USER MOD reduce.3.24.130724 H: found=0, std=0, add=675, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 677 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 81 MET CE :methyl 174:sc= -0.239 (180deg=-0.0263) USER MOD Set 1.2: A 153 MET CE :methyl 176:sc= -9.29! (180deg=-9.54!) USER MOD Set 2.1: A 35 SER OG : rot -160:sc= -1.55 USER MOD Set 2.2: A 69 SER OG : rot -22:sc= 0.583 USER MOD Set 2.3: A 71 THR OG1 : rot 34:sc= 0.133 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= -0.0216 (180deg=-0.0216) USER MOD Single : A 11 GLN : amide:sc= -0.0353 X(o=-0.035,f=0) USER MOD Single : A 13 THR OG1 : rot -101:sc= -0.278 USER MOD Single : A 16 GLN : amide:sc= -1.08 K(o=-1.1,f=-8.2!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc=-0.00839 K(o=-0.0084,f=-0.84) USER MOD Single : A 21 LYS NZ :NH3+ -157:sc= -0.0481 (180deg=-0.539) USER MOD Single : A 37 SER OG : rot -75:sc= -0.379! USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0433 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 155:sc=0.000978 (180deg=-0.402) USER MOD Single : A 45 MET CE :methyl 168:sc= -3.25 (180deg=-3.49) USER MOD Single : A 47 MET CE :methyl -141:sc= -3.8! (180deg=-5.99!) USER MOD Single : A 50 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.17) USER MOD Single : A 51 ASN : amide:sc= -2.56! C(o=-2.6!,f=-4.1!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 167:sc= -5.81! (180deg=-5.99!) USER MOD Single : A 80 MET CE :methyl -139:sc= -6.29! (180deg=-10.5!) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 154 MET CE :methyl -144:sc= -6.86! (180deg=-14.4!) USER MOD Single : A 155 GLN : amide:sc= -2.36! C(o=-2.4!,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 -8.663 5.908 12.295 1.00 0.00 N ATOM 45 CA ILE A 4 -9.700 6.132 11.299 1.00 0.00 C ATOM 46 C ILE A 4 -9.485 7.481 10.622 1.00 0.00 C ATOM 47 O ILE A 4 -9.477 7.587 9.394 1.00 0.00 O ATOM 48 CB ILE A 4 -11.076 6.103 11.964 1.00 0.00 C ATOM 49 CG1 ILE A 4 -12.159 6.277 10.892 1.00 0.00 C ATOM 50 CG2 ILE A 4 -11.162 7.218 13.010 1.00 0.00 C ATOM 51 CD1 ILE A 4 -12.477 7.760 10.694 1.00 0.00 C ATOM 0 HA ILE A 4 -9.648 5.342 10.550 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.229 5.147 12.465 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -11.822 5.842 9.951 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -13.061 5.741 11.186 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -12.143 7.197 13.484 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -10.391 7.068 13.766 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -11.013 8.183 12.526 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -13.247 7.868 9.930 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.834 8.184 11.632 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -11.576 8.286 10.378 1.00 0.00 H new ATOM 63 N TYR A 5 -9.270 8.509 11.430 1.00 0.00 N ATOM 64 CA TYR A 5 -9.020 9.837 10.891 1.00 0.00 C ATOM 65 C TYR A 5 -7.642 9.872 10.246 1.00 0.00 C ATOM 66 O TYR A 5 -7.404 10.616 9.292 1.00 0.00 O ATOM 67 CB TYR A 5 -9.104 10.876 11.997 1.00 0.00 C ATOM 68 CG TYR A 5 -10.495 10.859 12.594 1.00 0.00 C ATOM 69 CD1 TYR A 5 -10.703 11.329 13.894 1.00 0.00 C ATOM 70 CD2 TYR A 5 -11.576 10.369 11.851 1.00 0.00 C ATOM 71 CE1 TYR A 5 -11.985 11.312 14.451 1.00 0.00 C ATOM 72 CE2 TYR A 5 -12.861 10.354 12.408 1.00 0.00 C ATOM 73 CZ TYR A 5 -13.066 10.827 13.710 1.00 0.00 C ATOM 74 OH TYR A 5 -14.331 10.812 14.262 1.00 0.00 O ATOM 0 H TYR A 5 -9.263 8.451 12.448 1.00 0.00 H new ATOM 0 HA TYR A 5 -9.776 10.067 10.140 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -8.362 10.665 12.767 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -8.878 11.866 11.600 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -9.871 11.706 14.470 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -11.419 10.002 10.847 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -12.140 11.675 15.456 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -13.694 9.977 11.833 1.00 0.00 H new ATOM 0 HH TYR A 5 -14.967 10.445 13.613 1.00 0.00 H new ATOM 84 N LYS A 6 -6.737 9.047 10.756 1.00 0.00 N ATOM 85 CA LYS A 6 -5.392 8.978 10.202 1.00 0.00 C ATOM 86 C LYS A 6 -5.473 8.589 8.732 1.00 0.00 C ATOM 87 O LYS A 6 -4.832 9.192 7.869 1.00 0.00 O ATOM 88 CB LYS A 6 -4.572 7.938 10.970 1.00 0.00 C ATOM 89 CG LYS A 6 -4.042 8.570 12.257 1.00 0.00 C ATOM 90 CD LYS A 6 -2.678 9.208 11.987 1.00 0.00 C ATOM 91 CE LYS A 6 -2.832 10.391 11.022 1.00 0.00 C ATOM 92 NZ LYS A 6 -1.576 11.196 11.014 1.00 0.00 N1+ ATOM 0 H LYS A 6 -6.907 8.422 11.544 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.908 9.951 10.293 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.189 7.070 11.204 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.744 7.584 10.356 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.742 9.322 12.620 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.954 7.814 13.037 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.235 9.547 12.923 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.999 8.468 11.563 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.050 10.028 10.018 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.673 11.014 11.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.681 11.997 10.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.387 11.554 11.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.783 10.599 10.705 1.00 0.00 H new ATOM 106 N ALA A 7 -6.320 7.609 8.447 1.00 0.00 N ATOM 107 CA ALA A 7 -6.540 7.183 7.077 1.00 0.00 C ATOM 108 C ALA A 7 -7.175 8.324 6.295 1.00 0.00 C ATOM 109 O ALA A 7 -6.912 8.506 5.105 1.00 0.00 O ATOM 110 CB ALA A 7 -7.434 5.949 7.048 1.00 0.00 C ATOM 0 H ALA A 7 -6.862 7.098 9.144 1.00 0.00 H new ATOM 0 HA ALA A 7 -5.587 6.922 6.617 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.592 5.638 6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -6.956 5.140 7.601 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.394 6.184 7.507 1.00 0.00 H new ATOM 116 N ALA A 8 -8.014 9.101 6.979 1.00 0.00 N ATOM 117 CA ALA A 8 -8.682 10.236 6.348 1.00 0.00 C ATOM 118 C ALA A 8 -7.641 11.194 5.787 1.00 0.00 C ATOM 119 O ALA A 8 -7.788 11.706 4.678 1.00 0.00 O ATOM 120 CB ALA A 8 -9.533 10.980 7.381 1.00 0.00 C ATOM 0 H ALA A 8 -8.246 8.966 7.963 1.00 0.00 H new ATOM 0 HA ALA A 8 -9.320 9.868 5.544 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -10.028 11.825 6.903 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.283 10.303 7.790 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.894 11.342 8.186 1.00 0.00 H new ATOM 126 N VAL A 9 -6.574 11.416 6.549 1.00 0.00 N ATOM 127 CA VAL A 9 -5.503 12.299 6.104 1.00 0.00 C ATOM 128 C VAL A 9 -4.866 11.737 4.839 1.00 0.00 C ATOM 129 O VAL A 9 -4.641 12.457 3.866 1.00 0.00 O ATOM 130 CB VAL A 9 -4.441 12.428 7.199 1.00 0.00 C ATOM 131 CG1 VAL A 9 -3.233 13.188 6.652 1.00 0.00 C ATOM 132 CG2 VAL A 9 -5.020 13.183 8.395 1.00 0.00 C ATOM 0 H VAL A 9 -6.429 11.000 7.469 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.920 13.284 5.893 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.131 11.433 7.518 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.477 13.280 7.432 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.815 12.645 5.804 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.544 14.182 6.330 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.260 13.272 9.171 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.335 14.178 8.080 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.878 12.638 8.788 1.00 0.00 H new ATOM 142 N GLU A 10 -4.591 10.436 4.861 1.00 0.00 N ATOM 143 CA GLU A 10 -3.996 9.765 3.710 1.00 0.00 C ATOM 144 C GLU A 10 -4.998 9.672 2.565 1.00 0.00 C ATOM 145 O GLU A 10 -4.619 9.539 1.401 1.00 0.00 O ATOM 146 CB GLU A 10 -3.530 8.363 4.105 1.00 0.00 C ATOM 147 CG GLU A 10 -2.319 8.474 5.023 1.00 0.00 C ATOM 148 CD GLU A 10 -1.959 7.101 5.578 1.00 0.00 C ATOM 149 OE1 GLU A 10 -2.782 6.208 5.471 1.00 0.00 O ATOM 150 OE2 GLU A 10 -0.864 6.962 6.098 1.00 0.00 O1- ATOM 0 H GLU A 10 -4.770 9.828 5.660 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.138 10.349 3.376 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.335 7.829 4.609 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.274 7.788 3.215 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.473 8.887 4.474 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -2.534 9.161 5.841 1.00 0.00 H new ATOM 157 N GLN A 11 -6.279 9.739 2.909 1.00 0.00 N ATOM 158 CA GLN A 11 -7.338 9.658 1.912 1.00 0.00 C ATOM 159 C GLN A 11 -7.399 10.940 1.092 1.00 0.00 C ATOM 160 O GLN A 11 -7.713 10.910 -0.098 1.00 0.00 O ATOM 161 CB GLN A 11 -8.684 9.427 2.600 1.00 0.00 C ATOM 162 CG GLN A 11 -8.984 7.929 2.653 1.00 0.00 C ATOM 163 CD GLN A 11 -10.473 7.683 2.423 1.00 0.00 C ATOM 164 OE1 GLN A 11 -10.846 6.787 1.666 1.00 0.00 O ATOM 165 NE2 GLN A 11 -11.351 8.433 3.032 1.00 0.00 N ATOM 0 H GLN A 11 -6.608 9.849 3.868 1.00 0.00 H new ATOM 0 HA GLN A 11 -7.122 8.823 1.245 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.664 9.840 3.609 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.474 9.947 2.059 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -8.400 7.406 1.895 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -8.686 7.525 3.620 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -11.040 9.175 3.659 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -12.348 8.277 2.881 1.00 0.00 H new ATOM 174 N LEU A 12 -7.097 12.066 1.731 1.00 0.00 N ATOM 175 CA LEU A 12 -7.132 13.343 1.036 1.00 0.00 C ATOM 176 C LEU A 12 -6.110 13.358 -0.098 1.00 0.00 C ATOM 177 O LEU A 12 -4.938 13.038 0.103 1.00 0.00 O ATOM 178 CB LEU A 12 -6.839 14.490 2.011 1.00 0.00 C ATOM 179 CG LEU A 12 -7.848 14.459 3.165 1.00 0.00 C ATOM 180 CD1 LEU A 12 -7.841 15.805 3.892 1.00 0.00 C ATOM 181 CD2 LEU A 12 -9.248 14.166 2.617 1.00 0.00 C ATOM 0 H LEU A 12 -6.829 12.119 2.714 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.129 13.479 0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -5.825 14.399 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.897 15.446 1.491 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.570 