USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 680 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 44 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 26 THR OG1 : rot 54:sc= 0.991 USER MOD Set 2.2: A 32 THR OG1 : rot 98:sc= 0.0492 USER MOD Set 3.1: A 24 TYR OH : rot 150:sc= -0.457 USER MOD Set 3.2: A 38 SER OG : rot 170:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0.0974 USER MOD Single : A 13 THR OG1 : rot 79:sc= 1.2 USER MOD Single : A 21 SER OG : rot 70:sc= 0.188 USER MOD Single : A 22 LYS NZ :NH3+ 167:sc= -0.0191 (180deg=-0.244) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl -141:sc= -0.0323 (180deg=-0.804) USER MOD Single : A 51 HIS : no HD1:sc= -0.243 K(o=-0.24,f=-12!) USER MOD Single : A 52 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.6!) USER MOD Single : A 57 ASN : amide:sc= -0.56 K(o=-0.56,f=-2.8!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.597 K(o=-0.6,f=-0.018) USER MOD Single : A 67 ASN : amide:sc= 0.14 X(o=0.14,f=-0.045) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.188 X(o=-0.19,f=-0.11) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=-0.0013) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N GLU A 2 1.838 1.136 -3.250 1.00 0.00 N ATOM 19 CA GLU A 2 0.947 1.002 -4.396 1.00 0.00 C ATOM 20 C GLU A 2 1.491 -0.019 -5.392 1.00 0.00 C ATOM 21 O GLU A 2 2.571 -0.578 -5.198 1.00 0.00 O ATOM 22 CB GLU A 2 0.759 2.354 -5.086 1.00 0.00 C ATOM 23 CG GLU A 2 1.914 2.738 -5.997 1.00 0.00 C ATOM 24 CD GLU A 2 1.823 4.173 -6.480 1.00 0.00 C ATOM 25 OE1 GLU A 2 0.699 4.714 -6.527 1.00 0.00 O ATOM 26 OE2 GLU A 2 2.878 4.754 -6.811 1.00 0.00 O ATOM 0 HA GLU A 2 -0.019 0.651 -4.033 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -0.161 2.330 -5.670 1.00 0.00 H new ATOM 0 HB3 GLU A 2 0.634 3.126 -4.327 1.00 0.00 H new ATOM 0 HG2 GLU A 2 2.855 2.597 -5.465 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.931 2.069 -6.858 1.00 0.00 H new ATOM 33 N LEU A 3 0.735 -0.257 -6.458 1.00 0.00 N ATOM 34 CA LEU A 3 1.140 -1.210 -7.486 1.00 0.00 C ATOM 35 C LEU A 3 1.383 -0.506 -8.817 1.00 0.00 C ATOM 36 O LEU A 3 0.494 0.157 -9.351 1.00 0.00 O ATOM 37 CB LEU A 3 0.071 -2.291 -7.656 1.00 0.00 C ATOM 38 CG LEU A 3 0.549 -3.736 -7.510 1.00 0.00 C ATOM 39 CD1 LEU A 3 -0.607 -4.644 -7.120 1.00 0.00 C ATOM 40 CD2 LEU A 3 1.195 -4.217 -8.802 1.00 0.00 C ATOM 0 H LEU A 3 -0.162 0.197 -6.633 1.00 0.00 H new ATOM 0 HA LEU A 3 2.073 -1.676 -7.167 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.716 -2.114 -6.923 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -0.380 -2.176 -8.642 1.00 0.00 H new ATOM 0 HG LEU A 3 1.296 -3.773 -6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.248 -5.668 -7.021 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -1.025 -4.313 -6.170 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.378 -4.603 -7.890 1.00 0.00 H new ATOM 0 HD21 LEU A 3 1.529 -5.247 -8.680 1.00 0.00 H new ATOM 0 HD22 LEU A 3 0.469 -4.165 -9.613 1.00 0.00 H new ATOM 0 HD23 LEU A 3 2.050 -3.584 -9.039 1.00 0.00 H new ATOM 52 N ALA A 4 2.592 -0.655 -9.347 1.00 0.00 N ATOM 53 CA ALA A 4 2.951 -0.037 -10.618 1.00 0.00 C ATOM 54 C ALA A 4 3.477 -1.075 -11.604 1.00 0.00 C ATOM 55 O ALA A 4 4.394 -1.835 -11.290 1.00 0.00 O ATOM 56 CB ALA A 4 3.984 1.058 -10.399 1.00 0.00 C ATOM 0 H ALA A 4 3.340 -1.198 -8.916 1.00 0.00 H new ATOM 0 HA ALA A 4 2.052 0.408 -11.045 1.00 0.00 H new ATOM 0 HB1 ALA A 4 4.243 1.511 -11.356 1.00 0.00 H new ATOM 0 HB2 ALA A 4 3.572 1.820 -9.737 1.00 0.00 H new ATOM 0 HB3 ALA A 4 4.878 0.629 -9.947 1.00 0.00 H new ATOM 62 N VAL A 5 2.892 -1.101 -12.797 1.00 0.00 N ATOM 63 CA VAL A 5 3.303 -2.046 -13.829 1.00 0.00 C ATOM 64 C VAL A 5 3.533 -1.339 -15.160 1.00 0.00 C ATOM 65 O VAL A 5 2.904 -0.321 -15.451 1.00 0.00 O ATOM 66 CB VAL A 5 2.253 -3.156 -14.024 1.00 0.00 C ATOM 67 CG1 VAL A 5 2.902 -4.413 -14.583 1.00 0.00 C ATOM 68 CG2 VAL A 5 1.541 -3.451 -12.713 1.00 0.00 C ATOM 0 H VAL A 5 2.132 -0.479 -13.073 1.00 0.00 H new ATOM 0 HA VAL A 5 4.237 -2.496 -13.493 1.00 0.00 H new ATOM 0 HB VAL A 5 1.511 -2.809 -14.744 1.00 0.00 H new ATOM 0 HG11 VAL A 5 2.145 -5.186 -14.714 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.361 -4.188 -15.546 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.666 -4.767 -13.891 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.803 -4.237 -12.869 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.268 -3.778 -11.970 1.00 0.00 H new ATOM 0 HG23 VAL A 5 1.041 -2.549 -12.359 1.00 0.00 H new ATOM 78 N ILE A 6 4.437 -1.886 -15.965 1.00 0.00 N ATOM 79 CA ILE A 6 4.749 -1.309 -17.267 1.00 0.00 C ATOM 80 C ILE A 6 4.752 -2.377 -18.355 1.00 0.00 C ATOM 81 O ILE A 6 5.689 -3.167 -18.462 1.00 0.00 O ATOM 82 CB ILE A 6 6.116 -0.600 -17.255 1.00 0.00 C ATOM 83 CG1 ILE A 6 6.129 0.513 -16.206 1.00 0.00 C ATOM 84 CG2 ILE A 6 6.434 -0.040 -18.634 1.00 0.00 C ATOM 85 CD1 ILE A 6 7.513 0.844 -15.692 1.00 0.00 C ATOM 0 H ILE A 6 4.966 -2.728 -15.739 1.00 0.00 H new ATOM 0 HA ILE A 6 3.971 -0.577 -17.483 1.00 0.00 H new ATOM 0 HB ILE A 6 6.884 -1.328 -16.994 1.00 0.00 H new ATOM 0 HG12 ILE A 6 5.686 1.411 -16.636 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.500 0.217 -15.367 1.00 0.00 H new ATOM 0 HG21 ILE A 6 7.403 0.458 -18.610 1.00 0.00 H new ATOM 0 HG22 ILE A 6 6.462 -0.853 -19.359 1.00 0.00 H new ATOM 0 HG23 ILE A 6 5.665 0.677 -18.922 1.00 0.00 H new ATOM 0 HD11 ILE A 6 7.445 1.641 -14.952 1.00 0.00 H new ATOM 0 HD12 ILE A 6 7.952 -0.042 -15.232 1.00 0.00 H new ATOM 0 HD13 ILE A 6 8.140 1.171 -16.521 1.00 0.00 H new ATOM 97 N GLY A 7 3.696 -2.393 -19.164 1.00 0.00 N ATOM 98 CA GLY A 7 3.598 -3.367 -20.235 1.00 0.00 C ATOM 99 C GLY A 7 3.073 -2.762 -21.522 1.00 0.00 C ATOM 100 O GLY A 7 3.536 -1.706 -21.955 1.00 0.00 O ATOM 0 H GLY A 7 2.908 -1.749 -19.096 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.580 -3.803 -20.416 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.941 -4.179 -19.924 1.00 0.00 H new ATOM 104 N LYS A 8 2.104 -3.432 -22.137 1.00 0.00 N ATOM 105 CA LYS A 8 1.515 -2.955 -23.383 1.00 0.00 C ATOM 106 C LYS A 8 0.064 -2.536 -23.173 1.00 0.00 C ATOM 107 O LYS A 8 -0.432 -2.523 -22.046 1.00 0.00 O ATOM 108 CB LYS A 8 1.593 -4.042 -24.457 1.00 0.00 C ATOM 109 CG LYS A 8 0.946 -5.353 -24.043 1.00 0.00 C ATOM 110 CD LYS A 8 1.149 -6.431 -25.095 1.00 0.00 C ATOM 111 CE LYS A 8 0.710 -7.796 -24.586 1.00 0.00 C ATOM 112 NZ LYS A 8 1.873 -8.663 -24.251 1.00 0.00 N ATOM 0 H LYS A 8 1.710 -4.307 -21.793 1.00 0.00 H new ATOM 0 HA LYS A 8 2.082 -2.085 -23.714 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.111 -3.679 -25.365 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.639 -4.224 -24.702 1.00 0.00 H new ATOM 0 HG2 LYS A 8 1.368 -5.685 -23.094 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.121 -5.198 -23.880 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.584 -6.177 -25.992 1.00 0.00 H new ATOM 0 HD3 LYS A 8 2.200 -6.469 -25.381 1.00 0.00 H new ATOM 0 HE2 LYS A 8 0.084 -7.670 -23.702 1.00 0.00 H new ATOM 0 HE3 LYS A 8 0.098 -8.286 -25.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 1.532 -9.584 -23.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 2.457 -8.804 -25.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.444 -8.207 -23.511 1.00 0.00 H new ATOM 126 N SER A 9 -0.613 -2.194 -24.265 1.00 0.00 N ATOM 127 CA SER A 9 -2.007 -1.773 -24.199 1.00 0.00 C ATOM 128 C SER A 9 -2.911 -2.941 -23.817 1.00 0.00 C ATOM 129 O SER A 9 -3.967 -2.750 -23.215 1.00 0.00 O ATOM 130 CB SER A 9 -2.449 -1.190 -25.543 1.00 0.00 C ATOM 131 OG SER A 9 -1.477 -1.426 -26.546 1.00 0.00 O ATOM 0 H SER A 9 -0.218 -2.200 -25.206 1.00 0.00 H new ATOM 0 HA SER A 9 -2.092 -1.004 -23.431 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.399 -1.634 -25.841 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.617 -0.118 -25.440 1.00 0.00 H new ATOM 0 HG SER A 9 -1.784 -1.045 -27.395 1.00 0.00 H new ATOM 137 N GLU A 10 -2.487 -4.150 -24.171 1.00 0.00 N ATOM 138 CA GLU A 10 -3.258 -5.349 -23.866 1.00 0.00 C ATOM 139 C GLU A 10 -3.142 -5.709 -22.388 1.00 0.00 C ATOM 140 O GLU A 10 -4.079 -6.239 -21.791 1.00 0.00 O ATOM 141 CB GLU A 10 -2.781 -6.521 -24.726 1.00 0.00 C ATOM 142 CG GLU A 10 -2.816 -6.235 -26.218 1.00 0.00 C ATOM 143 CD GLU A 10 -4.219 -5.970 -26.728 1.00 0.00 C ATOM 144 OE1 GLU A 10 -4.994 -6.939 -26.869 1.00 0.00 O ATOM 145 OE2 GLU A 10 -4.543 -4.791 -26.987 1.00 0.00 O ATOM 0 H GLU A 10 -1.614 -4.325 -24.669 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.305 -5.144 -24.091 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.762 -6.781 -24.438 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.403 -7.391 -24.517 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.186 -5.372 -26.434 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -2.392 -7.082 -26.757 1.00 0.00 H new ATOM 152 N PHE A 11 -1.985 -5.417 -21.803 1.00 0.00 N ATOM 153 CA PHE A 11 -1.744 -5.711 -20.395 1.00 0.00 C ATOM 154 C PHE A 11 -2.569 -4.792 -19.499 1.00 0.00 C ATOM 155 O PHE A 11 -3.311 -5.254 -18.631 1.00 0.00 O ATOM 156 CB PHE A 11 -0.257 -5.560 -20.067 1.00 0.00 C ATOM 157 CG PHE A 11 0.380 -6.829 -19.577 1.00 0.00 C ATOM 158 CD1 PHE A 11 0.290 -7.194 -18.243 1.00 0.00 C ATOM 159 CD2 PHE A 11 1.069 -7.657 -20.449 1.00 0.00 C ATOM 160 CE1 PHE A 11 0.876 -8.361 -17.789 1.00 0.00 C ATOM 161 CE2 PHE A 11 1.656 -8.824 -20.000 1.00 0.00 C ATOM 162 CZ PHE A 11 1.559 -9.177 -18.669 1.00 0.00 C ATOM 0 H PHE A 11 -1.199 -4.977 -22.282 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.047 -6.741 -20.208 1.00 0.00 H new ATOM 0 HB2 PHE A 11 0.271 -5.218 -20.958 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -0.137 -4.786 -19.309 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.244 -6.560 -17.551 1.00 0.00 H new ATOM 0 HD2 PHE A 11 1.148 -7.387 -21.492 1.00 0.00 H new ATOM 0 HE1 PHE A 11 0.800 -8.634 -16.747 