -18.819 1.00 0.00 H new ATOM 0 HG23 THR A 59 8.172 -13.953 -17.464 1.00 0.00 H new ATOM 969 N GLU A 60 4.325 -15.929 -20.070 1.00 0.00 N ATOM 970 CA GLU A 60 3.413 -16.320 -21.142 1.00 0.00 C ATOM 971 C GLU A 60 2.265 -15.323 -21.241 1.00 0.00 C ATOM 972 O GLU A 60 1.871 -14.923 -22.330 1.00 0.00 O ATOM 973 CB GLU A 60 2.862 -17.732 -20.896 1.00 0.00 C ATOM 974 CG GLU A 60 1.985 -18.277 -22.027 1.00 0.00 C ATOM 975 CD GLU A 60 2.756 -18.525 -23.313 1.00 0.00 C ATOM 976 OE1 GLU A 60 3.662 -19.383 -23.306 1.00 0.00 O ATOM 977 OE2 GLU A 60 2.444 -17.882 -24.340 1.00 0.00 O1- ATOM 0 H GLU A 60 4.403 -16.608 -19.313 1.00 0.00 H new ATOM 0 HA GLU A 60 3.966 -16.323 -22.081 1.00 0.00 H new ATOM 0 HB2 GLU A 60 3.699 -18.413 -20.742 1.00 0.00 H new ATOM 0 HB3 GLU A 60 2.281 -17.726 -19.974 1.00 0.00 H new ATOM 0 HG2 GLU A 60 1.522 -19.209 -21.703 1.00 0.00 H new ATOM 0 HG3 GLU A 60 1.178 -17.572 -22.225 1.00 0.00 H new ATOM 984 N ALA A 61 1.756 -14.902 -20.086 1.00 0.00 N ATOM 985 CA ALA A 61 0.653 -13.949 -20.031 1.00 0.00 C ATOM 986 C ALA A 61 1.066 -12.608 -20.632 1.00 0.00 C ATOM 987 O ALA A 61 0.292 -11.970 -21.346 1.00 0.00 O ATOM 988 CB ALA A 61 0.179 -13.770 -18.597 1.00 0.00 C ATOM 0 H ALA A 61 2.092 -15.208 -19.173 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.173 -14.345 -20.622 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.644 -13.056 -18.572 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.160 -14.728 -18.204 1.00 0.00 H new ATOM 0 HB3 ALA A 61 1.001 -13.397 -17.986 1.00 0.00 H new ATOM 994 N ALA A 62 2.297 -12.200 -20.356 1.00 0.00 N ATOM 995 CA ALA A 62 2.825 -10.947 -20.881 1.00 0.00 C ATOM 996 C ALA A 62 3.093 -11.074 -22.371 1.00 0.00 C ATOM 997 O ALA A 62 2.842 -10.153 -23.145 1.00 0.00 O ATOM 998 CB ALA A 62 4.097 -10.562 -20.146 1.00 0.00 C ATOM 0 H ALA A 62 2.951 -12.720 -19.770 1.00 0.00 H new ATOM 0 HA ALA A 62 2.084 -10.163 -20.726 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.480 -9.624 -20.549 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.881 -10.440 -19.085 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.844 -11.345 -20.277 1.00 0.00 H new ATOM 1004 N LYS A 63 3.583 -12.240 -22.759 1.00 0.00 N ATOM 1005 CA LYS A 63 3.887 -12.548 -24.146 1.00 0.00 C ATOM 1006 C LYS A 63 2.612 -12.543 -24.983 1.00 0.00 C ATOM 1007 O LYS A 63 2.571 -11.976 -26.079 1.00 0.00 O ATOM 1008 CB LYS A 63 4.574 -13.916 -24.213 1.00 0.00 C ATOM 1009 CG LYS A 63 4.547 -14.580 -25.572 1.00 0.00 C ATOM 1010 CD LYS A 63 5.135 -15.977 -25.501 1.00 0.00 C ATOM 1011 CE LYS A 63 4.707 -16.813 -26.688 1.00 0.00 C ATOM 1012 NZ LYS A 63 3.235 -16.960 -26.743 1.00 0.00 N1+ ATOM 0 H LYS A 63 3.782 -13.005 -22.115 1.00 0.00 H new ATOM 0 HA LYS A 63 4.556 -11.789 -24.552 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.612 -13.800 -23.903 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.098 -14.580 -23.491 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.521 -14.631 -25.937 1.00 0.00 H new ATOM 0 HG3 LYS A 63 5.110 -13.979 -26.286 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.223 -15.915 -25.470 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.817 -16.462 -24.578 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.062 -16.350 -27.608 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.170 -17.798 -26.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.992 -17.838 -27.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.853 -16.997 -25.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.824 -16.148 -27.247 1.00 0.00 H new ATOM 1026 N GLN A 64 1.569 -13.162 -24.450 1.00 0.00 N ATOM 1027 CA GLN A 64 0.287 -13.214 -25.123 1.00 0.00 C ATOM 1028 C GLN A 64 -0.338 -11.831 -25.173 1.00 0.00 C ATOM 1029 O GLN A 64 -0.917 -11.437 -26.189 1.00 0.00 O ATOM 1030 CB GLN A 64 -0.652 -14.189 -24.410 1.00 0.00 C ATOM 1031 CG GLN A 64 -0.216 -15.645 -24.474 1.00 0.00 C ATOM 1032 CD GLN A 64 -0.362 -16.249 -25.857 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -0.265 -15.561 -26.869 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -0.590 -17.544 -25.906 1.00 0.00 N ATOM 0 H GLN A 64 1.590 -13.637 -23.548 1.00 0.00 H new ATOM 0 HA GLN A 64 0.447 -13.565 -26.142 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -0.736 -13.894 -23.364 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -1.647 -14.101 -24.847 1.00 0.00 H new ATOM 0 HG2 GLN A 64 0.825 -15.721 -24.159 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -0.806 -16.226 -23.766 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -0.664 -18.082 -25.042 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -0.693 -18.010 -26.807 1.00 0.00 H new ATOM 1043 N GLY A 65 -0.216 -11.090 -24.069 1.00 0.00 N ATOM 1044 CA GLY A 65 -0.756 -9.751 -24.016 1.00 0.00 C ATOM 1045 C GLY A 65 -0.126 -8.832 -25.032 1.00 0.00 C ATOM 1046 O GLY A 65 -0.815 -8.017 -25.635 1.00 0.00 O ATOM 0 H GLY A 65 0.248 -11.399 -23.215 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -1.832 -9.790 -24.185 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.605 -9.341 -23.017 1.00 0.00 H new ATOM 1050 N ASP A 66 1.180 -8.965 -25.242 1.00 0.00 N ATOM 1051 CA ASP A 66 1.863 -8.158 -26.251 1.00 0.00 C ATOM 1052 C ASP A 66 1.328 -8.461 -27.629 1.00 0.00 C ATOM 1053 O ASP A 66 1.112 -7.556 -28.430 1.00 0.00 O ATOM 1054 CB ASP A 66 3.379 -8.362 -26.222 1.00 0.00 C ATOM 1055 CG ASP A 66 4.066 -7.449 -25.238 1.00 0.00 C ATOM 1056 OD1 ASP A 66 3.932 -6.211 -25.383 1.00 0.00 O ATOM 1057 OD2 ASP A 66 4.756 -7.949 -24.337 1.00 0.00 O1- ATOM 0 H ASP A 66 1.781 -9.615 -24.735 1.00 0.00 H new ATOM 0 HA ASP A 66 1.664 -7.114 -26.011 1.00 0.00 H new ATOM 0 HB2 ASP A 66 3.598 -9.398 -25.965 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.785 -8.188 -27.219 1.00 0.00 H new ATOM 1062 N GLN A 67 1.087 -9.737 -27.895 1.00 0.00 N ATOM 1063 CA GLN A 67 0.549 -10.160 -29.176 1.00 0.00 C ATOM 1064 C GLN A 67 -0.853 -9.585 -29.361 1.00 0.00 C ATOM 1065 O GLN A 67 -1.201 -9.092 -30.432 1.00 0.00 O ATOM 1066 CB GLN A 67 0.512 -11.687 -29.254 1.00 0.00 C ATOM 1067 CG GLN A 67 0.139 -12.231 -30.623 1.00 0.00 C ATOM 1068 CD GLN A 67 0.128 -13.744 -30.658 1.00 0.00 C ATOM 1069 OE1 GLN A 67 1.150 -14.378 -30.913 1.00 0.00 O ATOM 1070 NE2 GLN A 67 -1.024 -14.333 -30.409 1.00 0.00 N ATOM 0 H GLN A 67 1.257 -10.498 -27.237 1.00 0.00 H new ATOM 0 HA GLN A 67 1.192 -9.789 -29.974 1.00 0.00 H new ATOM 0 HB2 GLN A 67 1.490 -12.078 -28.974 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -0.202 -12.060 -28.520 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -0.845 -11.856 -30.904 1.00 0.00 H new ATOM 0 HG3 GLN A 67 0.846 -11.858 -31.364 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.850 -13.771 -30.201 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -1.090 -15.351 -30.424 1.00 0.00 H new ATOM 1079 N TRP A 68 -1.639 -9.634 -28.291 1.00 0.00 N ATOM 1080 CA TRP A 68 -2.995 -9.100 -28.291 1.00 0.00 C ATOM 1081 C TRP A 68 -2.974 -7.605 -28.617 1.00 0.00 C ATOM 1082 O TRP A 68 -3.834 -7.102 -29.343 1.00 0.00 O ATOM 1083 CB TRP A 