13.674 3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -8.559 15.780 4.712 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.844 15.999 4.289 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.114 16.597 3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.963 14.144 3.439 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.532 14.945 1.909 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.246 13.200 2.112 1.00 0.00 H new ATOM 193 N THR A 13 -6.564 13.739 -1.289 1.00 0.00 N ATOM 194 CA THR A 13 -5.686 13.799 -2.454 1.00 0.00 C ATOM 195 C THR A 13 -4.690 14.936 -2.302 1.00 0.00 C ATOM 196 O THR A 13 -4.692 15.646 -1.296 1.00 0.00 O ATOM 197 CB THR A 13 -6.511 14.003 -3.727 1.00 0.00 C ATOM 198 OG1 THR A 13 -5.639 14.261 -4.818 1.00 0.00 O ATOM 199 CG2 THR A 13 -7.453 15.184 -3.532 1.00 0.00 C ATOM 0 H THR A 13 -7.530 14.010 -1.472 1.00 0.00 H new ATOM 0 HA THR A 13 -5.143 12.857 -2.528 1.00 0.00 H new ATOM 0 HB THR A 13 -7.093 13.106 -3.936 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.625 15.223 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 13 -8.042 15.333 -4.437 1.00 0.00 H new ATOM 0 HG22 THR A 13 -8.120 14.983 -2.693 1.00 0.00 H new ATOM 0 HG23 THR A 13 -6.872 16.083 -3.326 1.00 0.00 H new ATOM 207 N GLU A 14 -3.835 15.100 -3.299 1.00 0.00 N ATOM 208 CA GLU A 14 -2.832 16.148 -3.252 1.00 0.00 C ATOM 209 C GLU A 14 -3.480 17.526 -3.164 1.00 0.00 C ATOM 210 O GLU A 14 -3.060 18.365 -2.371 1.00 0.00 O ATOM 211 CB GLU A 14 -1.962 16.083 -4.504 1.00 0.00 C ATOM 212 CG GLU A 14 -1.085 14.831 -4.465 1.00 0.00 C ATOM 213 CD GLU A 14 -0.128 14.903 -3.278 1.00 0.00 C ATOM 214 OE1 GLU A 14 0.259 16.003 -2.921 1.00 0.00 O ATOM 215 OE2 GLU A 14 0.204 13.855 -2.747 1.00 0.00 O1- ATOM 0 H GLU A 14 -3.816 14.526 -4.142 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.221 15.993 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -2.591 16.069 -5.394 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.337 16.973 -4.569 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -1.710 13.941 -4.386 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -0.521 14.743 -5.393 1.00 0.00 H new ATOM 222 N GLU A 15 -4.505 17.755 -3.980 1.00 0.00 N ATOM 223 CA GLU A 15 -5.184 19.044 -3.981 1.00 0.00 C ATOM 224 C GLU A 15 -5.963 19.265 -2.689 1.00 0.00 C ATOM 225 O GLU A 15 -5.846 20.309 -2.051 1.00 0.00 O ATOM 226 CB GLU A 15 -6.152 19.112 -5.158 1.00 0.00 C ATOM 227 CG GLU A 15 -6.740 20.519 -5.253 1.00 0.00 C ATOM 228 CD GLU A 15 -7.553 20.653 -6.536 1.00 0.00 C ATOM 229 OE1 GLU A 15 -8.435 19.836 -6.744 1.00 0.00 O ATOM 230 OE2 GLU A 15 -7.282 21.571 -7.291 1.00 0.00 O1- ATOM 0 H GLU A 15 -4.879 17.074 -4.641 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.425 19.821 -4.066 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -5.634 18.859 -6.083 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -6.950 18.381 -5.029 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.373 20.718 -4.388 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -5.940 21.259 -5.239 1.00 0.00 H new ATOM 237 N GLN A 16 -6.760 18.271 -2.316 1.00 0.00 N ATOM 238 CA GLN A 16 -7.570 18.366 -1.108 1.00 0.00 C ATOM 239 C GLN A 16 -6.684 18.623 0.102 1.00 0.00 C ATOM 240 O GLN A 16 -6.927 19.548 0.879 1.00 0.00 O ATOM 241 CB GLN A 16 -8.357 17.070 -0.893 1.00 0.00 C ATOM 242 CG GLN A 16 -9.828 17.391 -0.620 1.00 0.00 C ATOM 243 CD GLN A 16 -10.720 16.446 -1.418 1.00 0.00 C ATOM 244 OE1 GLN A 16 -10.246 15.763 -2.326 1.00 0.00 O ATOM 245 NE2 GLN A 16 -11.992 16.367 -1.137 1.00 0.00 N ATOM 0 H GLN A 16 -6.863 17.395 -2.829 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.267 19.195 -1.227 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -8.272 16.433 -1.773 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -7.936 16.514 -0.056 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -10.039 17.293 0.445 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -10.041 18.424 -0.893 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -12.384 16.933 -0.385 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -12.594 15.739 -1.670 1.00 0.00 H new ATOM 254 N LYS A 17 -5.656 17.797 0.254 1.00 0.00 N ATOM 255 CA LYS A 17 -4.740 17.937 1.375 1.00 0.00 C ATOM 256 C LYS A 17 -4.029 19.285 1.299 1.00 0.00 C ATOM 257 O LYS A 17 -3.745 19.906 2.321 1.00 0.00 O ATOM 258 CB LYS A 17 -3.709 16.806 1.352 1.00 0.00 C ATOM 259 CG LYS A 17 -3.222 16.525 2.777 1.00 0.00 C ATOM 260 CD LYS A 17 -2.081 15.502 2.737 1.00 0.00 C ATOM 261 CE LYS A 17 -2.581 14.195 2.117 1.00 0.00 C ATOM 262 NZ LYS A 17 -1.483 13.185 2.133 1.00 0.00 N1+ ATOM 0 H LYS A 17 -5.438 17.029 -0.381 1.00 0.00 H new ATOM 0 HA LYS A 17 -5.307 17.883 2.304 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.151 15.906 0.924 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.867 17.081 0.717 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -2.880 17.449 3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.043 16.145 3.385 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -1.247 15.896 2.156 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -1.709 15.319 3.745 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -3.441 13.822 2.673 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -2.914 14.369 1.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -1.822 12.297 1.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -0.675 13.542 1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -1.185 13.011 3.114 1.00 0.00 H new ATOM 276 N ASN A 18 -3.741 19.729 0.077 1.00 0.00 N ATOM 277 CA ASN A 18 -3.055 21.002 -0.117 1.00 0.00 C ATOM 278 C ASN A 18 -3.881 22.138 0.475 1.00 0.00 C ATOM 279 O ASN A 18 -3.348 23.016 1.152 1.00 0.00 O ATOM 280 CB ASN A 18 -2.849 21.260 -1.612 1.00 0.00 C ATOM 281 CG ASN A 18 -1.673 22.208 -1.826 1.00 0.00 C ATOM 282 OD1 ASN A 18 -1.318 22.974 -0.929 1.00 0.00 O ATOM 283 ND2 ASN A 18 -1.036 22.195 -2.965 1.00 0.00 N ATOM 0 H ASN A 18 -3.969 19.232 -0.784 1.00 0.00 H new ATOM 0 HA ASN A 18 -2.088 20.956 0.384 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -2.665 20.318 -2.129 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -3.754 21.689 -2.043 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -0.243 22.820 -3.113 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -1.331 21.560 -3.707 1.00 0.00 H new ATOM 290 N GLU A 19 -5.189 22.106 0.233 1.00 0.00 N ATOM 291 CA GLU A 19 -6.073 23.136 0.764 1.00 0.00 C ATOM 292 C GLU A 19 -6.008 23.157 2.285 1.00 0.00 C ATOM 293 O GLU A 19 -5.781 24.204 2.899 1.00 0.00 O ATOM 294 CB GLU A 19 -7.514 22.867 0.321 1.00 0.00 C ATOM 295 CG GLU A 19 -7.823 23.657 -0.949 1.00 0.00 C ATOM 296 CD GLU A 19 -9.188 23.251 -1.497 1.00 0.00 C ATOM 297 OE1 GLU A 19 -10.040 22.886 -0.703 1.00 0.00 O ATOM 298 OE2 GLU A 19 -9.363 23.313 -2.704 1.00 0.00 O1- ATOM 0 H GLU A 19 -5.655 21.387 -0.321 1.00 0.00 H new ATOM 0 HA GLU A 19 -5.748 24.103 0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.655 21.801 0.140 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -8.206 23.150 1.114 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -7.811 24.726 -0.734 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -7.052 23.474 -1.698 1.00 0.00 H new ATOM 305 N PHE A 20 -6.180 21.988 2.891 1.00 0.00 N ATOM 306 CA PHE A 20 -6.129 21.882 4.341 1.00 0.00 C ATOM 307 C PHE A 20 -4.745 22.275 4.837 1.00 0.00 C ATOM 308 O PHE A 20 -4.601 22.883 5.897 1.00 0.00 O ATOM 309 CB PHE A 20 -6.458 20.450 4.782 1.00 0.00 C ATOM 310 CG PHE A 20 -7.877 20.111 4.386 1.00 0.00 C ATOM 311 CD1 PHE A 20 -8.133 18.998 3.576 1.00 0.00 C ATOM 312 CD2 PHE A 20 -8.937 20.912 4.830 1.00 0.00 C ATOM 313 CE1 PHE A 20 -9.449 18.687 3.209 1.00 0.00 C ATOM 314 CE2 PHE A 20 -10.252 20.600 4.464 1.00 0.00 C ATOM 315 CZ PHE A 20 -10.507 19.487 3.655 1.00 0.00 C ATOM 0 H PHE A 20 -6.354 21.109 2.405 1.00 0.00 H new ATOM 0 HA PHE A 20 -6.869 22.557 4.771 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -5.763 19.748 4.321 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.338 20.354 5.861 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -7.316 18.379 3.234 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.740 21.771 5.455 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.647 17.830 2.582 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -11.069 21.218 4.806 1.00 0.00 H new ATOM 0 HZ PHE A 20 -11.522 19.245 3.375 1.00 0.00 H new ATOM 325 N LYS A 21 -3.726 21.921 4.067 1.00 0.00 N ATOM 326 CA LYS A 21 -2.357 22.242 4.442 1.00 0.00 C ATOM 327 C LYS A 21 -2.206 23.750 4.595 1.00 0.00 C ATOM 328 O LYS A 21 -1.563 24.230 5.528 1.00 0.00 O ATOM 329 CB LYS A 21 -1.392 21.728 3.374 1.00 0.00 C ATOM 330 CG LYS A 21 0.048 21.977 3.823 1.00 0.00 C ATOM 331 CD LYS A 21 0.314 21.186 5.102 1.00 0.00 C ATOM 332 CE LYS A 21 1.794 21.293 5.475 1.00 0.00 C ATOM 333 NZ LYS A 21 2.617 20.584 4.452 1.00 0.00 N1+ ATOM 0 H LYS A 21 -3.820 21.416 3.186 1.00 0.00 H new ATOM 0 HA LYS A 21 -2.124 21.761 5.392 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.553 20.663 3.206 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.581 22.232 2.426 1.00 0.00 H new ATOM 0 HG2 LYS A 21 0.744 21.673 3.041 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.209 23.041 3.998 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.304 21.569 5.914 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.040 20.141 4.959 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.090 22.340 5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.964 20.858 6.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 3.531 20.313 4.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.115 19.731 4.