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.191 -9.460 -20.690 1.00 0.00 H new ATOM 0 HZ PHE A 11 2.016 -10.090 -18.317 1.00 0.00 H new ATOM 172 N VAL A 12 -2.435 -3.487 -19.715 1.00 0.00 N ATOM 173 CA VAL A 12 -3.167 -2.502 -18.929 1.00 0.00 C ATOM 174 C VAL A 12 -4.656 -2.830 -18.886 1.00 0.00 C ATOM 175 O VAL A 12 -5.293 -2.745 -17.836 1.00 0.00 O ATOM 176 CB VAL A 12 -2.981 -1.082 -19.494 1.00 0.00 C ATOM 177 CG1 VAL A 12 -1.567 -0.585 -19.236 1.00 0.00 C ATOM 178 CG2 VAL A 12 -3.302 -1.054 -20.981 1.00 0.00 C ATOM 0 H VAL A 12 -1.825 -3.088 -20.429 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.761 -2.538 -17.918 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.674 -0.413 -18.983 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.455 0.420 -19.643 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.378 -0.565 -18.163 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.853 -1.253 -19.718 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.165 -0.043 -21.364 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.636 -1.735 -21.510 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -4.335 -1.364 -21.136 1.00 0.00 H new ATOM 188 N THR A 13 -5.206 -3.206 -20.037 1.00 0.00 N ATOM 189 CA THR A 13 -6.620 -3.546 -20.132 1.00 0.00 C ATOM 190 C THR A 13 -7.019 -4.546 -19.053 1.00 0.00 C ATOM 191 O THR A 13 -8.149 -4.531 -18.566 1.00 0.00 O ATOM 192 CB THR A 13 -6.965 -4.133 -21.514 1.00 0.00 C ATOM 193 OG1 THR A 13 -6.548 -3.233 -22.546 1.00 0.00 O ATOM 194 CG2 THR A 13 -8.459 -4.394 -21.634 1.00 0.00 C ATOM 0 H THR A 13 -4.694 -3.283 -20.916 1.00 0.00 H new ATOM 0 HA THR A 13 -7.178 -2.621 -19.989 1.00 0.00 H new ATOM 0 HB THR A 13 -6.437 -5.080 -21.624 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.582 -3.321 -22.686 1.00 0.00 H new ATOM 0 HG21 THR A 13 -8.678 -4.808 -22.618 1.00 0.00 H new ATOM 0 HG22 THR A 13 -8.767 -5.102 -20.865 1.00 0.00 H new ATOM 0 HG23 THR A 13 -9.003 -3.459 -21.505 1.00 0.00 H new ATOM 202 N GLY A 14 -6.084 -5.416 -18.684 1.00 0.00 N ATOM 203 CA GLY A 14 -6.358 -6.411 -17.664 1.00 0.00 C ATOM 204 C GLY A 14 -6.683 -5.790 -16.320 1.00 0.00 C ATOM 205 O GLY A 14 -7.644 -6.187 -15.661 1.00 0.00 O ATOM 0 H GLY A 14 -5.142 -5.449 -19.073 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -7.193 -7.034 -17.984 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.493 -7.066 -17.558 1.00 0.00 H new ATOM 209 N PHE A 15 -5.879 -4.814 -15.911 1.00 0.00 N ATOM 210 CA PHE A 15 -6.085 -4.138 -14.635 1.00 0.00 C ATOM 211 C PHE A 15 -7.293 -3.208 -14.701 1.00 0.00 C ATOM 212 O PHE A 15 -8.104 -3.160 -13.776 1.00 0.00 O ATOM 213 CB PHE A 15 -4.836 -3.345 -14.247 1.00 0.00 C ATOM 214 CG PHE A 15 -4.942 -1.876 -14.545 1.00 0.00 C ATOM 215 CD1 PHE A 15 -5.735 -1.052 -13.763 1.00 0.00 C ATOM 216 CD2 PHE A 15 -4.249 -1.320 -15.608 1.00 0.00 C ATOM 217 CE1 PHE A 15 -5.834 0.299 -14.036 1.00 0.00 C ATOM 218 CE2 PHE A 15 -4.344 0.030 -15.886 1.00 0.00 C ATOM 219 CZ PHE A 15 -5.137 0.841 -15.098 1.00 0.00 C ATOM 0 H PHE A 15 -5.079 -4.474 -16.444 1.00 0.00 H new ATOM 0 HA PHE A 15 -6.275 -4.897 -13.876 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -4.647 -3.479 -13.182 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -3.976 -3.754 -14.777 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -6.282 -1.470 -12.931 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -3.627 -1.950 -16.227 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -6.456 0.931 -13.419 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.799 0.450 -16.718 1.00 0.00 H new ATOM 0 HZ PHE A 15 -5.212 1.897 -15.312 1.00 0.00 H new ATOM 229 N ARG A 16 -7.404 -2.470 -15.801 1.00 0.00 N ATOM 230 CA ARG A 16 -8.511 -1.539 -15.987 1.00 0.00 C ATOM 231 C ARG A 16 -9.828 -2.162 -15.532 1.00 0.00 C ATOM 232 O ARG A 16 -10.729 -1.463 -15.068 1.00 0.00 O ATOM 233 CB ARG A 16 -8.613 -1.122 -17.456 1.00 0.00 C ATOM 234 CG ARG A 16 -7.949 0.211 -17.757 1.00 0.00 C ATOM 235 CD ARG A 16 -7.821 0.444 -19.255 1.00 0.00 C ATOM 236 NE ARG A 16 -8.158 1.815 -19.627 1.00 0.00 N ATOM 237 CZ ARG A 16 -7.353 2.852 -19.419 1.00 0.00 C ATOM 238 NH1 ARG A 16 -6.171 2.673 -18.845 1.00 0.00 N ATOM 239 NH2 ARG A 16 -7.731 4.070 -19.785 1.00 0.00 N ATOM 0 H ARG A 16 -6.742 -2.499 -16.576 1.00 0.00 H new ATOM 0 HA ARG A 16 -8.317 -0.656 -15.378 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -8.158 -1.894 -18.077 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.665 -1.066 -17.737 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -8.531 1.018 -17.311 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.961 0.239 -17.298 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -6.801 0.223 -19.570 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.475 -0.247 -19.786 1.00 0.00 H new ATOM 0 HE ARG A 16 -9.060 1.986 -20.071 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -5.878 1.738 -18.562 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -5.555 3.470 -18.686 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -8.640 4.211 -20.226 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -7.113 4.865 -19.625 1.00 0.00 H new ATOM 253 N LEU A 17 -9.931 -3.479 -15.668 1.00 0.00 N ATOM 254 CA LEU A 17 -11.138 -4.197 -15.271 1.00 0.00 C ATOM 255 C LEU A 17 -11.417 -4.011 -13.783 1.00 0.00 C ATOM 256 O LEU A 17 -12.529 -3.662 -13.389 1.00 0.00 O ATOM 257 CB LEU A 17 -10.999 -5.685 -15.594 1.00 0.00 C ATOM 258 CG LEU A 17 -12.302 -6.484 -15.651 1.00 0.00 C ATOM 259 CD1 LEU A 17 -12.879 -6.464 -17.058 1.00 0.00 C ATOM 260 CD2 LEU A 17 -12.071 -7.915 -15.188 1.00 0.00 C ATOM 0 H LEU A 17 -9.194 -4.072 -16.050 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.977 -3.787 -15.833 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -10.494 -5.782 -16.555 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -10.350 -6.140 -14.846 1.00 0.00 H new ATOM 0 HG LEU A 17 -13.022 -6.017 -14.978 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -13.806 -7.037 -17.079 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.082 -5.435 -17.353 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -12.163 -6.906 -17.751 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -13.009 -8.469 -15.235 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -11.335 -8.392 -15.835 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -11.704 -7.911 -14.162 1.00 0.00 H new ATOM 272 N ALA A 18 -10.399 -4.246 -12.962 1.00 0.00 N ATOM 273 CA ALA A 18 -10.533 -4.101 -11.518 1.00 0.00 C ATOM 274 C ALA A 18 -10.213 -2.676 -11.077 1.00 0.00 C ATOM 275 O ALA A 18 -10.622 -2.243 -10.000 1.00 0.00 O ATOM 276 CB ALA A 18 -9.629 -5.093 -10.801 1.00 0.00 C ATOM 0 H ALA A 18 -9.472 -4.538 -13.272 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.569 -4.312 -11.252 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -9.740 -4.973 -9.723 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -9.907 -6.108 -11.084 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.592 -4.909 -11.082 1.00 0.00 H new ATOM 282 N GLY A 19 -9.479 -1.953 -11.916 1.00 0.00 N ATOM 283 CA GLY A 19 -9.116 -0.585 -11.595 1.00 0.00 C ATOM 284 C GLY A 19 -8.190 -0.497 -10.398 1.00 0.00 C ATOM 285 O GLY A 19 -7.928 0.592 -9.886 1.00 0.00 O ATOM 0 H GLY A 19 -9.129 -2.290 -12.813 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.633 -0.128 -12.459 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -10.020 -0.010 -11.394 1.00 0.00 H new ATOM 289 N ILE A 20 -7.694 -1.645 -9.950 1.00 0.00 N ATOM 290 CA ILE A 20 -6.793 -1.693 -8.805 1.00 0.00 C ATOM 291 C ILE A 20 -5.391 -2.119 -9.227 1.00 0.00 C ATOM 292 O ILE A 20 -4.929 -3.205 -8.875 1.00 0.00 O ATOM 293 CB ILE A 20 -7.308 -2.660 -7.723 1.00 0.00 C ATOM 294 CG1 ILE A 20 -8.796 -2.421 -7.461 1.00 0.00 C ATOM 295 CG2 ILE A 20 -6.505 -2.496 -6.441 1.00 0.00 C ATOM 296 CD1 ILE A 20 -9.288 -3.033 -6.167 1.00 0.00 C ATOM 0 H ILE A 20 -7.901 -2.555 -10.362 1.00 0.00 H new ATOM 0 HA ILE A 20 -6.755 -0.685 -8.391 1.00 0.00 H new ATOM 0 HB ILE A 20 -7.181 -3.682 -8.080 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.985 -1.348 -7.441 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -9.373 -2.831 -8.290 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.881 -3.186 -5.686 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -5.455 -2.711 -6.639 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -6.603 -1.473 -6.079 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -10.351 -2.824 -6.047 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -9.131 -4.111 -6.192 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -8.737 -2.605 -5.330 1.00 0.00 H new ATOM 308 N SER A 21 -4.718 -1.256 -9.981 1.00 0.00 N ATOM 309 CA SER A 21 -3.368 -1.544 -10.453 1.00 0.00 C ATOM 310 C SER A 21 -2.923 -0.513 -11.486 1.00 0.00 C ATOM 311 O SER A 21 -3.465 -0.447 -12.589 1.00 0.00 O ATOM 312 CB SER A 21 -3.305 -2.948 -11.057 1.00 0.00 C ATOM 313 OG SER A 21 -2.520 -3.813 -10.255 1.00 0.00 O ATOM 0 H SER A 21 -5.085 -0.352 -10.278 1.00 0.00 H new ATOM 0 HA SER A 21 -2.692 -1.493 -9.599 1.00 0.00 H new ATOM 0 HB2 SER A 21 -4.313 -3.351 -11.154 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.885 -2.897 -12.061 1.00 0.00 H new ATOM 0 HG SER A 21 -2.990 -3.996 -9.415 1.00 0.00 H new ATOM 319 N LYS A 22 -1.930 0.290 -11.120 1.00 0.00 N ATOM 320 CA LYS A 22 -1.408 1.318 -12.013 1.00 0.00 C ATOM 321 C LYS A 22 -0.480 0.709 -13.060 1.00 0.00 C ATOM 322 O LYS A 22 0.715 0.540 -12.821 1.00 0.00 O ATOM 323 CB LYS A 22 -0.660 2.387 -11.213 1.00 0.00 C ATOM 324 CG LYS A 22 -1.371 3.728 -11.177 1.00 0.00 C ATOM 325 CD LYS A 22 -2.595 3.687 -10.277 1.00 0.00 C ATOM 326 CE LYS A 22 -3.272 5.046 -10.194 1.00 0.00 C ATOM 327 NZ LYS A 22 -3.675 5.548 -11.537 1.00 0.00 N ATOM 0 H LYS A 22 -1.470 0.249 -10.210 1.00 0.00 H new ATOM 0 HA LYS A 22 -2.251 1.781 -12.525 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.519 2.032 -10.192 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.332 2.523 -11.643 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -0.683 4.496 -10.823 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.670 4.009 -12.187 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -3.302 2.950 -10.657 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.303 3.363 -9.278 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -4.151 4.975 -9.554 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.595 5.761 -9.