68 -3.661 -9.343 -26.929 1.00 0.00 C ATOM 1084 CG TRP A 68 -5.128 -9.028 -26.906 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -6.139 -9.851 -27.298 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -5.747 -7.814 -26.465 1.00 0.00 C ATOM 1087 NE1 TRP A 68 -7.348 -9.229 -27.134 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -7.138 -7.976 -26.624 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -5.264 -6.606 -25.952 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -8.048 -6.977 -26.289 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -6.169 -5.616 -25.621 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -7.547 -5.808 -25.790 1.00 0.00 C ATOM 0 H TRP A 68 -1.354 -10.044 -27.401 1.00 0.00 H new ATOM 0 HA TRP A 68 -3.575 -9.614 -29.057 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -3.519 -10.386 -26.647 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -3.157 -8.737 -26.176 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -6.007 -10.851 -27.683 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -8.258 -9.634 -27.356 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -4.204 -6.450 -25.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -9.110 -7.121 -26.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -5.808 -4.678 -25.225 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -8.228 -5.014 -25.520 1.00 0.00 H new ATOM 1103 N VAL A 69 -1.966 -6.913 -28.095 1.00 0.00 N ATOM 1104 CA VAL A 69 -1.827 -5.482 -28.310 1.00 0.00 C ATOM 1105 C VAL A 69 -1.533 -5.198 -29.780 1.00 0.00 C ATOM 1106 O VAL A 69 -2.080 -4.260 -30.359 1.00 0.00 O ATOM 1107 CB VAL A 69 -0.710 -4.863 -27.421 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -0.473 -3.400 -27.778 1.00 0.00 C ATOM 1109 CG2 VAL A 69 -1.069 -4.989 -25.949 1.00 0.00 C ATOM 0 H VAL A 69 -1.232 -7.325 -27.518 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.772 -5.018 -28.027 1.00 0.00 H new ATOM 0 HB VAL A 69 0.211 -5.415 -27.609 1.00 0.00 H new ATOM 0 HG11 VAL A 69 0.312 -2.993 -27.141 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -0.169 -3.325 -28.822 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.393 -2.835 -27.626 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -0.276 -4.551 -25.342 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -2.005 -4.465 -25.757 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -1.183 -6.042 -25.691 1.00 0.00 H new ATOM 1119 N GLN A 70 -0.695 -6.039 -30.388 1.00 0.00 N ATOM 1120 CA GLN A 70 -0.337 -5.876 -31.794 1.00 0.00 C ATOM 1121 C GLN A 70 -1.580 -5.993 -32.664 1.00 0.00 C ATOM 1122 O GLN A 70 -1.806 -5.180 -33.562 1.00 0.00 O ATOM 1123 CB GLN A 70 0.693 -6.929 -32.226 1.00 0.00 C ATOM 1124 CG GLN A 70 1.932 -7.009 -31.343 1.00 0.00 C ATOM 1125 CD GLN A 70 2.600 -5.666 -31.130 1.00 0.00 C ATOM 1126 OE1 GLN A 70 2.307 -4.959 -30.165 1.00 0.00 O ATOM 1127 NE2 GLN A 70 3.491 -5.305 -32.026 1.00 0.00 N ATOM 0 H GLN A 70 -0.254 -6.836 -29.929 1.00 0.00 H new ATOM 0 HA GLN A 70 0.105 -4.887 -31.918 1.00 0.00 H new ATOM 0 HB2 GLN A 70 0.210 -7.906 -32.239 1.00 0.00 H new ATOM 0 HB3 GLN A 70 1.005 -6.714 -33.248 1.00 0.00 H new ATOM 0 HG2 GLN A 70 1.654 -7.427 -30.375 1.00 0.00 H new ATOM 0 HG3 GLN A 70 2.648 -7.696 -31.794 1.00 0.00 H new ATOM 0 HE21 GLN A 70 3.704 -5.921 -32.810 1.00 0.00 H new ATOM 0 HE22 GLN A 70 3.970 -4.409 -31.937 1.00 0.00 H new ATOM 1136 N LEU A 71 -2.393 -7.006 -32.377 1.00 0.00 N ATOM 1137 CA LEU A 71 -3.633 -7.226 -33.110 1.00 0.00 C ATOM 1138 C LEU A 71 -4.597 -6.063 -32.905 1.00 0.00 C ATOM 1139 O LEU A 71 -5.298 -5.663 -33.830 1.00 0.00 O ATOM 1140 CB LEU A 71 -4.296 -8.550 -32.702 1.00 0.00 C ATOM 1141 CG LEU A 71 -3.795 -9.818 -33.420 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -2.315 -10.051 -33.169 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -4.604 -11.027 -32.984 1.00 0.00 C ATOM 0 H LEU A 71 -2.213 -7.688 -31.640 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.383 -7.287 -34.169 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.155 -8.686 -31.630 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.369 -8.462 -32.874 1.00 0.00 H new ATOM 0 HG LEU A 71 -3.931 -9.670 -34.491 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.995 -10.953 -33.690 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.745 -9.198 -33.537 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.142 -10.169 -32.099 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.238 -11.915 -33.500 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.501 -11.165 -31.908 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.654 -10.871 -33.231 1.00 0.00 H new ATOM 1155 N PHE A 72 -4.619 -5.518 -31.692 1.00 0.00 N ATOM 1156 CA PHE A 72 -5.467 -4.372 -31.386 1.00 0.00 C ATOM 1157 C PHE A 72 -5.047 -3.167 -32.224 1.00 0.00 C ATOM 1158 O PHE A 72 -5.890 -2.449 -32.770 1.00 0.00 O ATOM 1159 CB PHE A 72 -5.404 -4.027 -29.890 1.00 0.00 C ATOM 1160 CG PHE A 72 -6.252 -2.840 -29.507 1.00 0.00 C ATOM 1161 CD1 PHE A 72 -7.619 -2.979 -29.326 1.00 0.00 C ATOM 1162 CD2 PHE A 72 -5.681 -1.586 -29.336 1.00 0.00 C ATOM 1163 CE1 PHE A 72 -8.400 -1.892 -28.981 1.00 0.00 C ATOM 1164 CE2 PHE A 72 -6.457 -0.496 -28.992 1.00 0.00 C ATOM 1165 CZ PHE A 72 -7.818 -0.649 -28.813 1.00 0.00 C ATOM 0 H PHE A 72 -4.060 -5.851 -30.907 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.496 -4.633 -31.632 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.725 -4.894 -29.312 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.368 -3.827 -29.615 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.079 -3.947 -29.456 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.617 -1.461 -29.474 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.464 -2.013 -28.843 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.000 0.474 -28.863 1.00 0.00 H new ATOM 0 HZ PHE A 72 -8.427 0.201 -28.542 1.00 0.00 H new ATOM 1175 N GLN A 73 -3.740 -2.956 -32.326 1.00 0.00 N ATOM 1176 CA GLN A 73 -3.201 -1.865 -33.125 1.00 0.00 C ATOM 1177 C GLN A 73 -3.606 -2.027 -34.584 1.00 0.00 C ATOM 1178 O GLN A 73 -4.028 -1.069 -35.228 1.00 0.00 O ATOM 1179 CB GLN A 73 -1.680 -1.806 -32.999 1.00 0.00 C ATOM 1180 CG GLN A 73 -1.196 -1.565 -31.580 1.00 0.00 C ATOM 1181 CD GLN A 73 0.311 -1.546 -31.469 1.00 0.00 C ATOM 1182 OE1 GLN A 73 1.013 -2.205 -32.236 1.00 0.00 O ATOM 1183 NE2 GLN A 73 0.818 -0.793 -30.513 1.00 0.00 N ATOM 0 H GLN A 73 -3.033 -3.528 -31.864 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.613 -0.928 -32.750 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.257 -2.742 -33.364 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -1.301 -1.012 -33.643 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.594 -0.615 -31.222 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.594 -2.343 -30.929 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.199 -0.263 -29.899 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.829 -0.741 -30.387 1.00 0.00 H new ATOM 1192 N ARG A 74 -3.495 -3.253 -35.088 1.00 0.00 N ATOM 1193 CA ARG A 74 -3.886 -3.561 -36.464 1.00 0.00 C ATOM 1194 C ARG A 74 -5.383 -3.326 -36.643 1.00 0.00 C ATOM 1195 O ARG A 74 -5.824 -2.830 -37.673 1.00 0.00 O ATOM 1196 CB ARG A 74 -3.549 -5.017 -36.813 1.00 0.00 C ATOM 1197 CG ARG A 74 -2.078 -5.370 -36.668 1.00 0.00 C ATOM 1198 CD ARG A 74 -1.833 -6.843 -36.963 1.00 0.00 C ATOM 1199 NE ARG A 74 -0.467 -7.251 -36.626 1.00 0.00 N ATOM 1200 CZ ARG A 74 -0.100 -8.508 -36.358 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -0.981 -9.493 -36.458 1.00 0.00 N1+ ATOM 1202 NH2 ARG A 74 1.155 -8.778 -36.015 1.00 0.00 N ATOM 0 H ARG A 74 -3.137 -4.052 -34.565 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.330 -2.904 -37.134 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.134 -5.677 -36.172 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.858 -5.213 -37.840 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -1.486 -4.757 -37.347 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.744 -5.139 -35.657 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -2.542 -7.448 -36.398 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -2.019 -7.037 -38.019 1.00 0.00 H new ATOM 0 HE ARG A 74 0.252 -6.528 -36.594 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -1.941 -9.292 -36.740 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -0.699 -10.452 -36.253 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.841 -8.025 -35.956 1.00 0.00 H new ATOM 0 HH22 ARG A 74 1.433 -9.738 -35.811 1.00 0.00 H new ATOM 1216 N PHE A 75 -6.149 -3.685 -35.619 1.00 0.00 N ATOM 1217 CA PHE A 75 -7.596 -3.499 -35.621 1.00 0.00 C ATOM 1218 C PHE A 75 -7.928 -2.014 -35.776 1.00 0.00 C ATOM 1219 O PHE A 75 -8.765 -1.637 -36.591 1.00 0.00 O ATOM 1220 CB PHE A 75 -8.193 -4.065 -34.321 1.00 0.00 C ATOM 1221 CG PHE A 75 -9.692 -3.984 -34.225 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -10.491 -4.896 -34.896 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -10.302 -3.008 -33.452 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -11.868 -4.836 -34.801 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -11.679 -2.942 -33.354 1.00 0.00 C ATOM 1226 CZ PHE A 75 -12.462 -3.858 -34.029 1.00 0.00 C ATOM 0 H PHE A 75 -5.786 -4.112 -34.767 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.033 -4.036 -36.463 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -7.893 -5.109 -34.225 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -7.760 -3.530 -33.476 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -10.031 -5.664 -35.501 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -9.694 -2.291 -32.920 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -12.479 -5.553 -35.330 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -12.142 -2.175 -32.751 1.00 0.00 H new ATOM 0 HZ PHE A 75 -13.538 -3.809 -33.953 1.00 0.00 H new ATOM 1236 N ARG A 76 -7.248 -1.182 -34.991 1.00 0.00 N ATOM 1237 CA ARG A 76 -7.406 0.270 -35.067 1.00 0.00 C ATOM 1238 C ARG A 76 -7.082 0.781 -36.472 1.00 0.00 C ATOM 1239 O ARG A 76 -7.845 1.559 -37.049 1.00 0.00 O ATOM 1240 CB ARG A 76 -6.485 0.951 -34.044 1.00 0.00 C ATOM 1241 CG ARG A 76 -6.416 2.475 -34.160 1.00 0.00 C ATOM 1242 CD ARG A 76 -7.711 3.135 -33.719 1.00 0.00 C ATOM 1243 NE ARG A 76 -8.391 3.844 -34.818 1.00 0.00 N ATOM 1244 CZ ARG A 76 -9.520 4.536 -34.661 1.00 0.00 C ATOM 1245 NH1 ARG A 76 -10.023 4.729 -33.456 1.00 0.00 N1+ ATOM 1246 NH2 ARG A 76 -10.116 5.082 -35.701 1.00 0.00 N ATOM 0 H ARG A 76 -6.576 -1.491 -34.289 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.444 0.513 -34.841 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.824 0.692 -33.041 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.479 0.546 -34.155 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.592 2.849 -33.552 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.201 2.751 -35.192 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.380 2.377 -33.312 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.500 3.839 -32.914 1.00 0.00 H new ATOM 0 HE ARG A 76 -7.976 3.803 -35.749 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -9.548 4.348 -32.638 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -10.887 5.259 -33.343 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -9.714 4.977 -36.633 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.979 5.610 -35.575 1.00 0.00 H new ATOM 1260 N GLU A 77 -5.972 0.302 -37.030 1.00 0.00 N ATOM 1261 CA GLU A 77 -5.513 0.741 -38.345 1.00 0.00 C ATOM 1262 C GLU A 77 -6.492 0.322 -39.429 1.00 0.00 C ATOM 1263 O GLU A 77 -6.696 1.038 -40.410 1.00 0.00 O ATOM 1264 CB GLU A 77 -4.126 0.165 -38.662 1.00 0.00 C ATOM 1265 CG GLU A 77 -3.036 0.557 -37.678 1.00 0.00 C ATOM 1266 CD GLU A 77 -2.851 2.051 -37.569 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -2.346 2.667 -38.532 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -3.193 2.620 -36.516 1.00 0.00 O1- ATOM 0 H GLU A 77 -5.371 -0.394 -36.588 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.450 1.829 -38.323 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -4.197 -0.922 -38.691 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.831 0.492 -39.659 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.279 0.154 -36.695 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.095 0.101 -37.986 1.00 0.00 H new ATOM 1275 N ALA A 78 -7.115 -0.828 -39.236 1.00 0.00 N ATOM 1276 CA ALA A 78 -8.034 -1.377 -40.209 1.00 0.00 C ATOM 1277 C ALA A 78 -9.313 -0.561 -40.262 1.00 0.00 C ATOM 1278 O ALA A 78 -9.932 -0.425 -41.320 1.00 0.00 O ATOM 1279 CB ALA A 78 -8.336 -2.825 -39.889 1.00 0.00 C ATOM 0 H ALA A 78 -6.996 -1.403 -38.402 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.563 -1.331 -41.191 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.029 -3.224 -40.630 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.412 -3.402 -39.908 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.785 -2.893 -38.898 1.00 0.00 H new ATOM 1285 N ILE A 79 -9.699 0.003 -39.117 1.00 0.00 N ATOM 1286 CA ILE A 79 -10.904 0.812 -39.031 1.00 0.00 C ATOM 1287 C ILE A 79 -10.667 2.120 -39.753 1.00 0.00 C ATOM 1288 O ILE A 79 -11.545 2.639 -40.441 1.00 0.00 O ATOM 1289 CB ILE A 79 -11.269 1.123 -37.554 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -11.548 -0.166 -36.785 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -12.476 2.058 -37.479 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -11.753 0.043 -35.302 1.00 0.00 C ATOM 0 H ILE A 79 -9.190 -0.089 -38.238 1.00 0.00 H new ATOM 0 HA ILE A 79 -11.725 0.256 -39.484 1.00 0.00 H new ATOM 0 HB ILE A 79 -10.417 1.623 -37.094 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -12.435 -0.642 -37.202 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -10.717 -0.855 -36.934 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -12.714 2.262 -36.435 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -12.244 2.993 -37.988 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -13.332 1.586 -37.961 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -11.946 -0.917 -34.823 