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.779 21.213 3.640 1.00 0.00 H new ATOM 347 N ALA A 22 -2.819 24.497 3.677 1.00 0.00 N ATOM 348 CA ALA A 22 -2.761 25.951 3.732 1.00 0.00 C ATOM 349 C ALA A 22 -3.381 26.445 5.035 1.00 0.00 C ATOM 350 O ALA A 22 -2.847 27.339 5.693 1.00 0.00 O ATOM 351 CB ALA A 22 -3.525 26.544 2.550 1.00 0.00 C ATOM 0 H ALA A 22 -3.355 24.121 2.895 1.00 0.00 H new ATOM 0 HA ALA A 22 -1.719 26.266 3.685 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -3.479 27.632 2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -3.077 26.201 1.618 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.566 26.223 2.592 1.00 0.00 H new ATOM 357 N ALA A 23 -4.507 25.840 5.414 1.00 0.00 N ATOM 358 CA ALA A 23 -5.178 26.215 6.656 1.00 0.00 C ATOM 359 C ALA A 23 -4.264 25.948 7.844 1.00 0.00 C ATOM 360 O ALA A 23 -4.213 26.733 8.792 1.00 0.00 O ATOM 361 CB ALA A 23 -6.473 25.424 6.828 1.00 0.00 C ATOM 0 H ALA A 23 -4.968 25.098 4.886 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.415 27.278 6.608 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -6.958 25.718 7.759 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -7.140 25.631 5.991 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.247 24.358 6.857 1.00 0.00 H new ATOM 367 N PHE A 24 -3.538 24.836 7.784 1.00 0.00 N ATOM 368 CA PHE A 24 -2.621 24.477 8.857 1.00 0.00 C ATOM 369 C PHE A 24 -1.626 25.605 9.105 1.00 0.00 C ATOM 370 O PHE A 24 -1.426 26.034 10.241 1.00 0.00 O ATOM 371 CB PHE A 24 -1.862 23.199 8.491 1.00 0.00 C ATOM 372 CG PHE A 24 -0.558 23.140 9.258 1.00 0.00 C ATOM 373 CD1 PHE A 24 -0.537 22.819 10.626 1.00 0.00 C ATOM 374 CD2 PHE A 24 0.639 23.421 8.592 1.00 0.00 C ATOM 375 CE1 PHE A 24 0.683 22.783 11.317 1.00 0.00 C ATOM 376 CE2 PHE A 24 1.855 23.382 9.281 1.00 0.00 C ATOM 377 CZ PHE A 24 1.877 23.064 10.644 1.00 0.00 C ATOM 0 H PHE A 24 -3.567 24.173 7.009 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.200 24.308 9.765 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.471 22.325 8.722 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.665 23.176 7.419 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.459 22.600 11.144 1.00 0.00 H new ATOM 0 HD2 PHE A 24 0.624 23.669 7.541 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.701 22.538 12.369 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.777 23.597 8.762 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.816 23.036 11.176 1.00 0.00 H new ATOM 387 N ASP A 25 -1.006 26.085 8.030 1.00 0.00 N ATOM 388 CA ASP A 25 -0.037 27.168 8.139 1.00 0.00 C ATOM 389 C ASP A 25 -0.702 28.431 8.675 1.00 0.00 C ATOM 390 O ASP A 25 -0.137 29.135 9.512 1.00 0.00 O ATOM 391 CB ASP A 25 0.588 27.451 6.772 1.00 0.00 C ATOM 392 CG ASP A 25 1.644 28.542 6.895 1.00 0.00 C ATOM 393 OD1 ASP A 25 2.630 28.310 7.574 1.00 0.00 O ATOM 394 OD2 ASP A 25 1.453 29.593 6.308 1.00 0.00 O1- ATOM 0 H ASP A 25 -1.157 25.743 7.081 1.00 0.00 H new ATOM 0 HA ASP A 25 0.744 26.863 8.835 1.00 0.00 H new ATOM 0 HB2 ASP A 25 1.038 26.542 6.374 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.184 27.759 6.067 1.00 0.00 H new ATOM 399 N ILE A 26 -1.908 28.708 8.189 1.00 0.00 N ATOM 400 CA ILE A 26 -2.646 29.888 8.629 1.00 0.00 C ATOM 401 C ILE A 26 -2.891 29.828 10.130 1.00 0.00 C ATOM 402 O ILE A 26 -2.741 30.826 10.832 1.00 0.00 O ATOM 403 CB ILE A 26 -3.980 29.972 7.884 1.00 0.00 C ATOM 404 CG1 ILE A 26 -3.794 30.779 6.596 1.00 0.00 C ATOM 405 CG2 ILE A 26 -5.033 30.652 8.763 1.00 0.00 C ATOM 406 CD1 ILE A 26 -3.825 29.836 5.392 1.00 0.00 C ATOM 0 H ILE A 26 -2.392 28.137 7.496 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.055 30.777 8.407 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.316 28.964 7.642 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.582 31.526 6.506 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.846 31.317 6.625 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.978 30.706 8.223 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.171 30.076 9.678 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.701 31.659 9.015 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.693 30.411 4.476 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.021 29.105 5.481 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -4.784 29.318 5.360 1.00 0.00 H new ATOM 418 N PHE A 27 -3.258 28.649 10.621 1.00 0.00 N ATOM 419 CA PHE A 27 -3.505 28.483 12.046 1.00 0.00 C ATOM 420 C PHE A 27 -2.240 28.787 12.842 1.00 0.00 C ATOM 421 O PHE A 27 -2.296 29.403 13.906 1.00 0.00 O ATOM 422 CB PHE A 27 -3.961 27.060 12.350 1.00 0.00 C ATOM 423 CG PHE A 27 -5.460 27.002 12.395 1.00 0.00 C ATOM 424 CD1 PHE A 27 -6.190 26.888 11.216 1.00 0.00 C ATOM 425 CD2 PHE A 27 -6.114 27.050 13.629 1.00 0.00 C ATOM 426 CE1 PHE A 27 -7.584 26.821 11.264 1.00 0.00 C ATOM 427 CE2 PHE A 27 -7.509 26.989 13.681 1.00 0.00 C ATOM 428 CZ PHE A 27 -8.246 26.872 12.497 1.00 0.00 C ATOM 0 H PHE A 27 -3.389 27.806 10.062 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.292 29.180 12.336 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -3.585 26.378 11.588 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.547 26.732 13.304 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -5.679 26.851 10.265 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -5.542 27.134 14.541 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -8.152 26.730 10.350 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.017 27.032 14.633 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.324 26.821 12.534 1.00 0.00 H new ATOM 438 N VAL A 28 -1.099 28.356 12.314 1.00 0.00 N ATOM 439 CA VAL A 28 0.181 28.588 12.975 1.00 0.00 C ATOM 440 C VAL A 28 0.960 29.682 12.263 1.00 0.00 C ATOM 441 O VAL A 28 2.185 29.728 12.334 1.00 0.00 O ATOM 442 CB VAL A 28 1.011 27.307 12.999 1.00 0.00 C ATOM 443 CG1 VAL A 28 0.428 26.344 14.026 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.975 26.654 11.619 1.00 0.00 C ATOM 0 H VAL A 28 -1.034 27.846 11.433 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.021 28.903 13.999 1.00 0.00 H new ATOM 0 HB VAL A 28 2.041 27.546 13.265 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.020 25.429 14.044 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.447 26.808 15.012 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.601 26.105 13.758 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.567 25.739 11.634 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.056 26.415 11.356 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.388 27.341 10.880 1.00 0.00 H new ATOM 454 N LEU A 29 0.243 30.555 11.564 1.00 0.00 N ATOM 455 CA LEU A 29 0.886 31.641 10.833 1.00 0.00 C ATOM 456 C LEU A 29 1.773 32.454 11.772 1.00 0.00 C ATOM 457 O LEU A 29 1.279 33.227 12.594 1.00 0.00 O ATOM 458 CB LEU A 29 -0.181 32.546 10.210 1.00 0.00 C ATOM 459 CG LEU A 29 0.328 33.103 8.881 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.488 32.499 7.739 1.00 0.00 C ATOM 461 CD2 LEU A 29 0.167 34.624 8.870 1.00 0.00 C ATOM 0 H LEU A 29 -0.774 30.533 11.488 1.00 0.00 H new ATOM 0 HA LEU A 29 1.506 31.219 10.042 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.101 31.984 10.051 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.421 33.363 10.890 1.00 0.00 H new ATOM 0 HG LEU A 29 1.381 32.849 8.756 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.130 32.893 6.788 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.378 31.415 7.747 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.539 32.758 7.866 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.530 35.021 7.922 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.886 34.879 8.991 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.742 35.057 9.689 1.00 0.00 H new ATOM 473 N GLY A 30 3.085 32.273 11.643 1.00 0.00 N ATOM 474 CA GLY A 30 4.038 32.986 12.486 1.00 0.00 C ATOM 475 C GLY A 30 4.481 32.131 13.670 1.00 0.00 C ATOM 476 O GLY A 30 5.242 32.583 14.524 1.00 0.00 O ATOM 0 H GLY A 30 3.510 31.641 10.965 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.908 33.270 11.894 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.585 33.908 12.850 1.00 0.00 H new ATOM 480 N ALA A 31 4.001 30.891 13.713 1.00 0.00 N ATOM 481 CA ALA A 31 4.358 29.978 14.795 1.00 0.00 C ATOM 482 C ALA A 31 5.824 29.572 14.688 1.00 0.00 C ATOM 483 O ALA A 31 6.310 29.245 13.604 1.00 0.00 O ATOM 484 CB ALA A 31 3.468 28.732 14.742 1.00 0.00 C ATOM 0 H ALA A 31 3.368 30.497 13.017 1.00 0.00 H new ATOM 0 HA ALA A 31 4.205 30.489 15.746 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.740 28.056 15.552 1.00 0.00 H new ATOM 0 HB2 ALA A 31 2.424 29.026 14.850 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.606 28.227 13.786 1.00 0.00 H new ATOM 490 N GLU A 32 6.528 29.603 15.816 1.00 0.00 N ATOM 491 CA GLU A 32 7.942 29.244 15.828 1.00 0.00 C ATOM 492 C GLU A 32 8.133 27.758 15.539 1.00 0.00 C ATOM 493 O GLU A 32 9.029 27.372 14.788 1.00 0.00 O ATOM 494 CB GLU A 32 8.547 29.570 17.193 1.00 0.00 C ATOM 495 CG GLU A 32 8.512 31.083 17.418 1.00 0.00 C ATOM 496 CD GLU A 32 9.192 31.429 18.738 1.00 0.00 C ATOM 497 OE1 GLU A 32 8.938 30.742 19.712 1.00 0.00 O ATOM 498 OE2 GLU A 32 9.961 32.377 18.752 1.00 0.00 O1- ATOM 0 H GLU A 32 6.148 29.870 16.724 1.00 0.00 H new ATOM 0 HA GLU A 32 8.443 29.820 15.050 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.990 29.062 17.980 1.00 0.00 H new ATOM 0 HB3 GLU A 32 9.574 29.208 17.244 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.014 31.593 16.596 1.00 0.00 H new ATOM 0 HG3 GLU A 32 7.480 31.434 17.428 1.00 0.00 H new ATOM 505 N ASP A 33 7.281 26.931 16.138 1.00 0.00 N ATOM 506 CA ASP A 33 7.367 25.487 15.943 1.00 0.00 C ATOM 507 C ASP A 33 6.474 25.053 14.785 1.00 0.00 C ATOM 508 O ASP A 33 6.661 23.978 14.211 1.00 0.00 O ATOM 509 CB ASP A 33 6.947 24.760 17.223 1.00 0.00 C ATOM 510 CG ASP A 33 7.131 23.256 17.053 1.00 0.00 C ATOM 511 OD1 ASP A 33 7.504 22.843 15.967 1.00 0.00 O ATOM 512 OD2 ASP A 33 6.893 22.537 18.010 1.00 0.00 O1- ATOM 0 H ASP A 33 6.529 27.233 16.758 1.00 0.00 H new ATOM 0 HA ASP A 33 8.399 25.229 15.706 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.542 25.115 18.064 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.905 24.984 17.453 1.00 0.00 H new ATOM 517 N GLY A 34 5.497 25.890 14.456 1.00 0.00 N ATOM 518 CA GLY A 34 4.573 25.590 13.370 1.00 0.00 C ATOM 519 C GLY A 34 3.380 24.793 13.884 1.00 0.00 C ATOM 520 O GLY A 34 2.408 24.572 13.159 1.00 0.00 O ATOM 0 H GLY A 34 5.325 26.779 14.925 1.00 0.00 H new ATOM 0 HA2 GLY A 34 4.228 26.517 12.913 1.00 0.00 H new ATOM 0 HA3 GLY