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -4.319 6.357 -11.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -2.830 5.848 -12.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -4.158 4.790 -12.060 1.00 0.00 H new ATOM 341 N VAL A 23 -1.039 0.383 -14.221 1.00 0.00 N ATOM 342 CA VAL A 23 -0.261 -0.204 -15.306 1.00 0.00 C ATOM 343 C VAL A 23 -0.132 0.763 -16.477 1.00 0.00 C ATOM 344 O VAL A 23 -1.070 1.494 -16.798 1.00 0.00 O ATOM 345 CB VAL A 23 -0.895 -1.516 -15.805 1.00 0.00 C ATOM 346 CG1 VAL A 23 0.050 -2.240 -16.751 1.00 0.00 C ATOM 347 CG2 VAL A 23 -1.273 -2.406 -14.630 1.00 0.00 C ATOM 0 H VAL A 23 -2.028 0.515 -14.435 1.00 0.00 H new ATOM 0 HA VAL A 23 0.730 -0.417 -14.905 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.805 -1.274 -16.354 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.415 -3.164 -17.093 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.265 -1.603 -17.609 1.00 0.00 H new ATOM 0 HG13 VAL A 23 0.979 -2.472 -16.230 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.720 -3.328 -15.001 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.380 -2.642 -14.051 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.990 -1.886 -13.995 1.00 0.00 H new ATOM 357 N TYR A 24 1.035 0.763 -17.112 1.00 0.00 N ATOM 358 CA TYR A 24 1.287 1.642 -18.247 1.00 0.00 C ATOM 359 C TYR A 24 1.397 0.843 -19.542 1.00 0.00 C ATOM 360 O TYR A 24 1.362 -0.387 -19.529 1.00 0.00 O ATOM 361 CB TYR A 24 2.569 2.446 -18.020 1.00 0.00 C ATOM 362 CG TYR A 24 2.503 3.366 -16.822 1.00 0.00 C ATOM 363 CD1 TYR A 24 1.462 4.274 -16.675 1.00 0.00 C ATOM 364 CD2 TYR A 24 3.481 3.325 -15.836 1.00 0.00 C ATOM 365 CE1 TYR A 24 1.399 5.117 -15.582 1.00 0.00 C ATOM 366 CE2 TYR A 24 3.425 4.162 -14.739 1.00 0.00 C ATOM 367 CZ TYR A 24 2.382 5.057 -14.617 1.00 0.00 C ATOM 368 OH TYR A 24 2.322 5.893 -13.526 1.00 0.00 O ATOM 0 H TYR A 24 1.821 0.164 -16.860 1.00 0.00 H new ATOM 0 HA TYR A 24 0.445 2.329 -18.336 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.403 1.756 -17.892 1.00 0.00 H new ATOM 0 HB3 TYR A 24 2.779 3.038 -18.911 1.00 0.00 H new ATOM 0 HD1 TYR A 24 0.689 4.322 -17.428 1.00 0.00 H new ATOM 0 HD2 TYR A 24 4.299 2.626 -15.929 1.00 0.00 H new ATOM 0 HE1 TYR A 24 0.584 5.819 -15.484 1.00 0.00 H new ATOM 0 HE2 TYR A 24 4.193 4.116 -13.981 1.00 0.00 H new ATOM 0 HH TYR A 24 2.740 5.455 -12.755 1.00 0.00 H new ATOM 378 N GLU A 25 1.531 1.552 -20.658 1.00 0.00 N ATOM 379 CA GLU A 25 1.646 0.909 -21.962 1.00 0.00 C ATOM 380 C GLU A 25 2.755 1.553 -22.790 1.00 0.00 C ATOM 381 O GLU A 25 2.610 2.674 -23.278 1.00 0.00 O ATOM 382 CB GLU A 25 0.317 0.993 -22.715 1.00 0.00 C ATOM 383 CG GLU A 25 0.456 0.802 -24.216 1.00 0.00 C ATOM 384 CD GLU A 25 0.460 2.116 -24.973 1.00 0.00 C ATOM 385 OE1 GLU A 25 0.308 3.174 -24.328 1.00 0.00 O ATOM 386 OE2 GLU A 25 0.614 2.085 -26.212 1.00 0.00 O ATOM 0 H GLU A 25 1.563 2.571 -20.686 1.00 0.00 H new ATOM 0 HA GLU A 25 1.899 -0.139 -21.801 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -0.362 0.236 -22.322 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.140 1.963 -22.521 1.00 0.00 H new ATOM 0 HG2 GLU A 25 1.380 0.263 -24.426 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.364 0.181 -24.577 1.00 0.00 H new ATOM 393 N THR A 26 3.863 0.835 -22.944 1.00 0.00 N ATOM 394 CA THR A 26 4.997 1.335 -23.711 1.00 0.00 C ATOM 395 C THR A 26 5.340 0.395 -24.861 1.00 0.00 C ATOM 396 O THR A 26 6.189 -0.488 -24.741 1.00 0.00 O ATOM 397 CB THR A 26 6.241 1.515 -22.821 1.00 0.00 C ATOM 398 OG1 THR A 26 6.632 0.254 -22.265 1.00 0.00 O ATOM 399 CG2 THR A 26 5.966 2.505 -21.700 1.00 0.00 C ATOM 0 H THR A 26 3.999 -0.095 -22.548 1.00 0.00 H new ATOM 0 HA THR A 26 4.704 2.305 -24.113 1.00 0.00 H new ATOM 0 HB THR A 26 7.049 1.906 -23.439 1.00 0.00 H new ATOM 0 HG1 THR A 26 6.743 -0.401 -22.985 1.00 0.00 H new ATOM 0 HG21 THR A 26 6.859 2.616 -21.085 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.697 3.472 -22.126 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.145 2.139 -21.084 1.00 0.00 H new ATOM 407 N PRO A 27 4.667 0.588 -26.005 1.00 0.00 N ATOM 408 CA PRO A 27 4.885 -0.232 -27.200 1.00 0.00 C ATOM 409 C PRO A 27 6.244 0.028 -27.842 1.00 0.00 C ATOM 410 O PRO A 27 6.866 -0.881 -28.391 1.00 0.00 O ATOM 411 CB PRO A 27 3.758 0.204 -28.140 1.00 0.00 C ATOM 412 CG PRO A 27 3.417 1.587 -27.706 1.00 0.00 C ATOM 413 CD PRO A 27 3.641 1.623 -26.220 1.00 0.00 C ATOM 0 HA PRO A 27 4.879 -1.297 -26.970 1.00 0.00 H new ATOM 0 HB2 PRO A 27 4.081 0.184 -29.181 1.00 0.00 H new ATOM 0 HB3 PRO A 27 2.897 -0.460 -28.060 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.044 2.321 -28.213 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.383 1.829 -27.950 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.983 2.603 -25.889 1.00 0.00 H new ATOM 0 HD3 PRO A 27 2.726 1.402 -25.670 1.00 0.00 H new ATOM 421 N ASP A 28 6.699 1.274 -27.768 1.00 0.00 N ATOM 422 CA ASP A 28 7.985 1.653 -28.340 1.00 0.00 C ATOM 423 C ASP A 28 9.078 1.641 -27.276 1.00 0.00 C ATOM 424 O ASP A 28 8.806 1.831 -26.091 1.00 0.00 O ATOM 425 CB ASP A 28 7.894 3.039 -28.980 1.00 0.00 C ATOM 426 CG ASP A 28 6.585 3.253 -29.714 1.00 0.00 C ATOM 427 OD1 ASP A 28 6.171 2.346 -30.466 1.00 0.00 O ATOM 428 OD2 ASP A 28 5.975 4.328 -29.537 1.00 0.00 O ATOM 0 H ASP A 28 6.196 2.038 -27.317 1.00 0.00 H new ATOM 0 HA ASP A 28 8.242 0.923 -29.108 1.00 0.00 H new ATOM 0 HB2 ASP A 28 8.003 3.800 -28.208 1.00 0.00 H new ATOM 0 HB3 ASP A 28 8.723 3.170 -29.676 1.00 0.00 H new ATOM 433 N ILE A 29 10.315 1.416 -27.708 1.00 0.00 N ATOM 434 CA ILE A 29 11.448 1.379 -26.792 1.00 0.00 C ATOM 435 C ILE A 29 11.733 2.762 -26.215 1.00 0.00 C ATOM 436 O ILE A 29 12.002 2.922 -25.024 1.00 0.00 O ATOM 437 CB ILE A 29 12.717 0.854 -27.488 1.00 0.00 C ATOM 438 CG1 ILE A 29 13.857 1.865 -27.349 1.00 0.00 C ATOM 439 CG2 ILE A 29 12.436 0.564 -28.955 1.00 0.00 C ATOM 440 CD1 ILE A 29 15.179 1.364 -27.889 1.00 0.00 C ATOM 0 H ILE A 29 10.557 1.257 -28.686 1.00 0.00 H new ATOM 0 HA ILE A 29 11.179 0.699 -25.984 1.00 0.00 H new ATOM 0 HB ILE A 29 13.019 -0.075 -27.005 1.00 0.00 H new ATOM 0 HG12 ILE A 29 13.584 2.782 -27.872 1.00 0.00 H new ATOM 0 HG13 ILE A 29 13.978 2.122 -26.297 1.00 0.00 H new ATOM 0 HG21 ILE A 29 13.343 0.194 -29.433 1.00 0.00 H new ATOM 0 HG22 ILE A 29 11.651 -0.189 -29.033 1.00 0.00 H new ATOM 0 HG23 ILE A 29 12.112 1.479 -29.451 1.00 0.00 H new ATOM 0 HD11 ILE A 29 15.941 2.133 -27.757 1.00 0.00 H new ATOM 0 HD12 ILE A 29 15.475 0.464 -27.350 1.00 0.00 H new ATOM 0 HD13 ILE A 29 15.075 1.134 -28.949 1.00 0.00 H new ATOM 452 N PRO A 30 11.673 3.787 -27.078 1.00 0.00 N ATOM 453 CA PRO A 30 11.919 5.175 -26.677 1.00 0.00 C ATOM 454 C PRO A 30 10.809 5.728 -25.790 1.00 0.00 C ATOM 455 O PRO A 30 11.069 6.469 -24.843 1.00 0.00 O ATOM 456 CB PRO A 30 11.964 5.927 -28.009 1.00 0.00 C ATOM 457 CG PRO A 30 11.151 5.096 -28.941 1.00 0.00 C ATOM 458 CD PRO A 30 11.359 3.670 -28.512 1.00 0.00 C ATOM 0 HA PRO A 30 12.830 5.273 -26.086 1.00 0.00 H new ATOM 0 HB2 PRO A 30 11.551 6.931 -27.911 1.00 0.00 H new ATOM 0 HB3 PRO A 30 12.988 6.037 -28.367 1.00 0.00 H new ATOM 0 HG2 PRO A 30 10.097 5.369 -28.889 1.00 0.00 H new ATOM 0 HG3 PRO A 30 11.468 5.243 -29.973 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.467 3.066 -28.680 1.00 0.00 H new ATOM 0 HD3 PRO A 30 12.172 3.199 -29.064 1.00 0.00 H new ATOM 466 N ALA A 31 9.570 5.362 -26.103 1.00 0.00 N ATOM 467 CA ALA A 31 8.420 5.820 -25.333 1.00 0.00 C ATOM 468 C ALA A 31 8.496 5.332 -23.891 1.00 0.00 C ATOM 469 O ALA A 31 7.875 5.907 -22.996 1.00 0.00 O ATOM 470 CB ALA A 31 7.128 5.349 -25.984 1.00 0.00 C ATOM 0 H ALA A 31 9.337 4.749 -26.885 1.00 0.00 H new ATOM 0 HA ALA A 31 8.432 6.910 -25.321 1.00 0.00 H new ATOM 0 HB1 ALA A 31 6.277 5.698 -25.399 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.062 5.751 -26.995 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.117 4.260 -26.025 1.00 0.00 H new ATOM 476 N THR A 32 9.262 4.267 -23.670 1.00 0.00 N ATOM 477 CA THR A 32 9.417 3.701 -22.336 1.00 0.00 C ATOM 478 C THR A 32 9.876 4.760 -21.340 1.00 0.00 C ATOM 479 O THR A 32 9.470 4.748 -20.178 1.00 0.00 O ATOM 480 CB THR A 32 10.428 2.539 -22.334 1.00 0.00 C ATOM 481 OG1 THR A 32 9.977 1.496 -23.206 1.00 0.00 O ATOM 482 CG2 THR A 32 10.614 1.986 -20.929 1.00 0.00 C ATOM 0 H THR A 32 9.784 3.780 -24.398 1.00 0.00 H new ATOM 0 HA THR A 32 8.439 3.324 -22.036 1.00 0.00 H new ATOM 0 HB THR A 32 11.386 2.920 -22.688 1.00 0.00 H new ATOM 0 HG1 THR A 32 10.426 1.578 -24.073 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.332 1.166 -20.953 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.984 2.774 -20.274 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.659 1.620 -20.552 1.00 0.00 H new ATOM 490 N GLU A 33 10.723 5.674 -21.802 1.00 0.00 N ATOM 491 CA GLU A 33 11.236 6.740 -20.949 1.00 0.00 C ATOM 492 C GLU A 33 10.095 7.586 -20.390 1.00 0.00 C ATOM 493 O GLU A 33 10.184 8.110 -19.280 1.00 0.00 O ATOM 494 CB GLU A 33 12.207 7.626 -21.731 1.00 0.00 C ATOM 495 CG GLU A 33 11.533 8.476 -22.796 1.00 0.00 C ATOM 496 CD GLU A 33 12.439 8.754 -23.980 1.00 0.00 C ATOM 497 OE1 GLU A 33 13.673 8.667 -23.817 1.00 0.00 O ATOM 498 OE2 GLU A 33 11.911 9.058 -25.071 1.00 0.00 O ATOM 0 H GLU A 33 11.068 5.698 -22.761 1.00 0.00 H new ATOM 0 HA GLU A 33 11.766 6.280 -20.115 1.00 0.00 H new ATOM 0 HB2 GLU A 33 12.731 8.280 -21.034 1.00 