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.858 0.490 -34.870 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -12.603 0.706 -35.142 1.00 0.00 H new ATOM 1304 N ASP A 80 -9.451 2.625 -39.614 1.00 0.00 N ATOM 1305 CA ASP A 80 -9.057 3.883 -40.223 1.00 0.00 C ATOM 1306 C ASP A 80 -9.077 3.760 -41.738 1.00 0.00 C ATOM 1307 O ASP A 80 -9.349 4.723 -42.448 1.00 0.00 O ATOM 1308 CB ASP A 80 -7.655 4.282 -39.762 1.00 0.00 C ATOM 1309 CG ASP A 80 -7.558 4.548 -38.271 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -8.466 5.196 -37.710 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -6.564 4.121 -37.656 1.00 0.00 O1- ATOM 0 H ASP A 80 -8.711 2.174 -39.076 1.00 0.00 H new ATOM 0 HA ASP A 80 -9.765 4.652 -39.914 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -6.955 3.490 -40.027 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -7.344 5.176 -40.303 1.00 0.00 H new ATOM 1316 N LYS A 81 -8.793 2.563 -42.225 1.00 0.00 N ATOM 1317 CA LYS A 81 -8.768 2.306 -43.656 1.00 0.00 C ATOM 1318 C LYS A 81 -10.137 1.890 -44.174 1.00 0.00 C ATOM 1319 O LYS A 81 -10.330 1.759 -45.380 1.00 0.00 O ATOM 1320 CB LYS A 81 -7.745 1.220 -43.990 1.00 0.00 C ATOM 1321 CG LYS A 81 -6.329 1.546 -43.554 1.00 0.00 C ATOM 1322 CD LYS A 81 -5.849 2.854 -44.149 1.00 0.00 C ATOM 1323 CE LYS A 81 -4.397 3.126 -43.792 1.00 0.00 C ATOM 1324 NZ LYS A 81 -4.177 3.156 -42.324 1.00 0.00 N1+ ATOM 0 H LYS A 81 -8.576 1.751 -41.648 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.482 3.237 -44.146 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.054 0.288 -43.517 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.752 1.049 -45.066 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.287 1.603 -42.466 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.660 0.741 -43.857 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.959 2.825 -45.233 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.473 3.671 -43.787 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -3.765 2.357 -44.237 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -4.091 4.079 -44.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -3.226 3.525 -42.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -4.888 3.771 -41.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -4.263 2.193 -41.940 1.00 0.00 H new ATOM 1338 N GLY A 82 -11.088 1.691 -43.268 1.00 0.00 N ATOM 1339 CA GLY A 82 -12.406 1.253 -43.681 1.00 0.00 C ATOM 1340 C GLY A 82 -12.407 -0.164 -44.223 1.00 0.00 C ATOM 1341 O GLY A 82 -13.248 -0.514 -45.057 1.00 0.00 O ATOM 0 H GLY A 82 -10.971 1.824 -42.264 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.087 1.314 -42.832 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -12.787 1.931 -44.445 1.00 0.00 H new ATOM 1345 N ASP A 83 -11.471 -0.982 -43.762 1.00 0.00 N ATOM 1346 CA ASP A 83 -11.333 -2.350 -44.237 1.00 0.00 C ATOM 1347 C ASP A 83 -12.108 -3.299 -43.347 1.00 0.00 C ATOM 1348 O ASP A 83 -11.665 -3.630 -42.249 1.00 0.00 O ATOM 1349 CB ASP A 83 -9.864 -2.768 -44.302 1.00 0.00 C ATOM 1350 CG ASP A 83 -9.695 -4.172 -44.849 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -9.469 -4.319 -46.063 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -9.787 -5.128 -44.072 1.00 0.00 O1- ATOM 0 H ASP A 83 -10.789 -0.717 -43.051 1.00 0.00 H new ATOM 0 HA ASP A 83 -11.743 -2.397 -45.246 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.315 -2.066 -44.930 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.427 -2.713 -43.305 1.00 0.00 H new ATOM 1357 N LYS A 84 -13.267 -3.720 -43.808 1.00 0.00 N ATOM 1358 CA LYS A 84 -14.135 -4.563 -42.997 1.00 0.00 C ATOM 1359 C LYS A 84 -13.565 -5.977 -42.891 1.00 0.00 C ATOM 1360 O LYS A 84 -13.813 -6.689 -41.921 1.00 0.00 O ATOM 1361 CB LYS A 84 -15.538 -4.653 -43.607 1.00 0.00 C ATOM 1362 CG LYS A 84 -15.597 -5.520 -44.860 1.00 0.00 C ATOM 1363 CD LYS A 84 -16.953 -6.171 -45.025 1.00 0.00 C ATOM 1364 CE LYS A 84 -16.924 -7.260 -46.090 1.00 0.00 C ATOM 1365 NZ LYS A 84 -15.982 -8.364 -45.743 1.00 0.00 N1+ ATOM 0 H LYS A 84 -13.633 -3.497 -44.734 1.00 0.00 H new ATOM 0 HA LYS A 84 -14.195 -4.110 -42.007 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.225 -5.055 -42.863 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.885 -3.649 -43.852 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -15.377 -4.910 -45.736 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -14.827 -6.290 -44.807 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -17.270 -6.599 -44.074 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -17.690 -5.415 -45.296 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -17.927 -7.667 -46.218 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -16.633 -6.824 -47.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -16.384 -9.273 -46.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -15.073 -8.208 -46.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -15.831 -8.381 -44.714 1.00 0.00 H new ATOM 1379 N ASP A 85 -12.773 -6.356 -43.887 1.00 0.00 N ATOM 1380 CA ASP A 85 -12.289 -7.721 -44.015 1.00 0.00 C ATOM 1381 C ASP A 85 -11.346 -8.103 -42.902 1.00 0.00 C ATOM 1382 O ASP A 85 -11.507 -9.160 -42.281 1.00 0.00 O ATOM 1383 CB ASP A 85 -11.635 -7.940 -45.373 1.00 0.00 C ATOM 1384 CG ASP A 85 -12.635 -7.845 -46.500 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -13.434 -8.783 -46.675 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -12.640 -6.828 -47.210 1.00 0.00 O1- ATOM 0 H ASP A 85 -12.451 -5.728 -44.624 1.00 0.00 H new ATOM 0 HA ASP A 85 -13.159 -8.374 -43.936 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -10.849 -7.199 -45.521 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -11.158 -8.920 -45.393 1.00 0.00 H new ATOM 1391 N SER A 86 -10.373 -7.261 -42.632 1.00 0.00 N ATOM 1392 CA SER A 86 -9.427 -7.535 -41.583 1.00 0.00 C ATOM 1393 C SER A 86 -10.082 -7.401 -40.219 1.00 0.00 C ATOM 1394 O SER A 86 -9.716 -8.100 -39.288 1.00 0.00 O ATOM 1395 CB SER A 86 -8.198 -6.630 -41.701 1.00 0.00 C ATOM 1396 OG SER A 86 -8.566 -5.267 -41.795 1.00 0.00 O ATOM 0 H SER A 86 -10.220 -6.382 -43.126 1.00 0.00 H new ATOM 0 HA SER A 86 -9.088 -8.565 -41.692 1.00 0.00 H new ATOM 0 HB2 SER A 86 -7.553 -6.775 -40.834 1.00 0.00 H new ATOM 0 HB3 SER A 86 -7.619 -6.913 -42.580 1.00 0.00 H new ATOM 0 HG SER A 86 -8.681 -5.023 -42.737 1.00 0.00 H new ATOM 1402 N LEU A 87 -11.079 -6.516 -40.114 1.00 0.00 N ATOM 1403 CA LEU A 87 -11.783 -6.303 -38.850 1.00 0.00 C ATOM 1404 C LEU A 87 -12.451 -7.587 -38.396 1.00 0.00 C ATOM 1405 O LEU A 87 -12.336 -7.977 -37.234 1.00 0.00 O ATOM 1406 CB LEU A 87 -12.834 -5.197 -38.987 1.00 0.00 C ATOM 1407 CG LEU A 87 -12.300 -3.791 -39.250 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -13.445 -2.798 -39.365 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -11.344 -3.373 -38.150 1.00 0.00 C ATOM 0 H LEU A 87 -11.414 -5.940 -40.886 1.00 0.00 H new ATOM 0 HA LEU A 87 -11.049 -5.996 -38.105 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.510 -5.465 -39.799 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.428 -5.173 -38.073 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.757 -3.800 -40.195 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.045 -1.802 -39.552 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -14.097 -3.088 -40.189 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -14.015 -2.791 -38.436 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.973 -2.369 -38.353 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.865 -3.381 -37.193 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.506 -4.069 -38.112 1.00 0.00 H new ATOM 1421 N GLU A 88 -13.140 -8.246 -39.321 1.00 0.00 N ATOM 1422 CA GLU A 88 -13.804 -9.512 -39.036 1.00 0.00 C ATOM 1423 C GLU A 88 -12.798 -10.546 -38.526 1.00 0.00 C ATOM 1424 O GLU A 88 -13.040 -11.222 -37.526 1.00 0.00 O ATOM 1425 CB GLU A 88 -14.485 -10.043 -40.306 1.00 0.00 C ATOM 1426 CG GLU A 88 -15.527 -9.101 -40.897 1.00 0.00 C ATOM 1427 CD GLU A 88 -16.055 -9.581 -42.235 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -15.433 -9.274 -43.273 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -17.094 -10.266 -42.261 1.00 0.00 O1- ATOM 0 H GLU A 88 -13.253 -7.921 -40.281 1.00 0.00 H new ATOM 0 HA GLU A 88 -14.554 -9.341 -38.264 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.722 -10.240 -41.059 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -14.961 -10.996 -40.078 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -16.357 -8.999 -40.198 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -15.089 -8.110 -41.018 1.00 0.00 H new ATOM 1436 N GLN A 89 -11.665 -10.641 -39.207 1.00 0.00 N ATOM 1437 CA GLN A 89 -10.621 -11.595 -38.847 1.00 0.00 C ATOM 1438 C GLN A 89 -9.945 -11.222 -37.518 1.00 0.00 C ATOM 1439 O GLN A 89 -9.769 -12.069 -36.639 1.00 0.00 O ATOM 1440 CB GLN A 89 -9.577 -11.667 -39.969 1.00 0.00 C ATOM 1441 CG GLN A 89 -8.370 -12.533 -39.645 1.00 0.00 C ATOM 1442 CD GLN A 89 -8.728 -13.988 -39.422 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -9.663 -14.515 -40.022 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -7.995 -14.641 -38.551 1.00 0.00 N ATOM 0 H GLN A 89 -11.443 -10.065 -40.019 1.00 0.00 H new ATOM 0 HA GLN A 89 -11.087 -12.572 -38.717 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -10.055 -12.052 -40.870 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -9.235 -10.657 -40.196 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.650 -12.463 -40.460 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.880 -12.144 -38.752 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.228 -14.168 -38.074 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.193 -15.622 -38.351 1.00 0.00 H new ATOM 1453 N LEU A 90 -9.599 -9.952 -37.375 1.00 0.00 N ATOM 1454 CA LEU A 90 -8.899 -9.470 -36.190 1.00 0.00 C ATOM 1455 C LEU A 90 -9.763 -9.568 -34.950 1.00 0.00 C ATOM 1456 O LEU A 90 -9.277 -9.931 -33.885 1.00 0.00 O ATOM 1457 CB LEU A 90 -8.417 -8.032 -36.392 1.00 0.00 C ATOM 1458 CG LEU A 90 -7.317 -7.845 -37.441 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -7.074 -6.371 -37.703 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -6.032 -8.522 -36.991 1.00 0.00 C ATOM 0 H LEU A 90 -9.792 -9.230 -38.069 1.00 0.00 H new ATOM 0 HA LEU A 90 -8.031 -10.113 -36.041 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.272 -7.417 -36.674 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.053 -7.652 -35.437 1.00 0.00 H new ATOM 0 HG LEU A 90 -7.647 -8.310 -38.370 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.289 -6.259 -38.451 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.992 -5.910 -38.068 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.766 -5.883 -36.778 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.261 -8.379 -37.748 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.701 -8.085 -36.049 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.212 -9.588 -36.853 1.00 0.00 H new ATOM 1472 N LEU A 91 -11.047 -9.267 -35.092 1.00 0.00 N ATOM 1473 CA LEU A 91 -11.960 -9.316 -33.962 1.00 0.00 C ATOM 1474 C LEU A 91 -12.030 -10.723 -33.393 1.00 0.00 C ATOM 1475 O LEU A 91 -11.948 -10.910 -32.180 1.00 0.00 O ATOM 1476 CB LEU A 91 -13.360 -8.854 -34.373 1.00 0.00 C ATOM 1477 CG LEU A 91 -14.403 -8.836 -33.253 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -14.058 -7.785 -32.209 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -15.792 -8.598 -33.821 1.00 0.00 C ATOM 0 H LEU A 91 -11.476 -8.988 -35.974 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.580 -8.641 -33.195 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -13.284 -7.850 -34.791 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.719 -9.505 -35.170 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.396 -9.810 -32.764 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -14.813 -7.791 -31.423 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -13.083 -8.008 -31.776 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -14.030 -6.802 -32.678 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.520 -8.589 -33.010 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -15.814 -7.639 -34.339 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -16.040 -9.395 -34.522 1.00 0.00 H new ATOM 1491 N GLU A 92 -12.141 -11.713 -34.274 1.00 0.00 N ATOM 1492 CA GLU A 92 -12.222 -13.097 -33.843 1.00 0.00 C ATOM 1493 C GLU A 92 -10.957 -13.520 -33.117 1.00 0.00 C ATOM 1494 O GLU A 92 -11.024 -14.171 -32.073 1.00 0.00 O ATOM 1495 CB GLU A 92 -12.506 -14.032 -35.019 1.00 0.00 C ATOM 1496 CG GLU A 92 -13.881 -13.834 -35.630 1.00 0.00 C ATOM 1497 CD GLU A 92 -14.238 -14.907 -36.636 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -14.057 -14.678 -37.853 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -14.719 -15.980 -36.215 1.00 0.00 O1- ATOM 0 H GLU A 92 -12.176 -11.580 -35.285 1.00 0.00 H new ATOM 0 HA GLU A 92 -13.056 -13.172 -33.145 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -11.749 -13.876 -35.788 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -12.411 -15.065 -34.683 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -14.628 -13.824 -34.836 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -13.920 -12.859 -36.116 1.00 0.00 H new ATOM 1506 N GLU A 93 -9.807 -13.133 -33.656 1.00 0.00 N ATOM 1507 CA GLU A 93 -8.534 -13.469 -33.039 1.00 0.00 C ATOM 1508 C GLU A 93 -8.361 -12.753 -31.705 1.00 0.00 C ATOM 1509 O GLU A 93 -7.781 -13.306 -30.771 1.00 0.00 O ATOM 1510 CB GLU A 93 -7.371 -13.156 -33.975 1.00 0.00 C ATOM 1511 CG GLU A 93 -7.341 -14.031 -35.212 1.00 0.00 C ATOM 1512 CD GLU A 93 -6.115 -13.801 -36.061 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -5.044 -14.360 -35.736 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -6.212 -13.087 -37.070 1.00 0.00 O1- ATOM 0 H GLU A 93 -9.732 -12.589 -34.515 1.00 0.00 H new ATOM 0 HA GLU A 93 -8.535 -14.542 -32.847 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.431 -12.111 -34.280 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.434 -13.276 -33.431 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.378 -15.078 -34.912 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.232 -13.839 -35.809 1.00 0.00 H new ATOM 1521 N LEU A 94 -8.881 -11.531 -31.611 1.00 0.00 N ATOM 1522 CA LEU A 94 -8.816 -10.772 -30.367 1.00 0.00 C ATOM 1523 C LEU A 94 -9.601 -11.488 -29.283 1.00 0.00 C ATOM 1524 O LEU A 94 -9.134 -11.622 -28.151 1.00 0.00 O ATOM 1525 CB LEU A 94 -9.364 -9.350 -30.556 1.00 0.00 C ATOM 1526 CG LEU A 94 -8.490 -8.388 -31.365 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -9.214 -7.071 -31.588 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -7.165 -8.149 -30.656 1.00 0.00 C ATOM 0 H LEU A 94 -9.349 -11.048 -32.378 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.770 -10.697 -30.069 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -10.337 -9.420 -31.043 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -9.531 -8.914 -29.571 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.288 -8.841 -32.336 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -8.578 -6.399 -32.165 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.140 -7.253 -32.134 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.444 -6.615 -30.625 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.556 -7.463 -31.245 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.351 -7.717 -29.673 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.637 -9.096 -30.542 1.00 0.00 H new ATOM 1540 N GLU A 95 -10.802 -11.945 -29.639 1.00 0.00 N ATOM 1541 CA GLU A 95 -11.657 -12.688 -28.719 1.00 0.00 C ATOM 1542 C GLU A 95 -10.975 -13.974 -28.256 1.00 0.00 C ATOM 1543 O GLU A 95 -11.035 -14.327 -27.083 1.00 0.00 O ATOM 1544 CB GLU A 95 -12.989 -13.039 -29.387 1.00 0.00 C ATOM 1545 CG GLU A 95 -13.761 -11.843 -29.918 1.00 0.00 C ATOM 1546 CD GLU A 95 -15.045 -12.242 -30.610 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -14.980 -12.898 -31.667 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -16.130 -11.900 -30.099 1.00 0.00 O1- ATOM 0 H GLU A 95 -11.205 -11.811 -30.566 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.841 -12.051 -27.854 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -12.798 -13.727 -30.211 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -13.614 -13.569 -28.668 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.991 -11.168 -29.093 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -13.133 -11.290 -30.616 1.00 0.00 H new ATOM 1555 N GLN A 96 -10.321 -14.664 -29.183 1.00 0.00 N ATOM 1556 CA GLN A 96 -9.660 -15.932 -28.882 1.00 0.00 C ATOM 1557 C GLN A 96 -8.444 -15.720 -27.986 1.00 0.00 C ATOM 1558 O GLN A 96 -8.240 -16.442 -27.011 1.00 0.00 O ATOM 1559 CB GLN A 96 -9.235 -16.619 -30.181 1.00 0.00 C ATOM 1560 CG GLN A 96 -10.396 -17.008 -31.081 1.00 0.00 C ATOM 1561 CD GLN A 96 -9.943 -17.527 -32.431 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -8.865 -18.102 -32.558 1.00 0.00 O ATOM 1563 NE2 GLN A 96 -10.765 -17.331 -33.444 1.00 0.00 N ATOM 0 H GLN A 96 -10.233 -14.366 -30.155 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.369 -16.567 -28.350 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -8.569 -15.954 -30.731 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.662 -17.514 -29.937 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.994 -17.772 -30.585 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -11.042 -16.143 -31.228 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -11.651 -16.849 -33.296 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -10.514 -17.662 -34.376 1.00 0.00 H new ATOM 1572 N ALA A 97 -7.657 -14.714 -28.321 1.00 0.00 N ATOM 1573 CA ALA A 97 -6.444 -14.408 -27.583 1.00 0.00 C ATOM 1574 C ALA A 97 -6.770 -13.904 -26.181 1.00 0.00 C ATOM 1575 O ALA A 97 -6.162 -14.336 -25.202 1.00 0.00 O ATOM 1576 CB ALA A 97 -5.606 -13.390 -28.340 1.00 0.00 C ATOM 0 H ALA A 97 -7.838 -14.089 -29.107 1.00 0.00 H new ATOM 0 HA ALA A 97 -5.865 -15.326 -27.482 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -4.701 -13.171 -27.774 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -5.335 -13.795 -29.315 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.180 -12.473 -28.474 1.00 0.00 H new ATOM 1582 N LEU A 98 -7.758 -13.020 -26.088 1.00 0.00 N ATOM 1583 CA LEU A 98 -8.158 -12.444 -24.806 1.00 0.00 C ATOM 1584 C LEU A 98 -8.654 -13.529 -23.854 1.00 0.00 C ATOM 1585 O LEU A 98 -8.247 -13.588 -22.688 1.00 0.00 O ATOM 1586 CB LEU A 98 -9.243 -11.362 -25.024 1.00 0.00 C ATOM 1587 CG LEU A 98 -9.805 -10.673 -23.765 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -10.203 -9.244 -24.082 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -11.013 -11.433 -23.224 1.00 0.00 C ATOM 0 H LEU A 98 -8.298 -12.685 -26.886 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.287 -11.974 -24.349 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -8.828 -10.592 -25.675 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.075 -11.819 -25.560 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.024 -10.670 -23.004 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.598 -8.769 -23.184 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.330 -8.692 -24.430 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -10.967 -9.243 -24.859 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -11.392 -10.928 -22.336 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.793 -11.465 -23.984 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.717 -12.450 -22.965 1.00 0.00 H new ATOM 1601 N GLN A 99 -9.523 -14.393 -24.356 1.00 0.00 N ATOM 1602 CA GLN A 99 -10.067 -15.474 -23.553 1.00 0.00 C ATOM 1603 C GLN A 99 -8.987 -16.456 -23.119 1.00 0.00 C ATOM 1604 O GLN A 99 -9.086 -17.050 -22.048 1.00 0.00 O ATOM 1605 CB GLN A 99 -11.184 -16.202 -24.297 1.00 0.00 C ATOM 1606 CG GLN A 99 -12.407 -15.339 -24.554 1.00 0.00 C ATOM 1607 CD GLN A 99 -13.513 -16.091 -25.258 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -14.384 -16.681 -24.617 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -13.484 -16.085 -26.576 1.00 0.00 N ATOM 0 H GLN A 99 -9.866 -14.365 -25.316 1.00 0.00 H new ATOM 0 HA GLN A 99 -10.487 -15.024 -22.653 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -10.798 -16.564 -25.250 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.482 -17.078 -23.721 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -12.781 -14.954 -23.605 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -12.119 -14.477 -25.156 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -12.744 -15.583 -27.068 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -14.201 -16.582 -27.104 1.00 0.00 H new ATOM 1618 N LYS A 100 -7.945 -16.613 -23.932 1.00 0.00 N ATOM 1619 CA LYS A 100 -6.873 -17.543 -23.616 1.00 0.00 C ATOM 1620 C LYS A 100 -6.021 -16.997 -22.472 1.00 0.00 C ATOM 1621 O LYS A 100 -5.675 -17.719 -21.539 1.00 0.00 O ATOM 1622 CB LYS A 100 -5.996 -17.784 -24.851 1.00 0.00 C ATOM 1623 CG LYS A 100 -4.943 -18.869 -24.666 1.00 0.00 C ATOM 1624 CD LYS A 100 -4.003 -18.937 -25.860 1.00 0.00 C ATOM 1625 CE LYS A 100 -3.022 -20.097 -25.740 1.00 0.00 C ATOM 1626 NZ LYS A 100 -3.691 -21.415 -25.898 1.00 0.00 N1+ ATOM 0 H LYS A 100 -7.824 -16.109 -24.810 1.00 0.00 H new ATOM 0 HA LYS A 100 -7.315 -18.490 -23.308 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.636 -18.054 -25.691 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -5.498 -16.852 -25.117 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -4.370 -18.672 -23.760 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -5.432 -19.834 -24.530 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -4.585 -19.046 -26.775 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -3.451 -18.001 -25.942 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -2.244 -19.993 -26.497 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.529 -20.055 -24.