A 34 5.088 25.024 12.594 1.00 0.00 H new ATOM 524 N SER A 35 3.458 24.367 15.141 1.00 0.00 N ATOM 525 CA SER A 35 2.375 23.598 15.743 1.00 0.00 C ATOM 526 C SER A 35 1.230 24.522 16.150 1.00 0.00 C ATOM 527 O SER A 35 1.460 25.601 16.694 1.00 0.00 O ATOM 528 CB SER A 35 2.879 22.838 16.967 1.00 0.00 C ATOM 529 OG SER A 35 3.029 23.746 18.052 1.00 0.00 O ATOM 0 H SER A 35 4.252 24.539 15.757 1.00 0.00 H new ATOM 0 HA SER A 35 2.012 22.883 15.005 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.178 22.047 17.233 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.832 22.358 16.745 1.00 0.00 H new ATOM 0 HG SER A 35 3.632 23.360 18.721 1.00 0.00 H new ATOM 535 N ILE A 36 0.001 24.098 15.875 1.00 0.00 N ATOM 536 CA ILE A 36 -1.163 24.907 16.209 1.00 0.00 C ATOM 537 C ILE A 36 -1.462 24.852 17.703 1.00 0.00 C ATOM 538 O ILE A 36 -1.951 23.848 18.211 1.00 0.00 O ATOM 539 CB ILE A 36 -2.379 24.409 15.426 1.00 0.00 C ATOM 540 CG1 ILE A 36 -2.155 24.626 13.926 1.00 0.00 C ATOM 541 CG2 ILE A 36 -3.629 25.167 15.883 1.00 0.00 C ATOM 542 CD1 ILE A 36 -3.258 23.913 13.140 1.00 0.00 C ATOM 0 H ILE A 36 -0.213 23.207 15.426 1.00 0.00 H new ATOM 0 HA ILE A 36 -0.947 25.941 15.940 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.517 23.344 15.613 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.160 25.692 13.697 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.178 24.242 13.633 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.495 24.811 15.324 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.789 24.996 16.948 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.494 26.233 15.703 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.101 24.066 12.072 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.231 22.846 13.362 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.229 24.319 13.426 1.00 0.00 H new ATOM 554 N SER A 37 -1.189 25.954 18.394 1.00 0.00 N ATOM 555 CA SER A 37 -1.451 26.039 19.826 1.00 0.00 C ATOM 556 C SER A 37 -2.739 26.819 20.071 1.00 0.00 C ATOM 557 O SER A 37 -3.351 27.334 19.140 1.00 0.00 O ATOM 558 CB SER A 37 -0.297 26.734 20.542 1.00 0.00 C ATOM 559 OG SER A 37 -0.412 28.138 20.368 1.00 0.00 O ATOM 0 H SER A 37 -0.787 26.799 17.987 1.00 0.00 H new ATOM 0 HA SER A 37 -1.553 25.027 20.218 1.00 0.00 H new ATOM 0 HB2 SER A 37 -0.310 26.486 21.603 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.656 26.384 20.145 1.00 0.00 H new ATOM 0 HG SER A 37 -0.151 28.377 19.454 1.00 0.00 H new ATOM 565 N THR A 38 -3.155 26.891 21.329 1.00 0.00 N ATOM 566 CA THR A 38 -4.380 27.601 21.667 1.00 0.00 C ATOM 567 C THR A 38 -4.318 29.036 21.160 1.00 0.00 C ATOM 568 O THR A 38 -5.323 29.586 20.711 1.00 0.00 O ATOM 569 CB THR A 38 -4.600 27.579 23.174 1.00 0.00 C ATOM 570 OG1 THR A 38 -3.342 27.606 23.840 1.00 0.00 O ATOM 571 CG2 THR A 38 -5.375 26.316 23.558 1.00 0.00 C ATOM 0 H THR A 38 -2.669 26.472 22.122 1.00 0.00 H new ATOM 0 HA THR A 38 -5.219 27.101 21.184 1.00 0.00 H new ATOM 0 HB THR A 38 -5.177 28.454 23.473 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.485 27.594 24.809 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.533 26.300 24.636 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.339 26.312 23.050 1.00 0.00 H new ATOM 0 HG23 THR A 38 -4.805 25.435 23.261 1.00 0.00 H new ATOM 579 N LYS A 39 -3.131 29.629 21.208 1.00 0.00 N ATOM 580 CA LYS A 39 -2.951 30.993 20.719 1.00 0.00 C ATOM 581 C LYS A 39 -3.027 31.022 19.192 1.00 0.00 C ATOM 582 O LYS A 39 -3.724 31.854 18.611 1.00 0.00 O ATOM 583 CB LYS A 39 -1.601 31.534 21.191 1.00 0.00 C ATOM 584 CG LYS A 39 -1.803 32.358 22.463 1.00 0.00 C ATOM 585 CD LYS A 39 -2.075 33.816 22.086 1.00 0.00 C ATOM 586 CE LYS A 39 -0.797 34.636 22.276 1.00 0.00 C ATOM 587 NZ LYS A 39 -1.056 36.055 21.901 1.00 0.00 N1+ ATOM 0 H LYS A 39 -2.286 29.193 21.576 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.747 31.622 21.117 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.913 30.710 21.383 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.151 32.150 20.413 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -2.637 31.958 23.040 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.918 32.293 23.096 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -2.410 33.879 21.051 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -2.875 34.220 22.706 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -0.466 34.577 23.313 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.005 34.227 21.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.187 36.612 22.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -1.353 36.102 20.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -1.809 36.442 22.505 1.00 0.00 H new ATOM 601 N GLU A 40 -2.326 30.087 18.555 1.00 0.00 N ATOM 602 CA GLU A 40 -2.334 29.977 17.098 1.00 0.00 C ATOM 603 C GLU A 40 -3.668 29.428 16.603 1.00 0.00 C ATOM 604 O GLU A 40 -4.028 29.593 15.438 1.00 0.00 O ATOM 605 CB GLU A 40 -1.185 29.090 16.627 1.00 0.00 C ATOM 606 CG GLU A 40 0.105 29.908 16.581 1.00 0.00 C ATOM 607 CD GLU A 40 0.667 30.103 17.984 1.00 0.00 C ATOM 608 OE1 GLU A 40 0.006 29.706 18.923 1.00 0.00 O ATOM 609 OE2 GLU A 40 1.753 30.647 18.097 1.00 0.00 O1- ATOM 0 H GLU A 40 -1.744 29.394 19.026 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.200 30.974 16.679 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.066 28.242 17.301 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.406 28.684 15.640 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.841 29.402 15.956 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.089 30.878 16.123 1.00 0.00 H new ATOM 616 N LEU A 41 -4.393 28.758 17.490 1.00 0.00 N ATOM 617 CA LEU A 41 -5.687 28.189 17.136 1.00 0.00 C ATOM 618 C LEU A 41 -6.786 29.242 17.219 1.00 0.00 C ATOM 619 O LEU A 41 -7.581 29.396 16.297 1.00 0.00 O ATOM 620 CB LEU A 41 -6.017 27.022 18.064 1.00 0.00 C ATOM 621 CG LEU A 41 -7.202 26.249 17.488 1.00 0.00 C ATOM 622 CD1 LEU A 41 -6.850 24.765 17.388 1.00 0.00 C ATOM 623 CD2 LEU A 41 -8.408 26.427 18.408 1.00 0.00 C ATOM 0 H LEU A 41 -4.108 28.596 18.456 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.631 27.829 16.109 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.153 26.366 18.166 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.257 27.390 19.062 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.437 26.628 16.494 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.698 24.217 16.977 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -5.986 24.639 16.736 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.615 24.379 18.380 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.258 25.878 18.004 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.168 26.045 19.400 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.659 27.485 18.478 1.00 0.00 H new ATOM 635 N GLY A 42 -6.827 29.969 18.330 1.00 0.00 N ATOM 636 CA GLY A 42 -7.841 31.002 18.509 1.00 0.00 C ATOM 637 C GLY A 42 -7.699 32.102 17.457 1.00 0.00 C ATOM 638 O GLY A 42 -8.695 32.641 16.977 1.00 0.00 O ATOM 0 H GLY A 42 -6.179 29.865 19.111 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.834 30.557 18.442 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.752 31.434 19.506 1.00 0.00 H new ATOM 642 N LYS A 43 -6.459 32.446 17.102 1.00 0.00 N ATOM 643 CA LYS A 43 -6.229 33.494 16.102 1.00 0.00 C ATOM 644 C LYS A 43 -7.147 33.281 14.895 1.00 0.00 C ATOM 645 O LYS A 43 -7.963 34.139 14.563 1.00 0.00 O ATOM 646 CB LYS A 43 -4.770 33.464 15.652 1.00 0.00 C ATOM 647 CG LYS A 43 -4.363 32.024 15.354 1.00 0.00 C ATOM 648 CD LYS A 43 -4.116 31.854 13.855 1.00 0.00 C ATOM 649 CE LYS A 43 -2.645 32.135 13.545 1.00 0.00 C ATOM 650 NZ LYS A 43 -2.545 33.338 12.674 1.00 0.00 N1+ ATOM 0 H LYS A 43 -5.612 32.024 17.483 1.00 0.00 H new ATOM 0 HA LYS A 43 -6.450 34.464 16.547 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.639 34.082 14.764 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.129 33.882 16.429 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.462 31.769 15.911 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.146 31.340 15.683 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.377 30.842 13.545 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -4.754 32.535 13.291 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.091 32.295 14.470 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -2.196 31.275 13.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -1.612 33.780 12.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -2.665 33.058 11.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -3.288 34.018 12.934 1.00 0.00 H new ATOM 664 N VAL A 44 -7.042 32.111 14.277 1.00 0.00 N ATOM 665 CA VAL A 44 -7.898 31.761 13.146 1.00 0.00 C ATOM 666 C VAL A 44 -9.355 31.720 13.587 1.00 0.00 C ATOM 667 O VAL A 44 -10.258 32.062 12.824 1.00 0.00 O ATOM 668 CB VAL A 44 -7.484 30.403 12.571 1.00 0.00 C ATOM 669 CG1 VAL A 44 -8.632 29.843 11.752 1.00 0.00 C ATOM 670 CG2 VAL A 44 -6.269 30.583 11.660 1.00 0.00 C ATOM 0 H VAL A 44 -6.373 31.387 14.539 1.00 0.00 H new ATOM 0 HA VAL A 44 -7.785 32.519 12.371 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.235 29.723 13.385 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.346 28.876 11.339 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.508 29.721 12.389 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.868 30.530 10.939 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -5.975 29.617 11.251 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.523 31.260 10.844 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.442 31.001 12.234 1.00 0.00 H new ATOM 680 N MET A 45 -9.581 31.295 14.821 1.00 0.00 N ATOM 681 CA MET A 45 -10.935 31.215 15.346 1.00 0.00 C ATOM 682 C MET A 45 -11.587 32.597 15.292 1.00 0.00 C ATOM 683 O MET A 45 -12.736 32.729 14.884 1.00 0.00 O ATOM 684 CB MET A 45 -10.892 30.725 16.794 1.00 0.00 C ATOM 685 CG MET A 45 -10.478 29.253 16.834 1.00 0.00 C ATOM 686 SD MET A 45 -11.801 28.234 16.140 1.00 0.00 S ATOM 687 CE MET A 45 -12.909 28.319 17.565 1.00 0.00 C ATOM 0 H MET A 45 -8.852 31.003 15.472 1.00 0.00 H new ATOM 0 HA MET A 45 -11.517 30.517 14.744 1.00 0.00 H new ATOM 0 HB2 MET A 45 -10.188 31.326 17.369 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.870 30.849 17.258 1.00 0.00 H new ATOM 0 HG2 MET A 45 -9.558 29.108 16.268 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.272 28.950 17.861 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.890 27.935 17.286 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.502 27.719 18.379 1.00 0.00 H new ATOM 0 HE3 MET A 45 -13.004 29.355 17.891 1.00 0.00 H new ATOM 697 N ARG A 46 -10.828 33.627 15.659 1.00 0.00 N ATOM 698 CA ARG A 46 -11.329 34.999 15.604 1.00 0.00 C ATOM 699 C ARG A 46 -11.562 35.405 14.154 1.00 0.00 C ATOM 700 O ARG A 46 -12.480 36.162 13.846 1.00 0.00 O ATOM 701 CB ARG A 46 -10.342 35.957 16.266 1.00 0.00 C ATOM 702 CG ARG A 46 -10.292 35.671 17.768 1.00 0.00 C ATOM 703 CD ARG A 46 -9.312 36.631 18.444 1.00 0.00 C ATOM 704 NE ARG A 46 -9.820 37.999 18.364 1.00 0.00 N ATOM 705 CZ ARG A 46 -9.286 38.894 17.536 1.00 0.00 C ATOM 706 NH1 ARG A 46 -8.286 38.566 16.762 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 -9.768 40.106 17.494 1.00 0.00 N ATOM 0 H ARG A 46 -9.869 33.539 15.996 1.00 0.00 H new ATOM 0 HA ARG A 46 -12.273 35.049 16.146 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -9.351 35.837 15.828 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -10.645 36.989 16.090 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.285 35.784 18.203 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -9.984 34.640 17.941 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -9.172 36.346 19.487 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.336 36.567 17.962 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.603 38.275 18.957 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.909 37.619 16.790 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -7.882 39.257 16.130 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.551 40.365 18.094 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.362 40.795 16.861 1.00 0.00 H new ATOM 721 N MET A 47 -10.726 34.881 13.270 1.00 0.00 N ATOM 722 CA MET A 47 -10.844 35.178 11.852 1.00 0.00 C ATOM 723 C MET A 47 -12.213 34.737 11.342 1.00 0.00 C ATOM 724 O MET A 47 -12.813 35.397 10.493 1.00 0.00 O ATOM 725 CB MET A 47 -9.738 34.460 11.075 1.00 0.00 C ATOM 726 CG MET A 47 -8.390 35.103 11.397 1.00 0.00 C ATOM 727 SD MET A 47 -7.316 35.012 9.943 1.00 0.00 S ATOM 728 CE MET A 47 -7.531 33.248 9.609 1.00 0.00 C ATOM 0 H MET A 47 -9.961 34.250 13.509 1.00 0.00 H new ATOM 0 HA MET A 47 -10.740 36.253 11.703 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.721 33.403 11.339 1.00 0.00 H new ATOM 0 HB3 MET A 47 -9.934 34.518 10.004 1.00 0.00 H new ATOM 0 HG2 MET A 47 -8.532 36.142 11.693 1.00 0.00 H new ATOM 0 HG3 MET A 47 -7.923 34.593 12.240 1.00 0.00 H new ATOM 0 HE1 MET A 47 -6.580 32.818 9.295 1.00 0.00 H new ATOM 0 HE2 MET A 47 -7.875 32.746 10.513 1.00 0.00 H new ATOM 0 HE3 MET A 47 -8.268 33.115 8.817 1.00 0.00 H new ATOM 738 N LEU A 48 -12.698 33.614 11.859 1.00 0.00 N ATOM 739 CA LEU A 48 -13.996 33.086 11.452 1.00 0.00 C ATOM 740 C LEU A 48 -15.114 33.698 12.294 1.00 0.00 C ATOM 741 O LEU A 48 -16.287 33.378 12.108 1.00 0.00 O ATOM 742 CB LEU A 48 -14.008 31.573 11.627 1.00 0.00 C ATOM 743 CG LEU A 48 -12.831 30.972 10.871 1.00 0.00 C ATOM 744 CD1 LEU A 48 -12.815 29.472 11.094 1.00 0.00 C ATOM 745 CD2 LEU A 48 -12.967 31.260 9.376 1.00 0.00 C ATOM 0 H LEU A 48 -12.214 33.052 12.559 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.162 33.342 10.405 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -13.945 31.317 12.685 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -14.945 31.159 11.254 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.904 31.414 11.235 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.975 29.033 10.556 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.713 29.264 12.159 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -13.746 29.040 10.728 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.121 30.826 8.843 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -13.893 30.822 9.004 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.984 32.338 9.213 1.00 0.00 H new ATOM 757 N GLY A 49 -14.739 34.577 13.222 1.00 0.00 N ATOM 758 CA GLY A 49 -15.714 35.220 14.096 1.00 0.00 C ATOM 759 C GLY A 49 -15.760 34.543 15.463 1.00 0.00 C ATOM 760 O GLY A 49 -16.620 34.845 16.289 1.00 0.00 O ATOM 0 H GLY A 49 -13.772 34.858 13.386 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.459 36.273 14.217 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.701 35.182 13.635 1.00 0.00 H new ATOM 764 N GLN A 50 -14.832 33.621 15.692 1.00 0.00 N ATOM 765 CA GLN A 50 -14.779 32.902 16.961 1.00 0.00 C ATOM 766 C GLN A 50 -13.783 33.552 17.910 1.00 0.00 C ATOM 767 O GLN A 50 -12.647 33.824 17.537 1.00 0.00 O ATOM 768 CB GLN A 50 -14.346 31.464 16.722 1.00 0.00 C ATOM 769 CG GLN A 50 -15.237 30.833 15.647 1.00 0.00 C ATOM 770 CD GLN A 50 -16.704 30.950 16.051 1.00 0.00 C ATOM 771 OE1 GLN A 50 -17.472 31.665 15.407 1.00 0.00 O ATOM 772 NE2 GLN A 50 -17.145 30.278 17.080 1.00 0.00 N ATOM 0 H GLN A 50 -14.111 33.355 15.022 1.00 0.00 H new ATOM 0 HA GLN A 50 -15.774 32.930 17.405 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.303 31.435 16.408 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.416 30.893 17.648 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -15.074 31.329 14.690 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -14.971 29.785 15.512 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -16.508 29.686 17.613 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -18.126 30.345 17.351 1.00 0.00 H new ATOM 781 N ASN A 51 -14.197 33.776 19.147 1.00 0.00 N ATOM 782 CA ASN A 51 -13.302 34.383 20.116 1.00 0.00 C ATOM 783 C ASN A 51 -13.234 33.553 21.387 1.00 0.00 C ATOM 784 O ASN A 51 -13.561 34.027 22.475 1.00 0.00 O ATOM 785 CB ASN A 51 -13.795 35.787 20.452 1.00 0.00 C ATOM 786 CG ASN A 51 -12.788 36.517 21.338 1.00 0.00 C ATOM 787 OD1 ASN A 51 -12.221 35.923 22.254 1.00 0.00 O ATOM 788 ND2 ASN A 51 -12.532 37.778 21.117 1.00 0.00 N ATOM 0 H ASN A 51 -15.128 33.552 19.498 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.304 34.432 19.682 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -13.954 36.351 19.533 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.757 35.728 20.960 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.861 38.273 21.704 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -13.003 38.268 20.357 1.00 0.00 H new ATOM 795 N PRO A 52 -12.801 32.334 21.267 1.00 0.00 N ATOM 796 CA PRO A 52 -12.667 31.414 22.426 1.00 0.00 C ATOM 797 C PRO A 52 -11.437 31.725 23.275 1.00 0.00 C ATOM 798 O PRO A 52 -10.357 31.995 22.744 1.00 0.00 O ATOM 799 CB PRO A 52 -12.558 30.037 21.772 1.00 0.00 C ATOM 800 CG PRO A 52 -11.978 30.282 20.418 1.00 0.00 C ATOM 801 CD PRO A 52 -12.393 31.694 20.003 1.00 0.00 C ATOM 0 HA PRO A 52 -13.504 31.497 23.119 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.921 29.374 22.357 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -13.535 29.559 21.700 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.892 30.190 20.441 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -12.345 29.546 19.702 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.569 32.230 19.533 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -13.212 31.674 19.284 1.00 0.00 H new ATOM 809 N THR A 53 -11.600 31.670 24.591 1.00 0.00 N ATOM 810 CA THR A 53 -10.490 31.936 25.497 1.00 0.00 C ATOM 811 C THR A 53 -9.493 30.787 25.470 1.00 0.00 C ATOM 812 O THR A 53 -9.844 29.647 25.168 1.00 0.00 O ATOM 813 CB THR A 53 -11.011 32.133 26.923 1.00 0.00 C ATOM 814 OG1 THR A 53 -11.739 30.980 27.324 1.00 0.00 O ATOM 815 CG2 THR A 53 -11.911 33.366 26.973 1.00 0.00 C ATOM 0 H THR A 53 -12.482 31.446 25.052 1.00 0.00 H new ATOM 0 HA THR A 53 -9.988 32.846 25.169 1.00 0.00 H new ATOM 0 HB THR A 53 -10.172 32.279 27.603 1.00 0.00 H new ATOM 0 HG1 THR A 53 -12.072 31.104 28.237 1.00 0.00 H new ATOM 0 HG21 THR A 53 -12.281 33.505 27.989 1.00 0.00 H new ATOM 0 HG22 THR A 53 -11.341 34.245 26.671 1.00 0.00 H new ATOM 0 HG23 THR A 53 -12.754 33.229 26.295 1.00 0.00 H new ATOM 823 N PRO A 54 -8.264 31.073 25.783 1.00 0.00 N ATOM 824 CA PRO A 54 -7.177 30.052 25.807 1.00 0.00 C ATOM 825 C PRO A 54 -7.531 28.872 26.707 1.00 0.00 C ATOM 826 O PRO A 54 -7.180 27.728 26.413 1.00 0.00 O ATOM 827 CB PRO A 54 -5.977 30.817 26.364 1.00 0.00 C ATOM 828 CG PRO A 54 -6.253 32.245 26.050 1.00 0.00 C ATOM 829 CD PRO A 54 -7.767 32.408 26.140 1.00 0.00 C ATOM 0 HA PRO A 54 -6.993 29.620 24.823 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -5.873 30.662 27.438 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.047 30.484 25.903 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -5.747 32.905 26.755 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -5.891 32.503 25.055 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -8.083 32.702 27.141 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -8.132 33.172 25.453 1.00 0.00 H new ATOM 837 N GLU A 55 -8.225 29.158 27.806 1.00 0.00 N ATOM 838 CA GLU A 55 -8.616 28.112 28.745 1.00 0.00 C ATOM 839 C GLU A 55 -9.534 27.101 28.061 1.00 0.00 C ATOM 840 O GLU A 55 -9.396 25.893 28.255 1.00 0.00 O ATOM 841 CB GLU A 55 -9.339 28.735 29.942 1.00 0.00 C ATOM 842 CG GLU A 55 -8.348 29.538 30.781 1.00 0.00 C ATOM 843 CD GLU A 55 -9.090 30.327 31.855 1.00 0.00 C ATOM 844 OE1 GLU A 55 -10.309 30.328 31.824 1.00 0.00 O ATOM 845 OE2 GLU A 55 -8.427 30.922 32.690 1.00 0.00 O1- ATOM 0 H GLU A 55 -8.526 30.097 28.066 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.719 27.598 29.090 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.145 29.382 29.596 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.796 27.954 30.550 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.625 28.867 31.246 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.786 30.219 30.142 1.00 0.00 H new ATOM 852 N GLU A 56 -10.459 27.601 27.243 1.00 0.00 N ATOM 853 CA GLU A 56 -11.381 26.733 26.514 1.00 0.00 C ATOM 854 C GLU