0.00 H new ATOM 0 HB3 GLU A 33 12.960 6.996 -22.204 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.632 7.970 -23.143 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.217 9.421 -22.355 1.00 0.00 H new ATOM 505 N SER A 34 9.025 7.714 -21.168 1.00 0.00 N ATOM 506 CA SER A 34 7.869 8.499 -20.753 1.00 0.00 C ATOM 507 C SER A 34 7.215 7.892 -19.516 1.00 0.00 C ATOM 508 O SER A 34 6.852 8.603 -18.579 1.00 0.00 O ATOM 509 CB SER A 34 6.850 8.587 -21.892 1.00 0.00 C ATOM 510 OG SER A 34 6.075 9.769 -21.793 1.00 0.00 O ATOM 0 H SER A 34 8.935 7.284 -22.089 1.00 0.00 H new ATOM 0 HA SER A 34 8.213 9.503 -20.504 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.369 8.568 -22.850 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.195 7.716 -21.866 1.00 0.00 H new ATOM 0 HG SER A 34 5.433 9.802 -22.533 1.00 0.00 H new ATOM 516 N ALA A 35 7.067 6.571 -19.521 1.00 0.00 N ATOM 517 CA ALA A 35 6.459 5.866 -18.399 1.00 0.00 C ATOM 518 C ALA A 35 7.346 5.936 -17.161 1.00 0.00 C ATOM 519 O ALA A 35 6.861 5.860 -16.032 1.00 0.00 O ATOM 520 CB ALA A 35 6.184 4.417 -18.773 1.00 0.00 C ATOM 0 H ALA A 35 7.360 5.968 -20.290 1.00 0.00 H new ATOM 0 HA ALA A 35 5.513 6.355 -18.164 1.00 0.00 H new ATOM 0 HB1 ALA A 35 5.730 3.902 -17.926 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.504 4.384 -19.624 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.120 3.925 -19.037 1.00 0.00 H new ATOM 526 N VAL A 36 8.649 6.080 -17.380 1.00 0.00 N ATOM 527 CA VAL A 36 9.605 6.160 -16.281 1.00 0.00 C ATOM 528 C VAL A 36 9.377 7.414 -15.445 1.00 0.00 C ATOM 529 O VAL A 36 9.683 7.442 -14.253 1.00 0.00 O ATOM 530 CB VAL A 36 11.056 6.157 -16.798 1.00 0.00 C ATOM 531 CG1 VAL A 36 12.022 6.511 -15.678 1.00 0.00 C ATOM 532 CG2 VAL A 36 11.402 4.806 -17.406 1.00 0.00 C ATOM 0 H VAL A 36 9.067 6.144 -18.308 1.00 0.00 H new ATOM 0 HA VAL A 36 9.447 5.279 -15.659 1.00 0.00 H new ATOM 0 HB VAL A 36 11.148 6.914 -17.577 1.00 0.00 H new ATOM 0 HG11 VAL A 36 13.042 6.504 -16.062 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.786 7.503 -15.294 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.931 5.780 -14.875 1.00 0.00 H new ATOM 0 HG21 VAL A 36 12.431 4.822 -17.766 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.294 4.028 -16.650 1.00 0.00 H new ATOM 0 HG23 VAL A 36 10.729 4.599 -18.238 1.00 0.00 H new ATOM 542 N ARG A 37 8.837 8.450 -16.078 1.00 0.00 N ATOM 543 CA ARG A 37 8.568 9.708 -15.392 1.00 0.00 C ATOM 544 C ARG A 37 7.765 9.471 -14.116 1.00 0.00 C ATOM 545 O ARG A 37 7.976 10.141 -13.105 1.00 0.00 O ATOM 546 CB ARG A 37 7.809 10.665 -16.314 1.00 0.00 C ATOM 547 CG ARG A 37 6.314 10.398 -16.372 1.00 0.00 C ATOM 548 CD ARG A 37 5.651 11.184 -17.492 1.00 0.00 C ATOM 549 NE ARG A 37 6.198 12.532 -17.613 1.00 0.00 N ATOM 550 CZ ARG A 37 5.997 13.491 -16.715 1.00 0.00 C ATOM 551 NH1 ARG A 37 5.265 13.249 -15.636 1.00 0.00 N ATOM 552 NH2 ARG A 37 6.528 14.693 -16.895 1.00 0.00 N ATOM 0 H ARG A 37 8.577 8.443 -17.064 1.00 0.00 H new ATOM 0 HA ARG A 37 9.524 10.156 -15.122 1.00 0.00 H new ATOM 0 HB2 ARG A 37 7.974 11.688 -15.976 1.00 0.00 H new ATOM 0 HB3 ARG A 37 8.222 10.591 -17.320 1.00 0.00 H new ATOM 0 HG2 ARG A 37 6.139 9.332 -16.521 1.00 0.00 H new ATOM 0 HG3 ARG A 37 5.858 10.666 -15.419 1.00 0.00 H new ATOM 0 HD2 ARG A 37 5.783 10.653 -18.435 1.00 0.00 H new ATOM 0 HD3 ARG A 37 4.578 11.243 -17.307 1.00 0.00 H new ATOM 0 HE ARG A 37 6.766 12.750 -18.432 1.00 0.00 H new ATOM 0 HH11 ARG A 37 4.855 12.326 -15.494 1.00 0.00 H new ATOM 0 HH12 ARG A 37 5.112 13.986 -14.948 1.00 0.00 H new ATOM 0 HH21 ARG A 37 7.092 14.883 -17.724 1.00 0.00 H new ATOM 0 HH22 ARG A 37 6.373 15.428 -16.205 1.00 0.00 H new ATOM 566 N SER A 38 6.843 8.515 -14.172 1.00 0.00 N ATOM 567 CA SER A 38 6.006 8.193 -13.023 1.00 0.00 C ATOM 568 C SER A 38 6.670 7.135 -12.146 1.00 0.00 C ATOM 569 O SER A 38 6.543 7.158 -10.922 1.00 0.00 O ATOM 570 CB SER A 38 4.634 7.699 -13.487 1.00 0.00 C ATOM 571 OG SER A 38 3.898 8.742 -14.102 1.00 0.00 O ATOM 0 H SER A 38 6.657 7.950 -15.001 1.00 0.00 H new ATOM 0 HA SER A 38 5.877 9.100 -12.433 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.759 6.875 -14.189 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.077 7.310 -12.635 1.00 0.00 H new ATOM 0 HG SER A 38 3.099 8.370 -14.531 1.00 0.00 H new ATOM 577 N VAL A 39 7.379 6.208 -12.783 1.00 0.00 N ATOM 578 CA VAL A 39 8.064 5.142 -12.062 1.00 0.00 C ATOM 579 C VAL A 39 9.132 5.706 -11.131 1.00 0.00 C ATOM 580 O VAL A 39 9.271 5.264 -9.990 1.00 0.00 O ATOM 581 CB VAL A 39 8.721 4.142 -13.032 1.00 0.00 C ATOM 582 CG1 VAL A 39 9.478 3.070 -12.263 1.00 0.00 C ATOM 583 CG2 VAL A 39 7.674 3.518 -13.943 1.00 0.00 C ATOM 0 H VAL A 39 7.494 6.174 -13.796 1.00 0.00 H new ATOM 0 HA VAL A 39 7.309 4.623 -11.472 1.00 0.00 H new ATOM 0 HB VAL A 39 9.436 4.681 -13.654 1.00 0.00 H new ATOM 0 HG11 VAL A 39 9.935 2.373 -12.965 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.255 3.537 -11.657 1.00 0.00 H new ATOM 0 HG13 VAL A 39 8.787 2.531 -11.615 1.00 0.00 H new ATOM 0 HG21 VAL A 39 8.155 2.814 -14.622 1.00 0.00 H new ATOM 0 HG22 VAL A 39 6.934 2.992 -13.340 1.00 0.00 H new ATOM 0 HG23 VAL A 39 7.182 4.300 -14.521 1.00 0.00 H new ATOM 593 N LEU A 40 9.883 6.684 -11.625 1.00 0.00 N ATOM 594 CA LEU A 40 10.939 7.310 -10.837 1.00 0.00 C ATOM 595 C LEU A 40 10.423 7.717 -9.460 1.00 0.00 C ATOM 596 O LEU A 40 11.173 7.728 -8.485 1.00 0.00 O ATOM 597 CB LEU A 40 11.491 8.534 -11.569 1.00 0.00 C ATOM 598 CG LEU A 40 10.579 9.761 -11.608 1.00 0.00 C ATOM 599 CD1 LEU A 40 10.796 10.627 -10.377 1.00 0.00 C ATOM 600 CD2 LEU A 40 10.821 10.565 -12.877 1.00 0.00 C ATOM 0 H LEU A 40 9.780 7.061 -12.567 1.00 0.00 H new ATOM 0 HA LEU A 40 11.739 6.582 -10.704 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.432 8.820 -11.098 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.722 8.245 -12.594 1.00 0.00 H new ATOM 0 HG LEU A 40 9.544 9.420 -11.609 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.139 11.495 -10.422 1.00 0.00 H new ATOM 0 HD12 LEU A 40 10.572 10.048 -9.481 1.00 0.00 H new ATOM 0 HD13 LEU A 40 11.834 10.959 -10.344 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.164 11.434 -12.888 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.859 10.895 -12.906 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.614 9.942 -13.747 1.00 0.00 H new ATOM 612 N GLU A 41 9.137 8.047 -9.390 1.00 0.00 N ATOM 613 CA GLU A 41 8.521 8.453 -8.132 1.00 0.00 C ATOM 614 C GLU A 41 7.638 7.340 -7.575 1.00 0.00 C ATOM 615 O GLU A 41 7.267 7.356 -6.401 1.00 0.00 O ATOM 616 CB GLU A 41 7.694 9.725 -8.331 1.00 0.00 C ATOM 617 CG GLU A 41 6.487 9.531 -9.233 1.00 0.00 C ATOM 618 CD GLU A 41 5.551 10.724 -9.221 1.00 0.00 C ATOM 619 OE1 GLU A 41 5.796 11.677 -9.990 1.00 0.00 O ATOM 620 OE2 GLU A 41 4.575 10.706 -8.442 1.00 0.00 O ATOM 0 H GLU A 41 8.502 8.041 -10.188 1.00 0.00 H new ATOM 0 HA GLU A 41 9.317 8.655 -7.415 1.00 0.00 H new ATOM 0 HB2 GLU A 41 7.357 10.085 -7.359 1.00 0.00 H new ATOM 0 HB3 GLU A 41 8.332 10.501 -8.754 1.00 0.00 H new ATOM 0 HG2 GLU A 41 6.826 9.350 -10.253 1.00 0.00 H new ATOM 0 HG3 GLU A 41 5.941 8.642 -8.916 1.00 0.00 H new ATOM 627 N ASP A 42 7.304 6.376 -8.426 1.00 0.00 N ATOM 628 CA ASP A 42 6.465 5.255 -8.019 1.00 0.00 C ATOM 629 C ASP A 42 7.294 4.180 -7.323 1.00 0.00 C ATOM 630 O ASP A 42 6.764 3.362 -6.571 1.00 0.00 O ATOM 631 CB ASP A 42 5.751 4.659 -9.233 1.00 0.00 C ATOM 632 CG ASP A 42 4.552 3.816 -8.844 1.00 0.00 C ATOM 633 OD1 ASP A 42 4.737 2.827 -8.103 1.00 0.00 O ATOM 634 OD2 ASP A 42 3.429 4.145 -9.279 1.00 0.00 O ATOM 0 H ASP A 42 7.601 6.348 -9.401 1.00 0.00 H new ATOM 0 HA ASP A 42 5.721 5.627 -7.315 1.00 0.00 H new ATOM 0 HB2 ASP A 42 5.427 5.465 -9.892 1.00 0.00 H new ATOM 0 HB3 ASP A 42 6.453 4.047 -9.800 1.00 0.00 H new ATOM 639 N LYS A 43 8.598 4.186 -7.580 1.00 0.00 N ATOM 640 CA LYS A 43 9.501 3.213 -6.979 1.00 0.00 C ATOM 641 C LYS A 43 9.597 3.418 -5.471 1.00 0.00 C ATOM 642 O LYS A 43 9.910 2.489 -4.727 1.00 0.00 O ATOM 643 CB LYS A 43 10.892 3.320 -7.609 1.00 0.00 C ATOM 644 CG LYS A 43 11.652 4.568 -7.195 1.00 0.00 C ATOM 645 CD LYS A 43 12.645 4.274 -6.083 1.00 0.00 C ATOM 646 CE LYS A 43 13.094 5.549 -5.385 1.00 0.00 C ATOM 647 NZ LYS A 43 14.036 5.266 -4.267 1.00 0.00 N ATOM 0 H LYS A 43 9.053 4.855 -8.201 1.00 0.00 H new ATOM 0 HA LYS A 43 9.099 2.217 -7.167 1.00 0.00 H new ATOM 0 HB2 LYS A 43 11.475 2.441 -7.333 1.00 0.00 H new ATOM 0 HB3 LYS A 43 10.792 3.309 -8.694 1.00 0.00 H new ATOM 0 HG2 LYS A 43 12.180 4.976 -8.057 1.00 0.00 H new ATOM 0 HG3 LYS A 43 10.948 5.330 -6.863 1.00 0.00 H new ATOM 0 HD2 LYS A 43 12.190 3.601 -5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 43 13.513 3.759 -6.495 1.00 0.00 H new ATOM 0 HE2 LYS A 43 13.575 6.209 -6.107 1.00 0.00 H new ATOM 0 HE3 LYS A 43 12.223 6.079 -5.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 14.319 6.160 -3.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 13.569 4.657 -3.