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -2.972 -22.162 -25.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -4.292 -21.601 -25.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -4.278 -21.406 -26.756 1.00 0.00 H new ATOM 1640 N ILE A 101 -5.703 -15.706 -22.555 1.00 0.00 N ATOM 1641 CA ILE A 101 -4.869 -15.040 -21.555 1.00 0.00 C ATOM 1642 C ILE A 101 -5.544 -15.061 -20.192 1.00 0.00 C ATOM 1643 O ILE A 101 -4.919 -15.398 -19.179 1.00 0.00 O ATOM 1644 CB ILE A 101 -4.583 -13.572 -21.952 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -3.836 -13.523 -23.281 1.00 0.00 C ATOM 1646 CG2 ILE A 101 -3.773 -12.869 -20.863 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -3.670 -12.127 -23.838 1.00 0.00 C ATOM 0 H ILE A 101 -6.013 -15.096 -23.311 1.00 0.00 H new ATOM 0 HA ILE A 101 -3.926 -15.585 -21.505 1.00 0.00 H new ATOM 0 HB ILE A 101 -5.534 -13.052 -22.063 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.851 -13.971 -23.150 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -4.370 -14.133 -24.010 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -3.582 -11.838 -21.160 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -4.334 -12.879 -19.928 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -2.825 -13.388 -20.723 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -3.130 -12.174 -24.783 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -4.651 -11.682 -24.003 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -3.109 -11.517 -23.130 1.00 0.00 H new ATOM 1659 N ARG A 102 -6.827 -14.719 -20.175 1.00 0.00 N ATOM 1660 CA ARG A 102 -7.604 -14.691 -18.945 1.00 0.00 C ATOM 1661 C ARG A 102 -7.598 -16.058 -18.263 1.00 0.00 C ATOM 1662 O ARG A 102 -7.459 -16.148 -17.047 1.00 0.00 O ATOM 1663 CB ARG A 102 -9.043 -14.272 -19.255 1.00 0.00 C ATOM 1664 CG ARG A 102 -9.935 -14.149 -18.032 1.00 0.00 C ATOM 1665 CD ARG A 102 -11.397 -13.994 -18.431 1.00 0.00 C ATOM 1666 NE ARG A 102 -12.284 -13.902 -17.270 1.00 0.00 N ATOM 1667 CZ ARG A 102 -12.569 -14.919 -16.449 1.00 0.00 C ATOM 1668 NH1 ARG A 102 -12.044 -16.128 -16.657 1.00 0.00 N1+ ATOM 1669 NH2 ARG A 102 -13.397 -14.729 -15.432 1.00 0.00 N ATOM 0 H ARG A 102 -7.353 -14.455 -21.008 1.00 0.00 H new ATOM 0 HA ARG A 102 -7.150 -13.969 -18.267 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.026 -13.315 -19.776 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.482 -14.999 -19.939 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.818 -15.032 -17.403 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.625 -13.290 -17.437 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -11.511 -13.100 -19.044 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.695 -14.843 -19.047 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.715 -12.999 -17.073 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.419 -16.283 -17.448 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -12.268 -16.897 -16.025 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -13.814 -13.811 -15.278 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.618 -15.501 -14.803 1.00 0.00 H new ATOM 1683 N GLU A 103 -7.724 -17.112 -19.053 1.00 0.00 N ATOM 1684 CA GLU A 103 -7.741 -18.465 -18.517 1.00 0.00 C ATOM 1685 C GLU A 103 -6.392 -18.872 -17.941 1.00 0.00 C ATOM 1686 O GLU A 103 -6.327 -19.674 -17.008 1.00 0.00 O ATOM 1687 CB GLU A 103 -8.217 -19.473 -19.560 1.00 0.00 C ATOM 1688 CG GLU A 103 -9.678 -19.298 -19.938 1.00 0.00 C ATOM 1689 CD GLU A 103 -10.571 -19.165 -18.719 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -10.843 -20.191 -18.061 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -10.996 -18.026 -18.413 1.00 0.00 O1- ATOM 0 H GLU A 103 -7.816 -17.058 -20.067 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.457 -18.467 -17.695 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -7.603 -19.377 -20.455 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.066 -20.482 -19.176 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.786 -18.413 -20.564 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.003 -20.151 -20.533 1.00 0.00 H new ATOM 1698 N LEU A 104 -5.311 -18.335 -18.491 1.00 0.00 N ATOM 1699 CA LEU A 104 -3.982 -18.654 -17.993 1.00 0.00 C ATOM 1700 C LEU A 104 -3.747 -17.971 -16.655 1.00 0.00 C ATOM 1701 O LEU A 104 -3.253 -18.581 -15.706 1.00 0.00 O ATOM 1702 CB LEU A 104 -2.914 -18.191 -18.993 1.00 0.00 C ATOM 1703 CG LEU A 104 -2.930 -18.873 -20.360 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -1.930 -18.213 -21.297 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -2.624 -20.351 -20.217 1.00 0.00 C ATOM 0 H LEU A 104 -5.328 -17.683 -19.275 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.912 -19.734 -17.866 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.028 -17.118 -19.144 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.933 -18.347 -18.544 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.927 -18.765 -20.788 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.955 -18.712 -22.266 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.189 -17.162 -21.423 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.928 -18.292 -20.874 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.639 -20.822 -21.200 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.638 -20.477 -19.769 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.374 -20.818 -19.579 1.00 0.00 H new ATOM 1717 N ALA A 105 -4.143 -16.710 -16.580 1.00 0.00 N ATOM 1718 CA ALA A 105 -3.942 -15.907 -15.385 1.00 0.00 C ATOM 1719 C ALA A 105 -4.892 -16.306 -14.260 1.00 0.00 C ATOM 1720 O ALA A 105 -4.539 -16.218 -13.079 1.00 0.00 O ATOM 1721 CB ALA A 105 -4.098 -14.437 -15.716 1.00 0.00 C ATOM 0 H ALA A 105 -4.610 -16.217 -17.341 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.928 -16.091 -15.029 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.946 -13.843 -14.815 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.361 -14.153 -16.467 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.100 -14.256 -16.105 1.00 0.00 H new ATOM 1727 N GLU A 106 -6.087 -16.762 -14.620 1.00 0.00 N ATOM 1728 CA GLU A 106 -7.089 -17.127 -13.624 1.00 0.00 C ATOM 1729 C GLU A 106 -6.852 -18.542 -13.099 1.00 0.00 C ATOM 1730 O GLU A 106 -7.494 -18.981 -12.141 1.00 0.00 O ATOM 1731 CB GLU A 