A 56 -10.709 26.174 25.262 1.00 0.00 C ATOM 855 O GLU A 56 -10.905 25.011 24.899 1.00 0.00 O ATOM 856 CB GLU A 56 -12.640 27.508 26.126 1.00 0.00 C ATOM 857 CG GLU A 56 -13.824 27.001 26.942 1.00 0.00 C ATOM 858 CD GLU A 56 -15.120 27.605 26.411 1.00 0.00 C ATOM 859 OE1 GLU A 56 -15.341 28.780 26.644 1.00 0.00 O ATOM 860 OE2 GLU A 56 -15.871 26.880 25.778 1.00 0.00 O1- ATOM 0 H GLU A 56 -10.589 28.598 27.069 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.660 25.903 27.163 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.493 28.573 26.303 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.840 27.387 25.061 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.872 25.913 26.891 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.693 27.265 27.991 1.00 0.00 H new ATOM 867 N LEU A 57 -9.893 27.005 24.624 1.00 0.00 N ATOM 868 CA LEU A 57 -9.166 26.588 23.435 1.00 0.00 C ATOM 869 C LEU A 57 -8.225 25.442 23.761 1.00 0.00 C ATOM 870 O LEU A 57 -7.952 24.588 22.919 1.00 0.00 O ATOM 871 CB LEU A 57 -8.386 27.753 22.845 1.00 0.00 C ATOM 872 CG LEU A 57 -9.353 28.675 22.115 1.00 0.00 C ATOM 873 CD1 LEU A 57 -8.631 29.938 21.717 1.00 0.00 C ATOM 874 CD2 LEU A 57 -9.842 28.001 20.844 1.00 0.00 C ATOM 0 H LEU A 57 -9.720 27.968 24.910 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.891 26.247 22.697 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.868 28.298 23.634 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.623 27.387 22.158 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.192 28.899 22.773 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.320 30.601 21.194 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.253 30.438 22.609 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.798 29.689 21.060 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.534 28.663 20.324 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.992 27.784 20.197 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.351 27.071 21.098 1.00 0.00 H new ATOM 886 N GLN A 58 -7.722 25.430 24.990 1.00 0.00 N ATOM 887 CA GLN A 58 -6.798 24.389 25.414 1.00 0.00 C ATOM 888 C GLN A 58 -7.463 23.016 25.288 1.00 0.00 C ATOM 889 O GLN A 58 -6.845 22.060 24.820 1.00 0.00 O ATOM 890 CB GLN A 58 -6.385 24.628 26.866 1.00 0.00 C ATOM 891 CG GLN A 58 -5.234 23.693 27.228 1.00 0.00 C ATOM 892 CD GLN A 58 -4.859 23.867 28.696 1.00 0.00 C ATOM 893 OE1 GLN A 58 -5.640 23.522 29.583 1.00 0.00 O ATOM 894 NE2 GLN A 58 -3.706 24.393 29.008 1.00 0.00 N ATOM 0 H GLN A 58 -7.937 26.125 25.705 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.914 24.417 24.777 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -6.081 25.666 27.003 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -7.232 24.454 27.530 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.522 22.659 27.038 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.371 23.905 26.597 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.060 24.678 28.272 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -3.451 24.519 29.988 1.00 0.00 H new ATOM 903 N GLU A 59 -8.729 22.929 25.691 1.00 0.00 N ATOM 904 CA GLU A 59 -9.465 21.673 25.596 1.00 0.00 C ATOM 905 C GLU A 59 -9.692 21.294 24.135 1.00 0.00 C ATOM 906 O GLU A 59 -9.531 20.131 23.740 1.00 0.00 O ATOM 907 CB GLU A 59 -10.818 21.808 26.301 1.00 0.00 C ATOM 908 CG GLU A 59 -11.570 20.479 26.231 1.00 0.00 C ATOM 909 CD GLU A 59 -12.945 20.622 26.876 1.00 0.00 C ATOM 910 OE1 GLU A 59 -13.488 21.715 26.831 1.00 0.00 O ATOM 911 OE2 GLU A 59 -13.434 19.639 27.408 1.00 0.00 O1- ATOM 0 H GLU A 59 -9.261 23.706 26.083 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.877 20.892 26.077 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -10.670 22.099 27.341 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.407 22.595 25.831 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.677 20.167 25.192 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -11.000 19.702 26.740 1.00 0.00 H new ATOM 918 N MET A 60 -10.062 22.284 23.329 1.00 0.00 N ATOM 919 CA MET A 60 -10.310 22.043 21.913 1.00 0.00 C ATOM 920 C MET A 60 -9.052 21.513 21.238 1.00 0.00 C ATOM 921 O MET A 60 -9.120 20.636 20.375 1.00 0.00 O ATOM 922 CB MET A 60 -10.765 23.335 21.229 1.00 0.00 C ATOM 923 CG MET A 60 -12.292 23.442 21.295 1.00 0.00 C ATOM 924 SD MET A 60 -12.803 23.810 22.992 1.00 0.00 S ATOM 925 CE MET A 60 -12.700 25.612 22.873 1.00 0.00 C ATOM 0 H MET A 60 -10.195 23.250 23.628 1.00 0.00 H new ATOM 0 HA MET A 60 -11.099 21.297 21.821 1.00 0.00 H new ATOM 0 HB2 MET A 60 -10.309 24.197 21.717 1.00 0.00 H new ATOM 0 HB3 MET A 60 -10.434 23.344 20.190 1.00 0.00 H new ATOM 0 HG2 MET A 60 -12.641 24.225 20.622 1.00 0.00 H new ATOM 0 HG3 MET A 60 -12.747 22.509 20.962 1.00 0.00 H new ATOM 0 HE1 MET A 60 -13.192 26.062 23.735 1.00 0.00 H new ATOM 0 HE2 MET A 60 -11.653 25.916 22.853 1.00 0.00 H new ATOM 0 HE3 MET A 60 -13.192 25.945 21.959 1.00 0.00 H new ATOM 935 N ILE A 61 -7.903 22.045 21.633 1.00 0.00 N ATOM 936 CA ILE A 61 -6.633 21.615 21.060 1.00 0.00 C ATOM 937 C ILE A 61 -6.393 20.136 21.349 1.00 0.00 C ATOM 938 O ILE A 61 -6.030 19.367 20.460 1.00 0.00 O ATOM 939 CB ILE A 61 -5.497 22.417 21.669 1.00 0.00 C ATOM 940 CG1 ILE A 61 -5.652 23.890 21.247 1.00 0.00 C ATOM 941 CG2 ILE A 61 -4.178 21.823 21.169 1.00 0.00 C ATOM 942 CD1 ILE A 61 -4.301 24.519 20.917 1.00 0.00 C ATOM 0 H ILE A 61 -7.823 22.772 22.344 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.671 21.775 19.982 1.00 0.00 H new ATOM 0 HB ILE A 61 -5.511 22.373 22.758 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.307 23.954 20.378 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.130 24.452 22.049 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.344 22.382 21.592 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.109 20.780 21.477 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.141 21.884 20.081 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.446 25.559 20.623 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.656 24.477 21.795 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.835 23.972 20.098 1.00 0.00 H new ATOM 954 N ASP A 62 -6.608 19.748 22.602 1.00 0.00 N ATOM 955 CA ASP A 62 -6.422 18.362 23.013 1.00 0.00 C ATOM 956 C ASP A 62 -7.277 17.438 22.162 1.00 0.00 C ATOM 957 O ASP A 62 -6.950 16.264 21.979 1.00 0.00 O ATOM 958 CB ASP A 62 -6.789 18.206 24.486 1.00 0.00 C ATOM 959 CG ASP A 62 -6.645 16.747 24.911 1.00 0.00 C ATOM 960 OD1 ASP A 62 -6.264 15.941 24.079 1.00 0.00 O ATOM 961 OD2 ASP A 62 -6.922 16.457 26.063 1.00 0.00 O1- ATOM 0 H ASP A 62 -6.911 20.373 23.349 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.375 18.091 22.874 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.144 18.836 25.098 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.813 18.542 24.651 1.00 0.00 H new ATOM 966 N GLU A 63 -8.375 17.971 21.643 1.00 0.00 N ATOM 967 CA GLU A 63 -9.272 17.177 20.812 1.00 0.00 C ATOM 968 C GLU A 63 -8.467 16.373 19.791 1.00 0.00 C ATOM 969 O GLU A 63 -8.799 15.227 19.492 1.00 0.00 O ATOM 970 CB GLU A 63 -10.232 18.098 20.061 1.00 0.00 C ATOM 971 CG GLU A 63 -11.563 17.383 19.841 1.00 0.00 C ATOM 972 CD GLU A 63 -12.364 17.368 21.141 1.00 0.00 C ATOM 973 OE1 GLU A 63 -12.015 18.121 22.036 1.00 0.00 O ATOM 974 OE2 GLU A 63 -13.314 16.608 21.221 1.00 0.00 O1- ATOM 0 H GLU A 63 -8.665 18.939 21.780 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.832 16.499 21.455 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.390 19.015 20.628 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -9.800 18.386 19.103 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.131 17.886 19.059 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.386 16.363 19.500 1.00 0.00 H new ATOM 981 N VAL A 64 -7.405 16.981 19.266 1.00 0.00 N ATOM 982 CA VAL A 64 -6.554 16.308 18.287 1.00 0.00 C ATOM 983 C VAL A 64 -5.122 16.198 18.801 1.00 0.00 C ATOM 984 O VAL A 64 -4.313 15.441 18.259 1.00 0.00 O ATOM 985 CB VAL A 64 -6.575 17.073 16.961 1.00 0.00 C ATOM 986 CG1 VAL A 64 -7.742 16.567 16.112 1.00 0.00 C ATOM 987 CG2 VAL A 64 -6.776 18.563 17.242 1.00 0.00 C ATOM 0 H VAL A 64 -7.115 17.931 19.500 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.942 15.302 18.128 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.634 16.920 16.433 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.764 17.107 15.165 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.617 15.502 15.919 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.678 16.731 16.645 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.792 19.112 16.300 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.722 18.711 17.764 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.958 18.930 17.862 1.00 0.00 H new ATOM 997 N ASP A 65 -4.820 16.944 19.856 1.00 0.00 N ATOM 998 CA ASP A 65 -3.487 16.911 20.443 1.00 0.00 C ATOM 999 C ASP A 65 -3.379 15.780 21.462 1.00 0.00 C ATOM 1000 O ASP A 65 -3.245 16.018 22.661 1.00 0.00 O ATOM 1001 CB ASP A 65 -3.185 18.243 21.126 1.00 0.00 C ATOM 1002 CG ASP A 65 -1.808 18.194 21.771 1.00 0.00 C ATOM 1003 OD1 ASP A 65 -0.832 18.306 21.049 1.00 0.00 O ATOM 1004 OD2 ASP A 65 -1.751 18.028 22.979 1.00 0.00 O1- ATOM 0 H ASP A 65 -5.474 17.574 20.320 1.00 0.00 H new ATOM 0 HA ASP A 65 -2.764 16.739 19.646 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.226 19.053 20.397 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.942 18.454 21.881 1.00 0.00 H new ATOM 1009 N GLU A 66 -3.425 14.546 20.973 1.00 0.00 N ATOM 1010 CA GLU A 66 -3.323 13.379 21.843 1.00 0.00 C ATOM 1011 C GLU A 66 -1.926 13.277 22.445 1.00 0.00 C ATOM 1012 O GLU A 66 -1.711 12.548 23.414 1.00 0.00 O ATOM 1013 CB GLU A 66 -3.648 12.107 21.064 1.00 0.00 C ATOM 1014 CG GLU A 66 -3.720 10.924 22.030 1.00 0.00 C ATOM 1015 CD GLU A 66 -4.070 9.649 21.270 1.00 0.00 C ATOM 1016 OE1 GLU A 66 -4.364 9.751 20.092 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -4.032 8.592 21.877 1.00 0.00 O1- ATOM 0 H GLU A 66 -3.532 14.328 19.982 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.044 13.493 22.653 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.597 12.221 