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 14.879 4.783 -4.637 1.00 0.00 H new ATOM 661 N SER A 44 9.325 4.641 -5.026 1.00 0.00 N ATOM 662 CA SER A 44 9.383 4.969 -3.607 1.00 0.00 C ATOM 663 C SER A 44 8.004 4.852 -2.965 1.00 0.00 C ATOM 664 O SER A 44 7.792 5.295 -1.836 1.00 0.00 O ATOM 665 CB SER A 44 9.931 6.384 -3.410 1.00 0.00 C ATOM 666 OG SER A 44 10.956 6.403 -2.432 1.00 0.00 O ATOM 0 H SER A 44 9.062 5.421 -5.628 1.00 0.00 H new ATOM 0 HA SER A 44 10.052 4.257 -3.123 1.00 0.00 H new ATOM 0 HB2 SER A 44 10.320 6.762 -4.356 1.00 0.00 H new ATOM 0 HB3 SER A 44 9.124 7.051 -3.108 1.00 0.00 H new ATOM 0 HG SER A 44 11.290 7.318 -2.326 1.00 0.00 H new ATOM 672 N VAL A 45 7.068 4.252 -3.694 1.00 0.00 N ATOM 673 CA VAL A 45 5.709 4.075 -3.197 1.00 0.00 C ATOM 674 C VAL A 45 5.462 2.631 -2.773 1.00 0.00 C ATOM 675 O VAL A 45 5.334 2.335 -1.586 1.00 0.00 O ATOM 676 CB VAL A 45 4.667 4.471 -4.260 1.00 0.00 C ATOM 677 CG1 VAL A 45 3.266 4.458 -3.666 1.00 0.00 C ATOM 678 CG2 VAL A 45 4.994 5.837 -4.844 1.00 0.00 C ATOM 0 H VAL A 45 7.226 3.880 -4.631 1.00 0.00 H new ATOM 0 HA VAL A 45 5.601 4.728 -2.331 1.00 0.00 H new ATOM 0 HB VAL A 45 4.701 3.739 -5.067 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.544 4.740 -4.432 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.035 3.457 -3.300 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.215 5.167 -2.840 1.00 0.00 H new ATOM 0 HG21 VAL A 45 4.247 6.101 -5.593 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.990 6.583 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 45 5.980 5.808 -5.309 1.00 0.00 H new ATOM 688 N GLY A 46 5.397 1.735 -3.754 1.00 0.00 N ATOM 689 CA GLY A 46 5.167 0.332 -3.462 1.00 0.00 C ATOM 690 C GLY A 46 6.053 -0.584 -4.282 1.00 0.00 C ATOM 691 O GLY A 46 7.276 -0.440 -4.280 1.00 0.00 O ATOM 0 H GLY A 46 5.499 1.956 -4.745 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.345 0.151 -2.402 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.122 0.090 -3.656 1.00 0.00 H new ATOM 695 N ILE A 47 5.436 -1.528 -4.985 1.00 0.00 N ATOM 696 CA ILE A 47 6.178 -2.471 -5.813 1.00 0.00 C ATOM 697 C ILE A 47 6.032 -2.136 -7.293 1.00 0.00 C ATOM 698 O ILE A 47 4.972 -1.696 -7.740 1.00 0.00 O ATOM 699 CB ILE A 47 5.708 -3.918 -5.577 1.00 0.00 C ATOM 700 CG1 ILE A 47 6.633 -4.902 -6.296 1.00 0.00 C ATOM 701 CG2 ILE A 47 4.272 -4.092 -6.049 1.00 0.00 C ATOM 702 CD1 ILE A 47 6.261 -6.352 -6.078 1.00 0.00 C ATOM 0 H ILE A 47 4.425 -1.660 -4.998 1.00 0.00 H new ATOM 0 HA ILE A 47 7.226 -2.387 -5.526 1.00 0.00 H new ATOM 0 HB ILE A 47 5.747 -4.127 -4.508 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.617 -4.688 -7.365 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.656 -4.743 -5.954 1.00 0.00 H new ATOM 0 HG21 ILE A 47 3.954 -5.120 -5.876 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.623 -3.413 -5.496 1.00 0.00 H new ATOM 0 HG23 ILE A 47 4.209 -3.868 -7.114 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.960 -6.992 -6.617 1.00 0.00 H new ATOM 0 HD12 ILE A 47 6.305 -6.583 -5.014 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.250 -6.528 -6.446 1.00 0.00 H new ATOM 714 N LEU A 48 7.103 -2.347 -8.050 1.00 0.00 N ATOM 715 CA LEU A 48 7.094 -2.069 -9.482 1.00 0.00 C ATOM 716 C LEU A 48 7.152 -3.363 -10.288 1.00 0.00 C ATOM 717 O LEU A 48 7.628 -4.389 -9.803 1.00 0.00 O ATOM 718 CB LEU A 48 8.275 -1.171 -9.855 1.00 0.00 C ATOM 719 CG LEU A 48 8.600 -0.047 -8.870 1.00 0.00 C ATOM 720 CD1 LEU A 48 9.534 -0.547 -7.779 1.00 0.00 C ATOM 721 CD2 LEU A 48 9.214 1.140 -9.598 1.00 0.00 C ATOM 0 H LEU A 48 7.988 -2.710 -7.696 1.00 0.00 H new ATOM 0 HA LEU A 48 6.164 -1.554 -9.721 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.161 -1.797 -9.967 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.074 -0.726 -10.830 1.00 0.00 H new ATOM 0 HG LEU A 48 7.671 0.280 -8.403 1.00 0.00 H new ATOM 0 HD11 LEU A 48 9.754 0.266 -7.088 1.00 0.00 H new ATOM 0 HD12 LEU A 48 9.057 -1.364 -7.238 1.00 0.00 H new ATOM 0 HD13 LEU A 48 10.461 -0.902 -8.228 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.439 1.930 -8.881 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.133 0.827 -10.093 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.510 1.514 -10.342 1.00 0.00 H new ATOM 733 N VAL A 49 6.665 -3.307 -11.524 1.00 0.00 N ATOM 734 CA VAL A 49 6.663 -4.473 -12.399 1.00 0.00 C ATOM 735 C VAL A 49 6.771 -4.061 -13.863 1.00 0.00 C ATOM 736 O VAL A 49 5.911 -3.351 -14.383 1.00 0.00 O ATOM 737 CB VAL A 49 5.389 -5.317 -12.207 1.00 0.00 C ATOM 738 CG1 VAL A 49 5.465 -6.593 -13.031 1.00 0.00 C ATOM 739 CG2 VAL A 49 5.179 -5.635 -10.734 1.00 0.00 C ATOM 0 H VAL A 49 6.267 -2.466 -11.942 1.00 0.00 H new ATOM 0 HA VAL A 49 7.531 -5.074 -12.128 1.00 0.00 H new ATOM 0 HB VAL A 49 4.534 -4.738 -12.556 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.556 -7.177 -12.883 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.565 -6.339 -14.086 1.00 0.00 H new ATOM 0 HG13 VAL A 49 6.328 -7.179 -12.715 1.00 0.00 H new ATOM 0 HG21 VAL A 49 4.275 -6.232 -10.616 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.035 -6.195 -10.357 1.00 0.00 H new ATOM 0 HG23 VAL A 49 5.077 -4.706 -10.172 1.00 0.00 H new ATOM 749 N MET A 50 7.833 -4.512 -14.522 1.00 0.00 N ATOM 750 CA MET A 50 8.052 -4.192 -15.928 1.00 0.00 C ATOM 751 C MET A 50 8.095 -5.461 -16.774 1.00 0.00 C ATOM 752 O MET A 50 8.286 -6.560 -16.253 1.00 0.00 O ATOM 753 CB MET A 50 9.354 -3.407 -16.098 1.00 0.00 C ATOM 754 CG MET A 50 9.411 -2.138 -15.264 1.00 0.00 C ATOM 755 SD MET A 50 10.723 -1.019 -15.791 1.00 0.00 S ATOM 756 CE MET A 50 10.783 0.111 -14.402 1.00 0.00 C ATOM 0 H MET A 50 8.555 -5.100 -14.106 1.00 0.00 H new ATOM 0 HA MET A 50 7.219 -3.577 -16.269 1.00 0.00 H new ATOM 0 HB2 MET A 50 10.193 -4.048 -15.827 1.00 0.00 H new ATOM 0 HB3 MET A 50 9.477 -3.147 -17.149 1.00 0.00 H new ATOM 0 HG2 MET A 50 8.452 -1.623 -15.327 1.00 0.00 H new ATOM 0 HG3 MET A 50 9.563 -2.402 -14.217 1.00 0.00 H new ATOM 0 HE1 MET A 50 10.943 1.126 -14.765 1.00 0.00 H new ATOM 0 HE2 MET A 50 9.841 0.066 -13.855 1.00 0.00 H new ATOM 0 HE3 MET A 50 11.601 -0.171 -13.739 1.00 0.00 H new ATOM 766 N HIS A 51 7.917 -5.301 -18.082 1.00 0.00 N ATOM 767 CA HIS A 51 7.936 -6.435 -19.000 1.00 0.00 C ATOM 768 C HIS A 51 9.216 -6.439 -19.831 1.00 0.00 C ATOM 769 O HIS A 51 9.619 -5.411 -20.373 1.00 0.00 O ATOM 770 CB HIS A 51 6.716 -6.393 -19.921 1.00 0.00 C ATOM 771 CG HIS A 51 5.413 -6.513 -19.194 1.00 0.00 C ATOM 772 ND1 HIS A 51 5.326 -6.707 -17.831 1.00 0.00 N ATOM 773 CD2 HIS A 51 4.138 -6.464 -19.647 1.00 0.00 C ATOM 774 CE1 HIS A 51 4.054 -6.774 -17.478 1.00 0.00 C ATOM 775 NE2 HIS A 51 3.313 -6.628 -18.562 1.00 0.00 N ATOM 0 H HIS A 51 7.758 -4.398 -18.530 1.00 0.00 H new ATOM 0 HA HIS A 51 7.904 -7.350 -18.409 1.00 0.00 H new ATOM 0 HB2 HIS A 51 6.726 -5.458 -20.481 1.00 0.00 H new ATOM 0 HB3 HIS A 51 6.792 -7.201 -20.649 1.00 0.00 H new ATOM 0 HD2 HIS A 51 3.828 -6.322 -20.672 1.00 0.00 H new ATOM 0 HE1 HIS A 51 3.684 -6.923 -16.474 1.00 0.00 H new ATOM 0 HE2 HIS A 51 2.293 -6.636 -18.588 1.00 0.00 H new ATOM 783 N ASN A 52 9.850 -7.603 -19.926 1.00 0.00 N ATOM 784 CA ASN A 52 11.085 -7.740 -20.689 1.00 0.00 C ATOM 785 C ASN A 52 10.839 -7.480 -22.172 1.00 0.00 C ATOM 786 O ASN A 52 11.781 -7.362 -22.957 1.00 0.00 O ATOM 787 CB ASN A 52 11.675 -9.139 -20.497 1.00 0.00 C ATOM 788 CG ASN A 52 13.150 -9.101 -20.145 1.00 0.00 C ATOM 789 OD1 ASN A 52 13.981 -9.685 -20.841 1.00 0.00 O ATOM 790 ND2 ASN A 52 13.482 -8.410 -19.061 1.00 0.00 N ATOM 0 H ASN A 52 9.529 -8.465 -19.484 1.00 0.00 H new ATOM 0 HA ASN A 52 11.795 -6.999 -20.320 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.129 -9.655 -19.708 1.00 0.00 H new ATOM 0 HB3 ASN A 52 11.537 -9.717 -21.411 1.00 0.00 H new ATOM 0 HD21 ASN A 52 14.459 -8.348 -18.775 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.760 -7.942 -18.514 1.00 0.00 H new ATOM 797 N ASP A 53 9.569 -7.390 -22.549 1.00 0.00 N ATOM 798 CA ASP A 53 9.198 -7.141 -23.937 1.00 0.00 C ATOM 799 C ASP A 53 9.597 -5.731 -24.362 1.00 0.00 C ATOM 800 O ASP A 53 9.451 -5.358 -25.526 1.00 0.00 O ATOM 801 CB ASP A 53 7.694 -7.340 -24.130 1.00 0.00 C ATOM 802 CG ASP A 53 7.326 -8.792 -24.359 1.00 0.00 C ATOM 803 OD1 ASP A 53 7.508 -9.279 -25.494 1.00 0.00 O ATOM 804 OD2 ASP A 53 6.856 -9.443 -23.402 1.00 0.00 O ATOM 0 H ASP A 53 8.778 -7.486 -21.912 1.00 0.00 H new ATOM 0 HA ASP A 53 9.733 -7.855 -24.563 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.166 -6.969 -23.252 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.358 -6.745 -24.979 1.00 0.00 H new ATOM 809 N ASP A 54 10.099 -4.952 -23.410 1.00 0.00 N ATOM 810 CA ASP A 54 10.519 -3.583 -23.685 1.00 0.00 C ATOM 811 C ASP A 54 11.893 -3.305 -23.085 1.00 0.00 C ATOM 812 O ASP A 54 12.695 -2.570 -23.661 1.00 0.00 O ATOM 813 CB ASP A 54 9.495 -2.592 -23.128 1.00 0.00 C ATOM 814 CG ASP A 54 8.568 -2.054 -24.200 1.00 0.00 C ATOM 815 OD1 ASP A 54 7.602 -2.759 -24.556 1.00 0.00 O ATOM 816 OD2 ASP A 54 8.809 -0.927 -24.683 1.00 0.00 O ATOM 0 H ASP A 54 10.225 -5.245 -22.441 1.00 0.00 H new ATOM 0 HA ASP A 54 10.583 -3.459 -24.766 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.905 -3.081 -22.353 1.00 0.00 H new ATOM 0 HB3 ASP A 54 10.018 -1.762 -22.654 1.00 0.00 H new ATOM 821 N ILE A 55 12.157 -3.897 -21.925 1.00 0.00 N ATOM 822 CA ILE A 55 13.435 -3.712 -21.247 1.00 0.00 C ATOM 823 C ILE A 55 14.555 -4.444 -21.978 1.00 0.00 C ATOM 824 O ILE A 55 15.660 -3.922 -22.125 1.00 0.00 O ATOM 825 CB ILE A 55 13.376 -4.210 -19.791 1.00 0.00 C ATOM 826 CG1 ILE A 55 12.116 -3.685 -19.100 1.00 0.00 C ATOM 827 CG2 ILE A 55 14.622 -3.777 -19.033 1.00 0.00 C ATOM 828 CD1 ILE A 55 11.904 -4.257 -17.716 1.00 0.00 C ATOM 0 H ILE A 55 11.504 -4.508 -21.435 1.00 0.00 H new ATOM 0 HA ILE A 55 13.642 -2.642 -21.248 1.00 0.00 H new ATOM 0 HB ILE A 55 13.337 -5.299 -19.796 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.175 -2.599 -19.030 1.00 0.00 H new ATOM 0 HG13 ILE A 55 11.249 -3.918 -19.718 1.00 0.00 H new ATOM 0 HG21 ILE A 55 14.566 -4.136 -18.005 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.505 -4.195 -19.516 1.00 0.00 H new ATOM 0 HG23 ILE A 55 14.689 -2.689 -19.034 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.993 -3.841 -17.286 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.813 -5.341 -17.780 1.00 0.00 H new ATOM 0 HD13 ILE A 55 12.754 -4.002 -17.083 1.00 0.00 H new ATOM 840 N GLY A 56 14.262 -5.657 -22.437 1.00 0.00 N ATOM 841 CA GLY A 56 15.255 -6.441 -23.149 1.00 0.00 C ATOM 842 C GLY A 56 15.885 -5.675 -24.296 1.00 0.00 C ATOM 843 O GLY A 56 17.039 -5.912 -24.649 1.00 0.00 O ATOM 0 H GLY A 56 13.355 -6.111 -22.329 1.00 0.00 H new ATOM 0 HA2 GLY A 56 16.034 -6.753 -22.453 1.00 0.00 H new ATOM 0 HA3 GLY A 56 14.789 -7.348 -23.534 1.00 0.00 H new ATOM 847 N ASN A 57 15.124 -4.754 -24.879 1.00 0.00 N ATOM 848 CA ASN A 57 15.614 -3.952 -25.994 1.00 0.00 C ATOM 849 C ASN A 57 16.872 -3.184 -25.600 1.00 0.00 C ATOM 850 O ASN A 57 17.661 -2.782 -26.456 1.00 0.00 O ATOM 851 CB ASN A 57 14.533 -2.976 -26.462 1.00 0.00 C ATOM 852 CG ASN A 57 13.729 -3.519 -27.628 1.00 0.00 C ATOM 853 OD1 ASN A 57 14.038 -4.582 -28.167 1.00 0.00 O ATOM 854 ND2 ASN A 57 12.693 -2.789 -28.022 1.00 0.00 N ATOM 0 H ASN A 57 14.166 -4.545 -24.598 1.00 0.00 H new ATOM 0 HA ASN A 57 15.863 -4.627 -26.813 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.861 -2.757 -25.632 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.999 -2.034 -26.753 1.00 0.00 H new ATOM 0 HD21 ASN A 57 12.115 -3.103 -28.802 1.00 0.00 H new ATOM 0 HD22 ASN A 57 12.475 -1.914 -27.545 1.00 0.00 H new ATOM 861 N LEU A 58 17.054 -2.985 -24.299 1.00 0.00 N ATOM 862 CA LEU A 58 18.217 -2.266 -23.791 1.00 0.00 C ATOM 863 C LEU A 58 19.017 -3.136 -22.827 1.00 0.00 C ATOM 864 O LEU A 58 18.954 -2.974 -21.608 1.00 0.00 O ATOM 865 CB LEU A 58 17.779 -0.979 -23.090 1.00 0.00 C ATOM 866 CG LEU A 58 16.937 -0.013 -23.925 1.00 0.00 C ATOM 867 CD1 LEU A 58 17.460 0.055 -25.351 1.00 0.00 C ATOM 868 CD2 LEU A 58 15.474 -0.430 -23.910 1.00 0.00 C ATOM 0 H LEU A 58 16.411 -3.311 -23.577 1.00 0.00 H new ATOM 0 HA LEU A 58 18.855 -2.013 -24.638 1.00 0.00 H new ATOM 0 HB2 LEU A 58 17.210 -1.249 -22.200 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.671 -0.452 -22.751 1.00 0.00 H new ATOM 0 HG LEU A 58 17.015 0.981 -23.484 1.00 0.00 H new ATOM 0 HD11 LEU A 58 16.849 0.747 -25.930 1.00 0.00 H new ATOM 0 HD12 LEU A 58 18.493 0.402 -25.343 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.414 -0.936 -25.803 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.890 0.269 -24.509 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.377 -1.433 -24.325 1.00 0.00 H new ATOM 0 HD23 LEU A 58 15.105 -0.425 -22.884 1.00 0.00 H new ATOM 880 N PRO A 59 19.789 -4.081 -23.384 1.00 0.00 N ATOM 881 CA PRO A 59 20.618 -4.994 -22.592 1.00 0.00 C ATOM 882 C PRO A 59 21.795 -4.283 -21.932 1.00 0.00 C ATOM 883 O PRO A 59 21.744 -3.947 -20.749 1.00 0.00 O ATOM 884 CB PRO A 59 21.117 -6.007 -23.625 1.00 0.00 C ATOM 885 CG PRO A 59 21.078 -5.276 -24.922 1.00 0.00 C ATOM 886 CD PRO A 59 19.912 -4.331 -24.830 1.00 0.00 C ATOM 0 HA PRO A 59 20.059 -5.442 -21.770 1.00 0.00 H new ATOM 0 HB2 PRO A 59 22.126 -6.346 -23.392 1.00 0.00 H new ATOM 0 HB3 PRO A 59 20.482 -6.892 -23.650 1.00 0.00 H new ATOM 0 HG2 PRO A 59 22.008 -4.733 -25.092 1.00 0.00 H new ATOM 0 HG3 PRO A 59 20.955 -5.967 -25.756 1.00 0.00 H new ATOM 0 HD2 PRO A 59 20.097 -3.410 -25.383 1.00 0.00 H new ATOM 0 HD3 PRO A 59 19.004 -4.772 -25.240 1.00 0.00 H new ATOM 894 N GLU A 60 22.853 -4.058 -22.704 1.00 0.00 N ATOM 895 CA GLU A 60 24.042 -3.387 -22.192 1.00 0.00 C ATOM 896 C GLU A 60 23.732 -1.941 -21.817 1.00 0.00 C ATOM 897 O GLU A 60 24.548 -1.259 -21.197 1.00 0.00 O ATOM 898 CB GLU A 60 25.164 -3.426 -23.232 1.00 0.00 C ATOM 899 CG GLU A 60 24.834 -2.675 -24.511 1.00 0.00 C ATOM 900 CD GLU A 60 26.010 -2.606 -25.467 1.00 0.00 C ATOM 901 OE1 GLU A 60 26.480 -3.677 -25.906 1.00 0.00 O ATOM 902 OE2 GLU A 60 26.460 -1.483 -25.775 1.00 0.00 O ATOM 0 H GLU A 60 22.911 -4.330 -23.685 1.00 0.00 H new ATOM 0 HA GLU A 60 24.368 -3.915 -21.296 1.00 0.00 H new ATOM 0 HB2 GLU A 60 26.068 -3.002 -22.795 1.00 0.00 H new ATOM 0 HB3 GLU A 60 25.385 -4.465 -23.477 1.00 0.00 H new ATOM 0 HG2 GLU A 60 23.995 -3.162 -25.008 1.00 0.00 H new ATOM 0 HG3 GLU A 60 24.513 -1.664 -24.262 1.00 0.00 H new ATOM 909 N VAL A 61 22.545 -1.478 -22.198 1.00 0.00 N ATOM 910 CA VAL A 61 22.125 -0.114 -21.901 1.00 0.00 C ATOM 911 C VAL A 61 21.334 -0.053 -20.600 1.00 0.00 C ATOM 912 O VAL A 61 21.686 0.687 -19.680 1.00 0.00 O ATOM 913 CB VAL A 61 21.267 0.469 -23.039 1.00 0.00 C ATOM 914 CG1 VAL A 61 20.531 1.715 -22.569 1.00 0.00 C ATOM 915 CG2 VAL A 61 22.129 0.776 -24.254 1.00 0.00 C ATOM 0 H VAL A 61 21.858 -2.028 -22.713 1.00 0.00 H new ATOM 0 HA VAL A 61 23.032 0.481 -21.799 1.00 0.00 H new ATOM 0 HB VAL A 61 20.525 -0.275 -23.328 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.930 2.113 -23.387 1.00 0.00 H new ATOM 0 HG12 VAL A 61 19.881 1.460 -21.732 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.254 2.466 -22.251 1.00 0.00 H new ATOM 0 HG21 VAL A 61 21.506 1.187 -25.048 1.00 0.00 H new ATOM 0 HG22 VAL A 61 22.896 1.502 -23.982 1.00 0.00 H new ATOM 0 HG23 VAL A 61 22.604 -0.140 -24.604 1.00 0.00 H new ATOM 925 N LEU A 62 20.263 -0.835 -20.528 1.00 0.00 N ATOM 926 CA LEU A 62 19.421 -0.872 -19.338 1.00 0.00 C ATOM 927 C LEU A 62 19.777 -2.063 -18.454 1.00 0.00 C ATOM 928 O LEU A 62 20.257 -1.895 -17.333 1.00 0.00 O ATOM 929 CB LEU A 62 17.945 -0.941 -19.735 1.00 0.00 C ATOM 930 CG LEU A 62 16.941 -0.509 -18.666 1.00 0.00 C ATOM 931 CD1 LEU A 62 17.218 0.917 -18.218 1.00 0.00 C ATOM 932 CD2 LEU A 62 15.517 -0.639 -19.188 1.00 0.00 C ATOM 0 H LEU A 62 19.957 -1.452 -21.280 1.00 0.00 H new ATOM 0 HA LEU A 62 19.597 0.042 -18.771 1.00 0.00 H new ATOM 0 HB2 LEU A 62 17.797 -0.317 -20.617 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.716 -1.966 -20.027 1.00 0.00 H new ATOM 0 HG LEU A 62 17.052 -1.167 -17.804 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.493 1.207 -17.457 1.00 0.00 H new ATOM 0 HD12 LEU A 62 18.224 0.979 -17.803 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.136 1.589 -19.072 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.816 -0.327 -18.414 1.00 0.00 H new ATOM 0 HD22 LEU A 62 15.392 -0.006 -20.067 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.322 -1.677 -19.458 1.00 0.00 H new ATOM 944 N ARG A 63 19.542 -3.266 -18.968 1.00 0.00 N ATOM 945 CA ARG A 63 19.839 -4.485 -18.227 1.00 0.00 C ATOM 946 C ARG A 63 21.191 -4.380 -17.526 1.00 0.00 C ATOM 947 O ARG A 63 21.381 -4.917 -16.435 1.00 0.00 O ATOM 948 CB ARG A 63 19.832 -5.693 -19.165 1.00 0.00 C ATOM 949 CG ARG A 63 18.501 -5.913 -19.866 1.00 0.00 C ATOM 950 CD ARG A 63 17.374 -6.122 -18.867 1.00 0.00 C ATOM 951 NE ARG A 63 16.720 -7.416 -19.043 1.00 0.00 N ATOM 952 CZ ARG A 63 17.183 -8.549 -18.527 1.00 0.00 C ATOM 953 NH1 ARG A 63 18.296 -8.549 -17.807 1.00 0.00 N ATOM 954 NH2 ARG A 63 16.531 -9.687 -18.732 1.00 0.00 N ATOM 0 H ARG A 63 19.147 -3.422 -19.895 1.00 0.00 H new ATOM 0 HA ARG A 63 19.066 -4.617 -17.470 1.00 0.00 H new ATOM 0 HB2 ARG A 63 20.611 -5.564 -19.916 1.00 0.00 H new ATOM 0 HB3 ARG A 63 20.084 -6.587 -18.594 1.00 0.00 H new ATOM 0 HG2 ARG A 63 18.275 -5.054 -20.497 1.00 0.00 H new ATOM 0 HG3 ARG A 63 18.573 -6.781 -20.522 1.00 0.00 H new ATOM 0 HD2 ARG A 63 17.770 -6.051 -17.854 1.00 0.00 H new ATOM 0 HD3 ARG A 63 16.638 -5.326 -18.979 1.00 0.00 H new ATOM 0 HE ARG A 63 15.861 -7.452 -19.592 1.00 0.00 H new ATOM 0 HH11 ARG A 63 18.800 -7.677 -17.647 1.00 0.00 H new ATOM 0 HH12 ARG A 63 18.648 -9.421 -17.412 1.00 0.00 H new ATOM 0 HH21 ARG A 63 15.674 -9.691 -19.286 1.00 0.00 H new ATOM 0 HH22 ARG A 63 16.887 -10.557 -18.336 1.00 0.00 H new ATOM 968 N LYS A 64 22.127 -3.683 -18.161 1.00 0.00 N ATOM 969 CA LYS A 64 23.462 -3.506 -17.600 1.00 0.00 C ATOM 970 C LYS A 64 23.442 -2.493 -16.459 1.00 0.00 C ATOM 971 O LYS A 64 24.018 -2.728 -15.398 1.00 0.00 O ATOM 972 CB LYS A 64 24.437 -3.047 -18.686 1.00 0.00 C ATOM 973 CG LYS A 64 25.770 -2.564 -18.142 1.00 0.00 C ATOM 974 CD LYS A 64 26.802 -2.411 -19.247 1.00 0.00 C ATOM 975 CE LYS A 64 27.339 -0.990 -19.316 1.00 0.00 C ATOM 976 NZ LYS A 64 27.792 -0.634 -20.689 1.00 0.00 N ATOM 0 H LYS A 64 21.986 -3.231 -19.065 1.00 0.00 H new ATOM 0 HA LYS A 64 23.794 -4.466 -17.205 1.00 0.00 H new ATOM 0 HB2 LYS A 64 24.613 -3.872 -19.376 1.00 0.00 H new ATOM 0 HB3 LYS A 64 23.976 -2.244 -19.260 1.00 0.00 H new ATOM 0 HG2 LYS A 64 25.633 -1.608 -17.637 1.00 0.00 H new ATOM 0 HG3 LYS A 64 26.136 -3.269 -17.396 1.00 0.00 H new ATOM 0 HD2 LYS A 64 27.626 -3.104 -19.076 1.00 0.00 H new ATOM 0 HD3 LYS A 64 26.354 -2.679 -20.204 1.00 0.00 H new ATOM 0 HE2 LYS A 64 26.564 -0.293 -18.997 1.00 0.00 H new ATOM 0 HE3 LYS A 64 28.171 -0.882 -18.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 28.151 0.342 -20.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 28.549 -1.283 -20.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 26.993 -0.712 -21.350 1.00 0.00 H new ATOM 990 N ASN A 65 22.774 -1.367 -16.686 1.00 0.00 N ATOM 991 CA ASN A 65 22.678 -0.318 -15.676 1.00 0.00 C ATOM 992 C ASN A 65 21.873 -0.796 -14.471 1.00 0.00 C ATOM 993 O ASN A 65 22.338 -0.726 -13.333 1.00 0.00 O ATOM 994 CB ASN A 65 22.032 0.934 -16.271 1.00 0.00 C ATOM 995 CG ASN A 65 23.040 1.830 -16.966 1.00 0.00 C ATOM 996 OD1 ASN A 65 23.184 3.004 -16.624 1.00 0.00 O ATOM 997 ND2 ASN A 65 23.744 1.278 -17.947 1.00 0.00 N ATOM 0 H ASN A 65 22.291 -1.157 -17.560 1.00 0.00 H new ATOM 0 HA ASN A 65 23.687 -0.074 -15.343 1.00 0.00 H new ATOM 0 HB2 ASN A 65 21.261 0.639 -16.983 1.00 0.00 H new ATOM 0 HB3 ASN A 65 21.536 1.495 -15.479 1.00 0.00 H new ATOM 0 HD21 ASN A 65 24.437 1.831 -18.451 1.00 0.00 H new ATOM 0 HD22 ASN A 65 23.591 0.301 -18.197 1.00 0.00 H new ATOM 1004 N LEU A 66 20.664 -1.282 -14.730 1.00 0.00 N ATOM 1005 CA LEU A 66 19.793 -1.772 -13.667 1.00 0.00 C ATOM 1006 C LEU A 66 20.440 -2.940 -12.928 1.00 0.00 C ATOM 1007 O LEU A 66 20.167 -3.170 -11.751 1.00 0.00 O ATOM 1008 CB LEU A 66 18.444 -2.202 -14.244 1.00 0.00 C ATOM 1009 CG LEU A 66 18.478 -3.369 -15.232 1.00 0.00 C ATOM 1010 CD1 LEU A 66 18.461 -4.697 -14.491 1.00 0.00 C ATOM 1011 CD2 LEU A 66 17.308 -3.281 -16.201 1.00 0.00 C ATOM 0 H LEU A 66 20.265 -1.347 -15.666 1.00 0.00 H new ATOM 0 HA LEU A 66 19.635 -0.960 -12.957 1.00 0.00 H new ATOM 0 HB2 LEU A 66 17.787 -2.471 -13.417 1.00 0.00 H new ATOM 0 HB3 LEU A 66 17.994 -1.343 -14.742 1.00 0.00 H new ATOM 0 HG LEU A 66 19.403 -3.309 -15.805 1.00 0.00 H new ATOM 0 HD11 LEU A 66 18.486 -5.515 -15.210 1.00 0.00 H new ATOM 0 HD12 LEU A 66 19.332 -4.761 -13.839 1.00 0.00 H new ATOM 0 HD13 LEU A 66 17.553 -4.768 -13.892 1.00 0.00 H new ATOM 0 HD21 LEU A 66 17.348 -4.119 -16.897 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.371 -3.316 -15.645 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.365 -2.345 -16.757 1.00 0.00 H new ATOM 1023 N ASN A 67 21.300 -3.672 -13.628 1.00 0.00 N ATOM 1024 CA ASN A 67 21.987 -4.815 -13.039 1.00 0.00 C ATOM 1025 C ASN A 67 22.584 -4.451 -11.683 1.00 0.00 C ATOM 1026 O ASN A 67 22.593 -5.264 -10.759 1.00 0.00 O ATOM 1027 CB ASN A 67 23.089 -5.314 -13.976 1.00 0.00 C ATOM 1028 CG ASN A 67 22.939 -6.785 -14.313 1.00 0.00 C ATOM 1029 OD1 ASN A 67 22.928 -7.638 -13.425 1.00 0.00 O ATOM 1030 ND2 ASN A 67 22.824 -7.089 -15.600 1.00 0.00 N ATOM 0 H ASN A 67 21.538 -3.494 -14.604 1.00 0.00 H new ATOM 0 HA ASN A 67 21.256 -5.610 -12.893 1.00 0.00 H new ATOM 0 HB2 ASN A 67 23.072 -4.730 -14.896 1.00 0.00 H new ATOM 0 HB3 ASN A 67 24.061 -5.148 -13.511 1.00 0.00 H new ATOM 0 HD21 ASN A 67 22.721 -8.062 -15.887 1.00 0.00 H new ATOM 0 HD22 ASN A 67 22.838 -6.349 -16.302 1.00 0.00 H new ATOM 1037 N GLU A 68 23.082 -3.223 -11.572 1.00 0.00 N ATOM 1038 CA GLU A 68 23.681 -2.752 -10.329 1.00 0.00 C ATOM 1039 C GLU A 68 22.814 -1.677 -9.681 1.00 0.00 C ATOM 1040 O GLU A 68 22.955 -1.383 -8.494 1.00 0.00 O ATOM 1041 CB GLU A 68 25.085 -2.202 -10.590 1.00 0.00 C ATOM 1042 CG GLU A 68 25.132 -1.147 -11.683 1.00 0.00 C ATOM 1043 CD GLU A 68 26.483 -0.464 -11.777 1.00 0.00 C ATOM 1044 OE1 GLU A 68 27.410 -1.063 -12.361 1.00 0.00 O ATOM 1045 OE2 GLU A 68 26.612 0.668 -11.267 1.00 0.00 O ATOM 0 H GLU A 68 23.082 -2.537 -12.327 1.00 0.00 H new ATOM 0 HA GLU A 68 23.751 -3.598 -9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 68 25.476 -1.774 -9.667 1.00 0.00 H new ATOM 0 HB3 GLU A 68 25.744 -3.026 -10.864 1.00 0.00 H new ATOM 0 HG2 GLU A 68 24.896 -1.611 -12.641 1.00 0.00 H new ATOM 0 HG3 GLU A 68 24.363 -0.398 -11.493 1.00 0.00 H new ATOM 1052 N SER A 69 21.917 -1.093 -10.470 1.00 0.00 N ATOM 1053 CA SER A 69 21.030 -0.047 -9.975 1.00 0.00 C ATOM 1054 C SER A 69 19.658 -0.618 -9.628 1.00 0.00 C ATOM 1055 O SER A 69 18.674 0.116 -9.533 1.00 0.00 O ATOM 1056 CB SER A 69 20.885 1.063 -11.017 1.00 0.00 C ATOM 1057 OG SER A 69 22.053 1.863 -11.077 1.00 0.00 O ATOM 0 H SER A 69 21.786 -1.327 -11.454 1.00 0.00 H new ATOM 0 HA SER A 69 21.470 0.370 -9.069 1.00 0.00 H new ATOM 0 HB2 SER A 69 20.691 0.624 -11.996 1.00 0.00 H new ATOM 0 HB3 SER A 69 20.026 1.687 -10.771 1.00 0.00 H new ATOM 0 HG SER A 69 21.935 2.564 -11.752 1.00 0.00 H new ATOM 1063 N VAL A 70 19.602 -1.932 -9.439 1.00 0.00 N ATOM 1064 CA VAL A 70 18.352 -2.603 -9.102 1.00 0.00 C ATOM 1065 C VAL A 70 17.987 -2.382 -7.638 1.00 0.00 C ATOM 1066 O VAL A 70 17.871 -3.335 -6.868 1.00 0.00 O ATOM 1067 CB VAL A 70 18.435 -4.116 -9.376 1.00 0.00 C ATOM 1068 CG1 VAL A 70 19.550 -4.747 -8.557 1.00 0.00 C ATOM 1069 CG2 VAL A 70 17.101 -4.785 -9.081 1.00 0.00 C ATOM 0 H VAL A 70 20.408 -2.553 -9.513 1.00 0.00 H new ATOM 0 HA VAL A 70 17.579 -2.169 -9.736 1.00 0.00 H new ATOM 0 HB VAL A 70 18.664 -4.264 -10.431 1.00 0.00 H new ATOM 0 HG11 VAL A 70 19.593 -5.816 -8.764 1.00 0.00 H new ATOM 0 HG12 VAL A 70 20.502 -4.287 -8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 70 19.355 -4.590 -7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.178 -5.854 -9.280 1.00 0.00 H new ATOM 0 HG22 VAL A 70 16.839 -4.629 -8.034 1.00 0.00 H new ATOM 0 HG23 VAL A 70 16.329 -4.352 -9.717 1.00 0.00 H new ATOM 1079 N GLN A 71 17.808 -1.120 -7.262 1.00 0.00 N ATOM 1080 CA GLN A 71 17.457 -0.775 -5.890 1.00 0.00 C ATOM 1081 C GLN A 71 16.016 -1.168 -5.582 1.00 0.00 C ATOM 1082 O GLN A 71 15.745 -1.987 -4.703 1.00 0.00 O ATOM 1083 CB GLN A 71 17.651 0.724 -5.653 1.00 0.00 C ATOM 1084 CG GLN A 71 18.823 1.050 -4.742 1.00 0.00 C ATOM 1085 CD GLN A 71 20.121 0.427 -5.216 1.00 0.00 C ATOM 1086 OE1 GLN A 71 20.839 -0.206 -4.442 1.00 0.00 O ATOM 1087 NE2 GLN A 71 20.430 0.603 -6.496 1.00 0.00 N ATOM 0 H GLN A 71 17.900 -0.320 -7.888 1.00 0.00 H new ATOM 0 HA GLN A 71 18.116 -1.329 -5.222 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.799 1.219 -6.613 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.739 1.136 -5.220 1.00 0.00 H new ATOM 0 HG2 GLN A 71 18.943 2.132 -4.684 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.603 0.699 -3.734 1.00 0.00 H new ATOM 0 HE21 GLN A 71 19.806 1.135 -7.103 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.291 0.206 -6.872 1.00 0.00 H new ATOM 1096 N PRO A 72 15.068 -0.572 -6.320 1.00 0.00 N ATOM 1097 CA PRO A 72 13.639 -0.844 -6.144 1.00 0.00 C ATOM 1098 C PRO A 72 13.255 -2.246 -6.606 1.00 0.00 C ATOM 1099 O PRO A 72 14.118 -3.069 -6.912 1.00 0.00 O ATOM 1100 CB PRO A 72 12.965 0.212 -7.023 1.00 0.00 C ATOM 1101 CG PRO A 72 13.982 0.547 -8.059 1.00 0.00 C ATOM 1102 CD PRO A 72 15.319 0.415 -7.384 1.00 0.00 C ATOM 0 HA PRO A 72 13.342 -0.798 -5.096 1.00 0.00 H new ATOM 0 HB2 PRO A 72 12.051 -0.174 -7.475 1.00 0.00 H new ATOM 0 HB3 PRO A 72 12.687 1.091 -6.442 1.00 0.00 H new ATOM 0 HG2 PRO A 72 13.907 -0.128 -8.912 1.00 0.00 H new ATOM 0 HG3 PRO A 72 13.834 1.558 -8.438 1.00 0.00 H new ATOM 0 HD2 PRO A 72 16.087 0.072 -8.077 1.00 0.00 H new ATOM 0 HD3 PRO A 72 15.659 1.367 -6.977 1.00 0.00 H new ATOM 1110 N THR A 73 11.953 -2.513 -6.654 1.00 0.00 N ATOM 1111 CA THR A 73 11.455 -3.815 -7.077 1.00 0.00 C ATOM 1112 C THR A 73 10.902 -3.757 -8.497 1.00 0.00 C ATOM 1113 O THR A 73 9.703 -3.563 -8.699 1.00 0.00 O ATOM 1114 CB THR A 73 10.355 -4.331 -6.131 1.00 0.00 C ATOM 1115 OG1 THR A 73 10.655 -3.958 -4.781 1.00 0.00 O ATOM 1116 CG2 THR A 73 10.223 -5.843 -6.227 1.00 0.00 C ATOM 0 H THR A 73 11.225 -1.844 -6.405 1.00 0.00 H new ATOM 0 HA THR A 73 12.301 -4.502 -7.047 1.00 0.00 H new ATOM 0 HB THR A 73 9.409 -3.880 -6.431 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.950 -4.288 -4.186 1.00 0.00 H new ATOM 0 HG21 THR A 73 9.440 -6.184 -5.550 1.00 0.00 H new ATOM 0 HG22 THR A 73 9.965 -6.122 -7.249 1.00 0.00 H new ATOM 0 HG23 THR A 73 11.169 -6.309 -5.951 1.00 0.00 H new ATOM 1124 N VAL A 74 11.783 -3.926 -9.478 1.00 0.00 N ATOM 1125 CA VAL A 74 11.382 -3.895 -10.879 1.00 0.00 C ATOM 1126 C VAL A 74 11.124 -5.301 -11.409 1.00 0.00 C ATOM 1127 O VAL A 74 11.966 -5.882 -12.093 1.00 0.00 O ATOM 1128 CB VAL A 74 12.453 -3.217 -11.754 1.00 0.00 C ATOM 1129 CG1 VAL A 74 12.004 -3.168 -13.206 1.00 0.00 C ATOM 1130 CG2 VAL A 74 12.759 -1.820 -11.235 1.00 0.00 C ATOM 0 H VAL A 74 12.779 -4.086 -9.328 1.00 0.00 H new ATOM 0 HA VAL A 74 10.460 -3.316 -10.931 1.00 0.00 H new ATOM 0 HB VAL A 74 13.367 -3.808 -11.701 1.00 0.00 H new ATOM 0 HG11 VAL A 74 12.773 -2.686 -13.809 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.840 -4.182 -13.571 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.076 -2.601 -13.281 1.00 0.00 H new ATOM 0 HG21 VAL A 74 13.518 -1.356 -11.865 1.00 0.00 H new ATOM 0 HG22 VAL A 74 11.851 -1.217 -11.256 1.00 0.00 H new ATOM 0 HG23 VAL A 74 13.128 -1.885 -10.211 1.00 0.00 H new ATOM 1140 N VAL A 75 9.954 -5.843 -11.088 1.00 0.00 N ATOM 1141 CA VAL A 75 9.583 -7.181 -11.532 1.00 0.00 C ATOM 1142 C VAL A 75 9.573 -7.271 -13.054 1.00 0.00 C ATOM 1143 O VAL A 75 8.587 -6.918 -13.701 1.00 0.00 O ATOM 1144 CB VAL A 75 8.198 -7.587 -10.996 1.00 0.00 C ATOM 1145 CG1 VAL A 75 7.859 -9.010 -11.413 1.00 0.00 C ATOM 1146 CG2 VAL A 75 8.149 -7.441 -9.482 1.00 0.00 C ATOM 0 H VAL A 75 9.246 -5.376 -10.522 1.00 0.00 H new ATOM 0 HA VAL A 75 10.332 -7.865 -11.135 1.00 0.00 H new ATOM 0 HB VAL A 75 7.452 -6.920 -11.427 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.877 -9.279 -11.025 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.850 -9.078 -12.501 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.607 -9.694 -11.013 1.00 0.00 H new ATOM 0 HG21 VAL A 75 7.163 -7.732 -9.120 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.905 -8.083 -9.030 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.344 -6.404 -9.210 1.00 0.00 H new ATOM 1156 N ALA A 76 10.677 -7.746 -13.621 1.00 0.00 N ATOM 1157 CA ALA A 76 10.795 -7.886 -15.067 1.00 0.00 C ATOM 1158 C ALA A 76 10.121 -9.165 -15.552 1.00 0.00 C ATOM 1159 O ALA A 76 10.332 -10.241 -14.990 1.00 0.00 O ATOM 1160 CB ALA A 76 12.259 -7.868 -15.481 1.00 0.00 C ATOM 0 H ALA A 76 11.503 -8.041 -13.100 1.00 0.00 H new ATOM 0 HA ALA A 76 10.287 -7.041 -15.532 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.332 -7.973 -16.563 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.712 -6.924 -15.177 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.783 -8.694 -15.000 1.00 0.00 H new ATOM 1166 N LEU A 77 9.310 -9.041 -16.597 1.00 0.00 N ATOM 1167 CA LEU A 77 8.605 -10.188 -17.157 1.00 0.00 C ATOM 1168 C LEU A 77 9.328 -10.724 -18.389 1.00 0.00 C ATOM 1169 O LEU A 77 9.009 -10.353 -19.518 1.00 0.00 O ATOM 1170 CB LEU A 77 7.170 -9.801 -17.522 1.00 0.00 C ATOM 1171 CG LEU A 77 6.196 -10.960 -17.735 1.00 0.00 C ATOM 1172 CD1 LEU A 77 4.928 -10.749 -16.922 1.00 0.00 C ATOM 1173 CD2 LEU A 77 5.865 -11.114 -19.212 1.00 0.00 C ATOM 0 H LEU A 77 9.125 -8.158 -17.073 1.00 0.00 H new ATOM 0 HA LEU A 77 8.583 -10.973 -16.402 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.775 -9.162 -16.732 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.197 -9.203 -18.433 1.00 0.00 H new ATOM 0 HG LEU A 77 6.674 -11.878 -17.392 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.247 -11.584 -17.087 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.180 -10.690 -15.863 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.447 -9.822 -17.233 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.171 -11.944 -19.345 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.408 -10.196 -19.580 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.779 -11.313 -19.771 1.00 0.00 H new ATOM 1185 N GLY A 78 10.302 -11.600 -18.164 1.00 0.00 N ATOM 1186 CA GLY A 78 11.053 -12.174 -19.265 1.00 0.00 C ATOM 1187 C GLY A 78 12.551 -12.067 -19.062 1.00 0.00 C ATOM 1188 O GLY A 78 13.019 -11.277 -18.243 1.00 0.00 O ATOM 0 H GLY A 78 10.585 -11.923 -17.239 1.00 0.00 H new ATOM 0 HA2 GLY A 78 10.779 -13.223 -19.380 1.00 0.00 H new ATOM 0 HA3 GLY A 78 10.778 -11.669 -20.191 1.00 0.00 H new ATOM 1370 N LYS A 92 52.529 -12.753 -26.699 1.00 0.00 N ATOM 1371 CA LYS A 92 53.228 -12.702 -27.978 1.00 0.00 C ATOM 1372 C LYS A 92 54.129 -11.474 -28.057 1.00 0.00 C ATOM 1373 O LYS A 92 55.265 -11.556 -28.524 1.00 0.00 O ATOM 1374 CB LYS A 92 52.223 -12.686 -29.132 1.00 0.00 C ATOM 1375 CG LYS A 92 52.867 -12.810 -30.502 1.00 0.00 C ATOM 1376 CD LYS A 92 51.926 -13.456 -31.504 1.00 0.00 C ATOM 1377 CE LYS A 92 50.875 -12.473 -31.996 1.00 0.00 C ATOM 1378 NZ LYS A 92 49.605 -13.157 -32.367 1.00 0.00 N ATOM 0 HA LYS A 92 53.850 -13.593 -28.059 1.00 0.00 H new ATOM 0 HB2 LYS A 92 51.515 -13.504 -28.997 1.00 0.00 H new ATOM 0 HB3 LYS A 92 51.651 -11.759 -29.091 1.00 0.00 H new ATOM 0 HG2 LYS A 92 53.158 -11.822 -30.859 1.00 0.00 H new ATOM 0 HG3 LYS A 92 53.779 -13.402 -30.424 1.00 0.00 H new ATOM 0 HD2 LYS A 92 52.498 -13.833 -32.352 1.00 0.00 H new ATOM 0 HD3 LYS A 92 51.436 -14.314 -31.044 1.00 0.00 H new ATOM 0 HE2 LYS A 92 50.676 -11.735 -31.219 1.00 0.00 H new ATOM 0 HE3 LYS A 92 51.261 -11.931 -32.