106 -8.510 -16.978 -14.192 1.00 0.00 C ATOM 1732 CG GLU A 106 -9.610 -17.187 -13.159 1.00 0.00 C ATOM 1733 CD GLU A 106 -10.986 -16.885 -13.694 1.00 0.00 C ATOM 1734 OE1 GLU A 106 -11.512 -15.792 -13.396 1.00 0.00 O ATOM 1735 OE2 GLU A 106 -11.557 -17.738 -14.414 1.00 0.00 O1- ATOM 0 H GLU A 106 -6.385 -16.887 -15.588 1.00 0.00 H new ATOM 0 HA GLU A 106 -6.991 -16.440 -12.784 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -8.616 -15.983 -14.625 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -8.644 -17.695 -15.002 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -9.581 -18.219 -12.809 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -9.415 -16.552 -12.295 1.00 0.00 H new ATOM 1742 N LYS A 107 -5.939 -19.257 -13.728 1.00 0.00 N ATOM 1743 CA LYS A 107 -5.594 -20.591 -13.277 1.00 0.00 C ATOM 1744 C LYS A 107 -4.794 -20.514 -11.982 1.00 0.00 C ATOM 1745 O LYS A 107 -3.591 -20.215 -12.002 1.00 0.00 O ATOM 1746 CB LYS A 107 -4.799 -21.343 -14.340 1.00 0.00 C ATOM 1747 CG LYS A 107 -4.466 -22.771 -13.947 1.00 0.00 C ATOM 1748 CD LYS A 107 -3.574 -23.433 -14.971 1.00 0.00 C ATOM 1749 CE LYS A 107 -3.256 -24.864 -14.584 1.00 0.00 C ATOM 1750 NZ LYS A 107 -2.329 -25.498 -15.546 1.00 0.00 N1+ ATOM 0 H LYS A 107 -5.425 -18.938 -14.549 1.00 0.00 H new ATOM 0 HA LYS A 107 -6.519 -21.138 -13.096 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.369 -21.353 -15.269 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -3.873 -20.804 -14.540 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -3.972 -22.776 -12.975 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.387 -23.344 -13.840 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -4.062 -23.418 -15.945 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.648 -22.867 -15.070 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.815 -24.882 -13.588 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.179 -25.441 -14.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.135 -26.475 -15.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.761 -25.503 -16.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.438 -24.962 -15.575 1.00 0.00 H new ATOM 1764 N LYS A 108 -5.477 -20.776 -10.863 1.00 0.00 N ATOM 1765 CA LYS A 108 -4.893 -20.713 -9.520 1.00 0.00 C ATOM 1766 C LYS A 108 -4.557 -19.277 -9.108 1.00 0.00 C ATOM 1767 O LYS A 108 -4.113 -18.458 -9.920 1.00 0.00 O ATOM 1768 CB LYS A 108 -3.642 -21.598 -9.397 1.00 0.00 C ATOM 1769 CG LYS A 108 -3.027 -21.578 -8.005 1.00 0.00 C ATOM 1770 CD LYS A 108 -1.656 -22.218 -7.983 1.00 0.00 C ATOM 1771 CE LYS A 108 -1.023 -22.109 -6.604 1.00 0.00 C ATOM 1772 NZ LYS A 108 -0.908 -20.692 -6.150 1.00 0.00 N1+ ATOM 0 H LYS A 108 -6.462 -21.041 -10.865 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.654 -21.096 -8.840 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -3.904 -22.624 -9.657 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -2.898 -21.266 -10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -2.952 -20.548 -7.656 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.683 -22.103 -7.311 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -1.736 -23.267 -8.268 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -1.014 -21.736 -8.720 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.620 -22.672 -5.886 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.033 -22.565 -6.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.269 -20.641 -5.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.528 -20.110 -6.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -1.847 -20.337 -5.879 1.00 0.00 H new ATOM 1786 N ASN A 109 -4.784 -18.978 -7.854 1.00 0.00 N ATOM 1787 CA ASN A 109 -4.456 -17.687 -7.306 1.00 0.00 C ATOM 1788 C ASN A 109 -3.177 -17.781 -6.487 1.00 0.00 C ATOM 1789 O ASN A 109 -2.181 -17.137 -6.863 1.00 0.00 O ATOM 1790 CB ASN A 109 -5.620 -17.119 -6.467 1.00 0.00 C ATOM 1791 CG ASN A 109 -6.064 -18.027 -5.321 1.00 0.00 C ATOM 1792 OD1 ASN A 109 -5.966 -19.257 -5.397 1.00 0.00 O ATOM 1793 ND2 ASN A 109 -6.563 -17.424 -4.257 1.00 0.00 N ATOM 1794 OXT ASN A 109 -3.152 -18.546 -5.502 1.00 0.00 O ATOM 0 H ASN A 109 -5.202 -19.624 -7.184 1.00 0.00 H new ATOM 0 HA ASN A 109 -4.290 -16.994 -8.130 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -5.321 -16.154 -6.057 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -6.471 -16.937 -7.123 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.883 -17.976 -3.461 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -6.628 -16.406 -4.231 1.00 0.00 H new TER 1801 ASN A 109 HETATM 1802 NA1 7BU A 201 -0.858 -8.858 -18.970 1.00 0.00 N HETATM 1803 NB2 7BU A 201 -3.039 -8.521 -20.808 1.00 0.00 N HETATM 1804 ND4 7BU A 201 -2.579 -10.224 -17.104 1.00 0.00 N HETATM 1805 CHA 7BU A 201 -0.110 -10.279 -17.064 1.00 0.00 C HETATM 1806 CHB 7BU A 201 -0.888 -7.305 -20.906 1.00 0.00 C HETATM 1807 CHC 7BU A 201 -5.220 -9.522 -21.370 1.00 0.00 C HETATM 1808 CHD 7BU A 201 -4.973 -10.590 -16.587 1.00 0.00 C HETATM 1809 C1A 7BU A 201 0.120 -9.382 -18.154 1.00 0.00 C HETATM 1810 C1B 7BU A 201 -2.167 -7.654 -21.426 1.00 0.00 C HETATM 1811 C1C 7BU A 201 -5.570 -9.974 -20.065 1.00 0.00 C HETATM 1812 C1D 7BU A 201 -3.585 -10.652 -16.268 1.00 0.00 C HETATM 1813 C1FA 7BU A 201 1.168 -10.803 -16.369 1.00 0.00 C HETATM 1814 C1FB 7BU A 201 -0.059 -6.232 -21.631 1.00 0.00 C HETATM 1815 C1FC 7BU A 201 -6.299 -9.757 -22.434 1.00 0.00 C HETATM 1816 C1FD 7BU A 201 -5.993 -10.946 -15.495 1.00 0.00 C HETATM 1817 C2A 7BU A 201 1.405 -8.792 -18.512 1.00 0.00 C HETATM 1818 C2B 7BU A 201 -2.687 -7.309 -22.742 1.00 0.00 C HETATM 1819 C2C 7BU A 201 -6.894 -10.437 -19.654 1.00 0.00 C HETATM 1820 C2D 7BU A 201 -2.997 -11.309 -15.112 1.00 0.00 C HETATM 1821 C3A 7BU A 201 1.182 -7.928 -19.528 1.00 0.00 C HETATM 1822 C3B 7BU A 201 -3.853 -7.974 -22.896 1.00 0.00 C HETATM 1823 C3C 7BU A 201 -6.842 -10.669 -18.325 1.00 0.00 C HETATM 1824 C3D 7BU A 201 -1.655 -11.283 -15.276 1.00 0.00 C HETATM 1825 C4A 7BU A 201 -0.243 -7.972 -19.821 1.00 0.00 C HETATM 1826 C4B 7BU A 201 -4.082 -8.741 -21.681 1.00 0.00 C HETATM 1827 C4C 7BU A 201 -5.489 -10.359 -17.889 1.00 0.00 C HETATM 1828 C4D 7BU A 201 -1.382 -10.601 -16.530 1.00 0.00 C HETATM 1829 NC3 7BU A 201 -4.744 -9.942 -18.968 1.00 0.00 N HETATM 1830 F21A 7BU A 201 1.652 -9.905 -15.484 1.00 0.00 F HETATM 1831 F21B 7BU A 201 -0.840 -5.320 -22.265 1.00 0.00 F HETATM 1832 F21C 7BU A 201 -5.870 -9.694 -23.710 1.00 0.00 F HETATM 1833 F21D 7BU A 201 -7.080 -10.141 -15.505 1.00 0.00 F HETATM 1834 F22A 7BU A 201 2.175 -11.019 -17.247 1.00 0.00 F HETATM 1835 F22B 7BU A 201 0.756 -6.734 -22.588 1.00 0.00 F HETATM 1836 F22C 7BU A 201 -6.868 -10.979 -22.313 1.00 0.00 F HETATM 1837 F22D 7BU A 201 -5.469 -10.824 -14.253 1.00 0.00 F HETATM 1838 F23A 7BU A 201 1.011 -11.958 -15.686 1.00 0.00 F HETATM 1839 F23B 7BU A 201 0.724 -5.536 -20.778 1.00 0.00 F HETATM 1840 F23C 7BU A 201 -7.296 -8.849 -22.326 1.00 0.00 F HETATM 1841 F23D 7BU A 201 -6.445 -12.217 -15.610 1.00 0.00 F HETATM 1842 ZN 7BU A 201 -2.913 -9.006 -18.780 1.00 0.00 ZN