20.540 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.885 11.926 20.307 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -2.765 10.802 22.540 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -4.469 11.116 22.798 1.00 0.00 H new ATOM 1024 N ASP A 67 -0.974 13.987 21.848 1.00 0.00 N ATOM 1025 CA ASP A 67 0.404 13.942 22.323 1.00 0.00 C ATOM 1026 C ASP A 67 0.557 14.754 23.606 1.00 0.00 C ATOM 1027 O ASP A 67 1.568 14.646 24.300 1.00 0.00 O ATOM 1028 CB ASP A 67 1.334 14.517 21.253 1.00 0.00 C ATOM 1029 CG ASP A 67 0.705 14.355 19.874 1.00 0.00 C ATOM 1030 OD1 ASP A 67 -0.079 15.212 19.499 1.00 0.00 O ATOM 1031 OD2 ASP A 67 1.014 13.377 19.211 1.00 0.00 O1- ATOM 0 H ASP A 67 -1.129 14.594 21.043 1.00 0.00 H new ATOM 0 HA ASP A 67 0.666 12.904 22.527 1.00 0.00 H new ATOM 0 HB2 ASP A 67 1.524 15.571 21.453 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.297 14.008 21.285 1.00 0.00 H new ATOM 1036 N GLY A 68 -0.457 15.553 23.927 1.00 0.00 N ATOM 1037 CA GLY A 68 -0.421 16.362 25.142 1.00 0.00 C ATOM 1038 C GLY A 68 0.456 17.593 24.952 1.00 0.00 C ATOM 1039 O GLY A 68 0.653 18.376 25.881 1.00 0.00 O ATOM 0 H GLY A 68 -1.305 15.657 23.370 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.432 16.669 25.409 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.040 15.764 25.970 1.00 0.00 H new ATOM 1043 N SER A 69 0.984 17.757 23.744 1.00 0.00 N ATOM 1044 CA SER A 69 1.844 18.895 23.439 1.00 0.00 C ATOM 1045 C SER A 69 1.060 20.200 23.515 1.00 0.00 C ATOM 1046 O SER A 69 1.641 21.280 23.609 1.00 0.00 O ATOM 1047 CB SER A 69 2.447 18.735 22.043 1.00 0.00 C ATOM 1048 OG SER A 69 1.406 18.718 21.078 1.00 0.00 O ATOM 0 H SER A 69 0.833 17.119 22.963 1.00 0.00 H new ATOM 0 HA SER A 69 2.645 18.927 24.177 1.00 0.00 H new ATOM 0 HB2 SER A 69 3.136 19.554 21.836 1.00 0.00 H new ATOM 0 HB3 SER A 69 3.024 17.812 21.988 1.00 0.00 H new ATOM 0 HG SER A 69 0.564 18.464 21.510 1.00 0.00 H new ATOM 1054 N GLY A 70 -0.261 20.090 23.457 1.00 0.00 N ATOM 1055 CA GLY A 70 -1.116 21.269 23.512 1.00 0.00 C ATOM 1056 C GLY A 70 -1.077 22.016 22.185 1.00 0.00 C ATOM 1057 O GLY A 70 -1.520 23.160 22.089 1.00 0.00 O ATOM 0 H GLY A 70 -0.760 19.205 23.373 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.140 20.973 23.740 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.788 21.927 24.317 1.00 0.00 H new ATOM 1061 N THR A 71 -0.537 21.358 21.168 1.00 0.00 N ATOM 1062 CA THR A 71 -0.436 21.958 19.845 1.00 0.00 C ATOM 1063 C THR A 71 -0.772 20.940 18.762 1.00 0.00 C ATOM 1064 O THR A 71 -0.242 19.829 18.749 1.00 0.00 O ATOM 1065 CB THR A 71 0.982 22.494 19.631 1.00 0.00 C ATOM 1066 OG1 THR A 71 1.918 21.619 20.245 1.00 0.00 O ATOM 1067 CG2 THR A 71 1.100 23.892 20.237 1.00 0.00 C ATOM 0 H THR A 71 -0.163 20.411 21.233 1.00 0.00 H new ATOM 0 HA THR A 71 -1.151 22.778 19.780 1.00 0.00 H new ATOM 0 HB THR A 71 1.192 22.550 18.563 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.593 20.697 20.183 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.110 24.271 20.083 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.385 24.559 19.755 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.889 23.844 21.305 1.00 0.00 H new ATOM 1075 N VAL A 72 -1.646 21.339 17.846 1.00 0.00 N ATOM 1076 CA VAL A 72 -2.050 20.471 16.746 1.00 0.00 C ATOM 1077 C VAL A 72 -1.221 20.790 15.498 1.00 0.00 C ATOM 1078 O VAL A 72 -1.351 21.863 14.911 1.00 0.00 O ATOM 1079 CB VAL A 72 -3.556 20.642 16.451 1.00 0.00 C ATOM 1080 CG1 VAL A 72 -4.076 21.947 17.064 1.00 0.00 C ATOM 1081 CG2 VAL A 72 -3.788 20.677 14.937 1.00 0.00 C ATOM 0 H VAL A 72 -2.089 22.258 17.843 1.00 0.00 H new ATOM 0 HA VAL A 72 -1.872 19.434 17.031 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.091 19.799 16.889 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.139 22.053 16.847 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -3.926 21.927 18.143 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -3.533 22.791 16.638 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.852 20.798 14.735 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -3.239 21.513 14.504 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -3.438 19.745 14.494 1.00 0.00 H new ATOM 1091 N ASP A 73 -0.381 19.846 15.095 1.00 0.00 N ATOM 1092 CA ASP A 73 0.458 20.033 13.916 1.00 0.00 C ATOM 1093 C ASP A 73 -0.329 19.722 12.651 1.00 0.00 C ATOM 1094 O ASP A 73 -1.553 19.630 12.683 1.00 0.00 O ATOM 1095 CB ASP A 73 1.683 19.123 13.982 1.00 0.00 C ATOM 1096 CG ASP A 73 1.267 17.676 13.748 1.00 0.00 C ATOM 1097 OD1 ASP A 73 0.144 17.341 14.084 1.00 0.00 O ATOM 1098 OD2 ASP A 73 2.076 16.924 13.228 1.00 0.00 O1- ATOM 0 H ASP A 73 -0.262 18.948 15.563 1.00 0.00 H new ATOM 0 HA ASP A 73 0.783 21.073 13.894 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.413 19.427 13.232 1.00 0.00 H new ATOM 0 HB3 ASP A 73 2.166 19.219 14.954 1.00 0.00 H new ATOM 1103 N PHE A 74 0.376 19.568 11.538 1.00 0.00 N ATOM 1104 CA PHE A 74 -0.284 19.281 10.269 1.00 0.00 C ATOM 1105 C PHE A 74 -1.127 18.016 10.374 1.00 0.00 C ATOM 1106 O PHE A 74 -2.297 18.012 9.996 1.00 0.00 O ATOM 1107 CB PHE A 74 0.762 19.103 9.166 1.00 0.00 C ATOM 1108 CG PHE A 74 0.097 18.574 7.915 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -1.260 18.830 7.678 1.00 0.00 C ATOM 1110 CD2 PHE A 74 0.839 17.833 6.989 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -1.876 18.345 6.515 1.00 0.00 C ATOM 1112 CE2 PHE A 74 0.227 17.348 5.827 1.00 0.00 C ATOM 1113 CZ PHE A 74 -1.130 17.604 5.589 1.00 0.00 C ATOM 0 H PHE A 74 1.392 19.636 11.486 1.00 0.00 H new ATOM 0 HA PHE A 74 -0.936 20.120 10.025 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.249 20.055 8.956 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.539 18.414 9.496 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.833 19.402 8.393 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.885 17.635 7.171 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -2.922 18.542 6.334 1.00 0.00 H new ATOM 0 HE2 PHE A 74 0.801 16.776 5.113 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.601 17.230 4.692 1.00 0.00 H new ATOM 1123 N ASP A 75 -0.535 16.947 10.889 1.00 0.00 N ATOM 1124 CA ASP A 75 -1.262 15.692 11.028 1.00 0.00 C ATOM 1125 C ASP A 75 -2.419 15.842 12.016 1.00 0.00 C ATOM 1126 O ASP A 75 -3.530 15.378 11.757 1.00 0.00 O ATOM 1127 CB ASP A 75 -0.320 14.600 11.517 1.00 0.00 C ATOM 1128 CG ASP A 75 0.765 14.345 10.476 1.00 0.00 C ATOM 1129 OD1 ASP A 75 0.437 14.305 9.304 1.00 0.00 O ATOM 1130 OD2 ASP A 75 1.912 14.200 10.871 1.00 0.00 O1- ATOM 0 H ASP A 75 0.432 16.922 11.213 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.666 15.421 10.052 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.134 14.896 12.463 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.879 13.683 11.705 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.153 16.496 13.143 1.00 0.00 N ATOM 1136 CA GLU A 76 -3.181 16.699 14.159 1.00 0.00 C ATOM 1137 C GLU A 76 -4.295 17.588 13.620 1.00 0.00 C ATOM 1138 O GLU A 76 -5.482 17.331 13.841 1.00 0.00 O ATOM 1139 CB GLU A 76 -2.563 17.351 15.401 1.00 0.00 C ATOM 1140 CG GLU A 76 -1.646 16.347 16.101 1.00 0.00 C ATOM 1141 CD GLU A 76 -1.009 16.986 17.333 1.00 0.00 C ATOM 1142 OE1 GLU A 76 -1.729 17.623 18.084 1.00 0.00 O ATOM 1143 OE2 GLU A 76 0.188 16.825 17.508 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.242 16.892 13.375 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.601 15.729 14.426 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.998 18.238 15.116 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.349 17.678 16.082 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -2.216 15.465 16.393 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.870 16.012 15.414 1.00 0.00 H new ATOM 1150 N PHE A 77 -3.908 18.629 12.896 1.00 0.00 N ATOM 1151 CA PHE A 77 -4.885 19.542 12.327 1.00 0.00 C ATOM 1152 C PHE A 77 -5.695 18.830 11.247 1.00 0.00 C ATOM 1153 O PHE A 77 -6.909 19.015 11.138 1.00 0.00 O ATOM 1154 CB PHE A 77 -4.179 20.776 11.751 1.00 0.00 C ATOM 1155 CG PHE A 77 -4.422 20.862 10.264 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -5.599 21.439 9.783 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -3.478 20.358 9.372 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -5.831 21.510 8.409 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -3.709 20.431 7.996 1.00 0.00 C ATOM 1160 CZ PHE A 77 -4.883 21.007 7.517 1.00 0.00 C ATOM 0 H PHE A 77 -2.936 18.860 12.691 1.00 0.00 H new ATOM 0 HA PHE A 77 -5.567 19.871 13.111 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.547 21.678 12.241 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -3.109 20.719 11.950 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -6.330 21.831 10.475 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.568 19.911 9.744 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -6.743 21.953 8.036 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -2.977 20.041 7.304 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.060 21.065 6.453 1.00 0.00 H new ATOM 1170 N LEU A 78 -5.010 18.020 10.447 1.00 0.00 N ATOM 1171 CA LEU A 78 -5.668 17.283 9.378 1.00 0.00 C ATOM 1172 C LEU A 78 -6.762 16.402 9.972 1.00 0.00 C ATOM 1173 O LEU A 78 -7.858 16.286 9.418 1.00 0.00 O ATOM 1174 CB LEU A 78 -4.637 16.426 8.641 1.00 0.00 C ATOM 1175 CG LEU A 78 -5.036 16.294 7.174 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -6.503 15.948 7.078 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -4.830 17.619 6.457 1.00 0.00 C ATOM 0 H LEU A 78 -4.005 17.859 10.519 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.118 17.979 8.670 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.649 16.879 8.720 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.573 15.440 9.101 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.423 15.516 6.719 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.787 15.854 6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.688 15.004 7.590 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.094 16.736 7.545 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.117 17.515 5.411 