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 48.915 -12.452 -32.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 49.789 -13.843 -33.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 49.223 -13.653 -31.537 1.00 0.00 H new ATOM 1392 N GLN A 93 53.615 -10.338 -27.597 1.00 0.00 N ATOM 1393 CA GLN A 93 54.374 -9.093 -27.616 1.00 0.00 C ATOM 1394 C GLN A 93 55.690 -9.247 -26.861 1.00 0.00 C ATOM 1395 O GLN A 93 56.651 -8.521 -27.114 1.00 0.00 O ATOM 1396 CB GLN A 93 53.550 -7.959 -27.003 1.00 0.00 C ATOM 1397 CG GLN A 93 52.952 -7.016 -28.035 1.00 0.00 C ATOM 1398 CD GLN A 93 51.777 -6.227 -27.492 1.00 0.00 C ATOM 1399 OE1 GLN A 93 51.846 -5.661 -26.400 1.00 0.00 O ATOM 1400 NE2 GLN A 93 50.689 -6.186 -28.252 1.00 0.00 N ATOM 0 H GLN A 93 52.676 -10.254 -27.207 1.00 0.00 H new ATOM 0 HA GLN A 93 54.598 -8.849 -28.654 1.00 0.00 H new ATOM 0 HB2 GLN A 93 52.746 -8.387 -26.405 1.00 0.00 H new ATOM 0 HB3 GLN A 93 54.182 -7.387 -26.324 1.00 0.00 H new ATOM 0 HG2 GLN A 93 53.721 -6.325 -28.379 1.00 0.00 H new ATOM 0 HG3 GLN A 93 52.629 -7.591 -28.903 1.00 0.00 H new ATOM 0 HE21 GLN A 93 50.676 -6.670 -29.150 1.00 0.00 H new ATOM 0 HE22 GLN A 93 49.867 -5.671 -27.938 1.00 0.00 H new ATOM 1409 N ALA A 94 55.726 -10.197 -25.932 1.00 0.00 N ATOM 1410 CA ALA A 94 56.925 -10.447 -25.141 1.00 0.00 C ATOM 1411 C ALA A 94 58.146 -10.627 -26.036 1.00 0.00 C ATOM 1412 O ALA A 94 59.245 -10.187 -25.700 1.00 0.00 O ATOM 1413 CB ALA A 94 56.729 -11.671 -24.259 1.00 0.00 C ATOM 0 H ALA A 94 54.939 -10.806 -25.709 1.00 0.00 H new ATOM 0 HA ALA A 94 57.099 -9.579 -24.505 1.00 0.00 H new ATOM 0 HB1 ALA A 94 57.632 -11.846 -23.674 1.00 0.00 H new ATOM 0 HB2 ALA A 94 55.888 -11.504 -23.587 1.00 0.00 H new ATOM 0 HB3 ALA A 94 56.527 -12.541 -24.884 1.00 0.00 H new ATOM 1419 N VAL A 95 57.946 -11.277 -27.178 1.00 0.00 N ATOM 1420 CA VAL A 95 59.031 -11.515 -28.123 1.00 0.00 C ATOM 1421 C VAL A 95 59.731 -10.213 -28.494 1.00 0.00 C ATOM 1422 O VAL A 95 60.921 -10.204 -28.807 1.00 0.00 O ATOM 1423 CB VAL A 95 58.518 -12.194 -29.407 1.00 0.00 C ATOM 1424 CG1 VAL A 95 57.785 -13.484 -29.073 1.00 0.00 C ATOM 1425 CG2 VAL A 95 57.619 -11.247 -30.187 1.00 0.00 C ATOM 0 H VAL A 95 57.042 -11.648 -27.471 1.00 0.00 H new ATOM 0 HA VAL A 95 59.741 -12.178 -27.630 1.00 0.00 H new ATOM 0 HB VAL A 95 59.375 -12.443 -30.033 1.00 0.00 H new ATOM 0 HG11 VAL A 95 57.430 -13.949 -29.993 1.00 0.00 H new ATOM 0 HG12 VAL A 95 58.463 -14.166 -28.560 1.00 0.00 H new ATOM 0 HG13 VAL A 95 56.935 -13.263 -28.427 1.00 0.00 H new ATOM 0 HG21 VAL A 95 57.266 -11.743 -31.091 1.00 0.00 H new ATOM 0 HG22 VAL A 95 56.766 -10.965 -29.570 1.00 0.00 H new ATOM 0 HG23 VAL A 95 58.181 -10.354 -30.459 1.00 0.00 H new ATOM 1435 N GLY A 96 58.985 -9.114 -28.456 1.00 0.00 N ATOM 1436 CA GLY A 96 59.552 -7.820 -28.791 1.00 0.00 C ATOM 1437 C GLY A 96 60.723 -7.453 -27.902 1.00 0.00 C ATOM 1438 O GLY A 96 61.538 -6.602 -28.257 1.00 0.00 O ATOM 0 H GLY A 96 57.998 -9.096 -28.199 1.00 0.00 H new ATOM 0 HA2 GLY A 96 59.878 -7.828 -29.831 1.00 0.00 H new ATOM 0 HA3 GLY A 96 58.780 -7.055 -28.704 1.00 0.00 H new ATOM 1442 N VAL A 97 60.807 -8.095 -26.741 1.00 0.00 N ATOM 1443 CA VAL A 97 61.887 -7.831 -25.798 1.00 0.00 C ATOM 1444 C VAL A 97 63.236 -8.239 -26.379 1.00 0.00 C ATOM 1445 O VAL A 97 64.251 -7.586 -26.135 1.00 0.00 O ATOM 1446 CB VAL A 97 61.666 -8.578 -24.469 1.00 0.00 C ATOM 1447 CG1 VAL A 97 62.817 -8.313 -23.510 1.00 0.00 C ATOM 1448 CG2 VAL A 97 60.338 -8.174 -23.846 1.00 0.00 C ATOM 0 H VAL A 97 60.140 -8.802 -26.431 1.00 0.00 H new ATOM 0 HA VAL A 97 61.886 -6.758 -25.608 1.00 0.00 H new ATOM 0 HB VAL A 97 61.635 -9.648 -24.674 1.00 0.00 H new ATOM 0 HG11 VAL A 97 62.644 -8.849 -22.577 1.00 0.00 H new ATOM 0 HG12 VAL A 97 63.750 -8.656 -23.957 1.00 0.00 H new ATOM 0 HG13 VAL A 97 62.883 -7.244 -23.308 1.00 0.00 H new ATOM 0 HG21 VAL A 97 60.198 -8.711 -22.908 1.00 0.00 H new ATOM 0 HG22 VAL A 97 60.338 -7.101 -23.653 1.00 0.00 H new ATOM 0 HG23 VAL A 97 59.526 -8.420 -24.530 1.00 0.00 H new ATOM 1458 N ASP A 98 63.240 -9.321 -27.149 1.00 0.00 N ATOM 1459 CA ASP A 98 64.465 -9.816 -27.767 1.00 0.00 C ATOM 1460 C ASP A 98 64.929 -8.879 -28.877 1.00 0.00 C ATOM 1461 O ASP A 98 66.093 -8.904 -29.279 1.00 0.00 O ATOM 1462 CB ASP A 98 64.247 -11.222 -28.327 1.00 0.00 C ATOM 1463 CG ASP A 98 65.316 -11.620 -29.325 1.00 0.00 C ATOM 1464 OD1 ASP A 98 66.465 -11.859 -28.899 1.00 0.00 O ATOM 1465 OD2 ASP A 98 65.004 -11.691 -30.532 1.00 0.00 O ATOM 0 H ASP A 98 62.409 -9.873 -27.360 1.00 0.00 H new ATOM 0 HA ASP A 98 65.240 -9.855 -27.001 1.00 0.00 H new ATOM 0 HB2 ASP A 98 64.235 -11.939 -27.506 1.00 0.00 H new ATOM 0 HB3 ASP A 98 63.270 -11.271 -28.807 1.00 0.00 H new ATOM 1470 N LEU A 99 64.012 -8.054 -29.371 1.00 0.00 N ATOM 1471 CA LEU A 99 64.327 -7.109 -30.437 1.00 0.00 C ATOM 1472 C LEU A 99 65.237 -5.996 -29.926 1.00 0.00 C ATOM 1473 O LEU A 99 66.278 -5.711 -30.519 1.00 0.00 O ATOM 1474 CB LEU A 99 63.042 -6.510 -31.010 1.00 0.00 C ATOM 1475 CG LEU A 99 63.201 -5.666 -32.275 1.00 0.00 C ATOM 1476 CD1 LEU A 99 63.215 -6.553 -33.511 1.00 0.00 C ATOM 1477 CD2 LEU A 99 62.087 -4.633 -32.371 1.00 0.00 C ATOM 0 H LEU A 99 63.044 -8.020 -29.050 1.00 0.00 H new ATOM 0 HA LEU A 99 64.852 -7.649 -31.225 1.00 0.00 H new ATOM 0 HB2 LEU A 99 62.350 -7.324 -31.225 1.00 0.00 H new ATOM 0 HB3 LEU A 99 62.578 -5.892 -30.241 1.00 0.00 H new ATOM 0 HG LEU A 99 64.154 -5.140 -32.220 1.00 0.00 H new ATOM 0 HD11 LEU A 99 63.329 -5.935 -34.401 1.00 0.00 H new ATOM 0 HD12 LEU A 99 64.048 -7.253 -33.447 1.00 0.00 H new ATOM 0 HD13 LEU A 99 62.278 -7.107 -33.572 1.00 0.00 H new ATOM 0 HD21 LEU A 99 62.216 -4.042 -33.277 1.00 0.00 H new ATOM 0 HD22 LEU A 99 61.123 -5.140 -32.403 1.00 0.00 H new ATOM 0 HD23 LEU A 99 62.123 -3.977 -31.501 1.00 0.00 H new ATOM 1489 N TRP A 100 64.838 -5.372 -28.824 1.00 0.00 N ATOM 1490 CA TRP A 100 65.619 -4.292 -28.232 1.00 0.00 C ATOM 1491 C TRP A 100 66.888 -4.830 -27.581 1.00 0.00 C ATOM 1492 O TRP A 100 67.886 -4.120 -27.462 1.00 0.00 O ATOM 1493 CB TRP A 100 64.781 -3.536 -27.199 1.00 0.00 C ATOM 1494 CG TRP A 100 64.991 -4.020 -25.796 1.00 0.00 C ATOM 1495 CD1 TRP A 100 64.219 -4.918 -25.115 1.00 0.00 C ATOM 1496 CD2 TRP A 100 66.040 -3.631 -24.903 1.00 0.00 C ATOM 1497 NE1 TRP A 100 64.725 -5.110 -23.852 1.00 0.00 N ATOM 1498 CE2 TRP A 100 65.843 -4.333 -23.698 1.00 0.00 C ATOM 1499 CE3 TRP A 100 67.128 -2.760 -25.005 1.00 0.00 C ATOM 1500 CZ2 TRP A 100 66.692 -4.188 -22.605 1.00 0.00 C ATOM 1501 CZ3 TRP A 100 67.971 -2.617 -23.919 1.00 0.00 C ATOM 1502 CH2 TRP A 100 67.750 -3.329 -22.732 1.00 0.00 C ATOM 0 H TRP A 100 63.978 -5.595 -28.322 1.00 0.00 H new ATOM 0 HA TRP A 100 65.906 -3.606 -29.029 1.00 0.00 H new ATOM 0 HB2 TRP A 100 65.025 -2.475 -27.250 1.00 0.00 H new ATOM 0 HB3 TRP A 100 63.726 -3.634 -27.456 1.00 0.00 H new ATOM 0 HD1 TRP A 100 63.340 -5.405 -25.511 1.00 0.00 H new ATOM 0 HE1 TRP A 100 64.332 -5.730 -23.144 1.00 0.00 H new ATOM 0 HE3 TRP A 100 67.307 -2.208 -25.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 66.522 -4.734 -21.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 68.814 -1.945 -23.986 1.00 0.00 H new ATOM 0 HH2 TRP A 100 68.428 -3.197 -21.901 1.00 0.00 H new ATOM 1513 N LYS A 101 66.843 -6.090 -27.161 1.00 0.00 N ATOM 1514 CA LYS A 101 67.990 -6.726 -26.522 1.00 0.00 C ATOM 1515 C LYS A 101 69.120 -6.940 -27.524 1.00 0.00 C ATOM 1516 O LYS A 101 70.235 -6.455 -27.330 1.00 0.00 O ATOM 1517 CB LYS A 101 67.579 -8.065 -25.906 1.00 0.00 C ATOM 1518 CG LYS A 101 68.491 -8.521 -24.780 1.00 0.00 C ATOM 1519 CD LYS A 101 68.974 -9.945 -24.997 1.00 0.00 C ATOM 1520 CE LYS A 101 70.365 -9.975 -25.612 1.00 0.00 C ATOM 1521 NZ LYS A 101 70.594 -11.214 -26.405 1.00 0.00 N ATOM 0 H LYS A 101 66.024 -6.691 -27.252 1.00 0.00 H new ATOM 0 HA LYS A 101 68.348 -6.065 -25.733 1.00 0.00 H new ATOM 0 HB2 LYS A 101 66.560 -7.984 -25.527 1.00 0.00 H new ATOM 0 HB3 LYS A 101 67.569 -8.827 -26.686 1.00 0.00 H new ATOM 0 HG2 LYS A 101 69.348 -7.851 -24.711 1.00 0.00 H new ATOM 0 HG3 LYS A 101 67.959 -8.457 -23.831 1.00 0.00 H new ATOM 0 HD2 LYS A 101 68.985 -10.476 -24.045 1.00 0.00 H new ATOM 0 HD3 LYS A 101 68.276 -10.472 -25.648 1.00 0.00 H new ATOM 0 HE2 LYS A 101 70.497 -9.104 -26.253 1.00 0.00 H new ATOM 0 HE3 LYS A 101 71.113 -9.906 -24.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 71.553 -11.196 -26.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 70.493 -12.045 -25.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 69.897 -11.267 -27.175 1.00 0.00 H new