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -5.444 18.387 6.928 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.780 17.906 6.518 1.00 0.00 H new ATOM 1189 N VAL A 79 -6.469 15.820 11.128 1.00 0.00 N ATOM 1190 CA VAL A 79 -7.442 14.994 11.822 1.00 0.00 C ATOM 1191 C VAL A 79 -8.660 15.827 12.189 1.00 0.00 C ATOM 1192 O VAL A 79 -9.793 15.364 12.094 1.00 0.00 O ATOM 1193 CB VAL A 79 -6.831 14.381 13.079 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -7.939 13.769 13.936 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -5.849 13.281 12.674 1.00 0.00 C ATOM 0 H VAL A 79 -5.569 15.905 11.601 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.746 14.185 11.158 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.312 15.153 13.647 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.504 13.331 14.834 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -8.651 14.545 14.219 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.453 12.995 13.367 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.409 12.839 13.568 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.377 12.511 12.111 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.060 13.707 12.054 1.00 0.00 H new ATOM 1205 N MET A 80 -8.424 17.059 12.616 1.00 0.00 N ATOM 1206 CA MET A 80 -9.520 17.935 13.008 1.00 0.00 C ATOM 1207 C MET A 80 -10.485 18.116 11.840 1.00 0.00 C ATOM 1208 O MET A 80 -11.702 18.121 12.026 1.00 0.00 O ATOM 1209 CB MET A 80 -8.972 19.301 13.414 1.00 0.00 C ATOM 1210 CG MET A 80 -8.013 19.134 14.595 1.00 0.00 C ATOM 1211 SD MET A 80 -7.494 20.759 15.207 1.00 0.00 S ATOM 1212 CE MET A 80 -7.154 21.524 13.605 1.00 0.00 C ATOM 0 H MET A 80 -7.495 17.472 12.700 1.00 0.00 H new ATOM 0 HA MET A 80 -10.045 17.484 13.850 1.00 0.00 H new ATOM 0 HB2 MET A 80 -8.454 19.762 12.573 1.00 0.00 H new ATOM 0 HB3 MET A 80 -9.791 19.967 13.687 1.00 0.00 H new ATOM 0 HG2 MET A 80 -8.500 18.574 15.393 1.00 0.00 H new ATOM 0 HG3 MET A 80 -7.141 18.557 14.287 1.00 0.00 H new ATOM 0 HE1 MET A 80 -6.243 22.119 13.672 1.00 0.00 H new ATOM 0 HE2 MET A 80 -7.025 20.747 12.851 1.00 0.00 H new ATOM 0 HE3 MET A 80 -7.988 22.167 13.325 1.00 0.00 H new ATOM 1222 N MET A 81 -9.934 18.249 10.633 1.00 0.00 N ATOM 1223 CA MET A 81 -10.766 18.410 9.447 1.00 0.00 C ATOM 1224 C MET A 81 -11.660 17.193 9.251 1.00 0.00 C ATOM 1225 O MET A 81 -12.851 17.320 8.975 1.00 0.00 O ATOM 1226 CB MET A 81 -9.882 18.589 8.214 1.00 0.00 C ATOM 1227 CG MET A 81 -9.221 19.959 8.243 1.00 0.00 C ATOM 1228 SD MET A 81 -10.492 21.244 8.138 1.00 0.00 S ATOM 1229 CE MET A 81 -9.395 22.668 8.336 1.00 0.00 C ATOM 0 H MET A 81 -8.930 18.248 10.455 1.00 0.00 H new ATOM 0 HA MET A 81 -11.392 19.292 9.583 1.00 0.00 H new ATOM 0 HB2 MET A 81 -9.121 17.809 8.186 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.480 18.484 7.309 1.00 0.00 H new ATOM 0 HG2 MET A 81 -8.644 20.077 9.160 1.00 0.00 H new ATOM 0 HG3 MET A 81 -8.522 20.055 7.412 1.00 0.00 H new ATOM 0 HE1 MET A 81 -9.963 23.587 8.195 1.00 0.00 H new ATOM 0 HE2 MET A 81 -8.963 22.658 9.337 1.00 0.00 H new ATOM 0 HE3 MET A 81 -8.597 22.618 7.596 1.00 0.00 H new ATOM 1239 N VAL A 82 -11.076 16.013 9.423 1.00 0.00 N ATOM 1240 CA VAL A 82 -11.830 14.772 9.277 1.00 0.00 C ATOM 1241 C VAL A 82 -12.704 14.537 10.499 1.00 0.00 C ATOM 1242 O VAL A 82 -13.772 13.936 10.400 1.00 0.00 O ATOM 1243 CB VAL A 82 -10.880 13.578 9.061 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -9.455 13.983 9.410 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -11.287 12.399 9.956 1.00 0.00 C ATOM 0 H VAL A 82 -10.092 15.888 9.661 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.471 14.863 8.400 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.940 13.278 8.015 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.788 13.135 9.256 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.145 14.810 8.771 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.410 14.294 10.454 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.606 11.564 9.791 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.241 12.703 11.002 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.304 12.091 9.712 1.00 0.00 H new ATOM 1616 N ILE A 148 -16.818 25.027 14.702 1.00 0.00 N ATOM 1617 CA ILE A 148 -16.053 25.784 13.712 1.00 0.00 C ATOM 1618 C ILE A 148 -16.320 25.254 12.310 1.00 0.00 C ATOM 1619 O ILE A 148 -15.580 24.411 11.802 1.00 0.00 O ATOM 1620 CB ILE A 148 -14.560 25.681 14.023 1.00 0.00 C ATOM 1621 CG1 ILE A 148 -13.780 26.604 13.083 1.00 0.00 C ATOM 1622 CG2 ILE A 148 -14.092 24.240 13.823 1.00 0.00 C ATOM 1623 CD1 ILE A 148 -12.343 26.744 13.587 1.00 0.00 C ATOM 0 HA ILE A 148 -16.364 26.828 13.757 1.00 0.00 H new ATOM 0 HB ILE A 148 -14.384 25.978 15.057 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -13.784 26.199 12.071 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -14.258 27.583 13.037 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -13.027 24.169 14.045 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -14.647 23.581 14.491 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -14.268 23.940 12.790 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -11.786 27.401 12.919 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -12.349 27.168 14.591 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -11.868 25.763 13.610 1.00 0.00 H new ATOM 1635 N SER A 149 -17.394 25.742 11.696 1.00 0.00 N ATOM 1636 CA SER A 149 -17.761 25.293 10.358 1.00 0.00 C ATOM 1637 C SER A 149 -16.508 25.047 9.532 1.00 0.00 C ATOM 1638 O SER A 149 -15.830 25.987 9.133 1.00 0.00 O ATOM 1639 CB SER A 149 -18.624 26.351 9.677 1.00 0.00 C ATOM 1640 OG SER A 149 -18.948 25.916 8.363 1.00 0.00 O ATOM 0 H SER A 149 -18.019 26.441 12.098 1.00 0.00 H new ATOM 0 HA SER A 149 -18.325 24.364 10.438 1.00 0.00 H new ATOM 0 HB2 SER A 149 -19.535 26.520 10.252 1.00 0.00 H new ATOM 0 HB3 SER A 149 -18.092 27.301 9.637 1.00 0.00 H new ATOM 0 HG SER A 149 -19.504 26.592 7.922 1.00 0.00 H new ATOM 1646 N ALA A 150 -16.209 23.776 9.281 1.00 0.00 N ATOM 1647 CA ALA A 150 -15.024 23.413 8.513 1.00 0.00 C ATOM 1648 C ALA A 150 -15.073 24.023 7.119 1.00 0.00 C ATOM 1649 O ALA A 150 -14.058 24.493 6.604 1.00 0.00 O ATOM 1650 CB ALA A 150 -14.918 21.891 8.403 1.00 0.00 C ATOM 0 H ALA A 150 -16.768 22.984 9.597 1.00 0.00 H new ATOM 0 HA ALA A 150 -14.149 23.803 9.033 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -14.030 21.629 7.828 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -14.845 21.458 9.401 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -15.803 21.500 7.902 1.00 0.00 H new ATOM 1656 N ASP A 151 -16.253 24.016 6.511 1.00 0.00 N ATOM 1657 CA ASP A 151 -16.411 24.573 5.174 1.00 0.00 C ATOM 1658 C ASP A 151 -15.929 26.020 5.133 1.00 0.00 C ATOM 1659 O ASP A 151 -14.882 26.332 4.564 1.00 0.00 O ATOM 1660 CB ASP A 151 -17.885 24.524 4.773 1.00 0.00 C ATOM 1661 CG ASP A 151 -18.391 23.085 4.822 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -17.732 22.227 4.254 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -19.424 22.859 5.428 1.00 0.00 O1- ATOM 0 H ASP A 151 -17.107 23.635 6.918 1.00 0.00 H new ATOM 0 HA ASP A 151 -15.814 23.982 4.479 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -18.474 25.149 5.445 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -18.011 24.929 3.769 1.00 0.00 H new ATOM 1668 N ALA A 152 -16.695 26.900 5.758 1.00 0.00 N ATOM 1669 CA ALA A 152 -16.341 28.309 5.800 1.00 0.00 C ATOM 1670 C ALA A 152 -15.017 28.512 6.528 1.00 0.00 C ATOM 1671 O ALA A 152 -14.246 29.412 6.196 1.00 0.00 O ATOM 1672 CB ALA A 152 -17.436 29.108 6.491 1.00 0.00 C ATOM 0 H ALA A 152 -17.562 26.665 6.241 1.00 0.00 H new ATOM 0 HA ALA A 152 -16.233 28.662 4.775 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -17.157 30.162 6.515 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -18.371 28.992 5.943 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -17.565 28.743 7.510 1.00 0.00 H new ATOM 1678 N MET A 153 -14.774 27.687 7.539 1.00 0.00 N ATOM 1679 CA MET A 153 -13.550 27.798 8.323 1.00 0.00 C ATOM 1680 C MET A 153 -12.335 27.834 7.409 1.00 0.00 C ATOM 1681 O MET A 153 -11.477 28.705 7.532 1.00 0.00 O ATOM 1682 CB MET A 153 -13.436 26.598 9.267 1.00 0.00 C ATOM 1683 CG MET A 153 -12.040 26.550 9.887 1.00 0.00 C ATOM 1684 SD MET A 153 -11.702 24.869 10.462 1.00 0.00 S ATOM 1685 CE MET A 153 -9.914 25.061 10.635 1.00 0.00 C ATOM 0 H MET A 153 -15.402 26.940 7.834 1.00 0.00 H new ATOM 0 HA MET A 153 -13.587 28.722 8.900 1.00 0.00 H new ATOM 0 HB2 MET A 153 -14.189 26.670 10.052 1.00 0.00 H new ATOM 0 HB3 MET A 153 -13.632 25.675 8.721 1.00 0.00 H new ATOM 0 HG2 MET A 153 -11.293 26.853 9.154 1.00 0.00 H new ATOM 0 HG3 MET A 153 -11.974 27.252 10.718 1.00 0.00 H new ATOM 0 HE1 MET A 153 -9.489 24.149 11.054 1.00 0.00 H new ATOM 0 HE2 MET A 153 -9.472 25.251 9.657 1.00 0.00 H new ATOM 0 HE3 MET A 153 -9.701 25.899 11.298 1.00 0.00 H new ATOM 1695 N MET A 154 -12.275 26.901 6.473 1.00 0.00 N ATOM 1696 CA MET A 154 -11.166 26.864 5.534 1.00 0.00 C ATOM 1697 C MET A 154 -11.261 28.029 4.559 1.00 0.00 C ATOM 1698 O MET A 154 -10.251 28.487 4.025 1.00 0.00 O ATOM 1699 CB MET A 154 -11.183 25.553 4.758 1.00 0.00 C ATOM 1700 CG MET A 154 -10.220 24.560 5.407 1.00 0.00 C ATOM 1701 SD MET A 154 -9.329 23.673 4.111 1.00 0.00 S ATOM 1702 CE MET A 154 -8.096 24.959 3.812 1.00 0.00 C ATOM 0 H MET A 154 -12.972 26.167 6.344 1.00 0.00 H new ATOM 0 HA MET A 154 -10.235 26.942 6.095 1.00 0.00 H new ATOM 0 HB2 MET A 154 -12.192 25.140 4.744 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.896 25.729 3.721 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.518 25.085 6.055 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.769 23.858 6.034 1.00 0.00 H new ATOM 0 HE1 MET A 154 -7.855 24.992 2.749 1.00 0.00 H new ATOM 0 HE2 MET A 154 -8.494 25.924 4.124 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.194 24.737 4.382 1.00 0.00 H new ATOM 1712 N GLN A 155 -12.484 28.493 4.311 1.00 0.00 N ATOM 1713 CA GLN A 155 -12.685 29.593 3.374 1.00 0.00 C ATOM 1714 C GLN A 155 -11.919 30.827 3.840 1.00 0.00 C ATOM 1715 O GLN A 155 -11.220 31.470 3.056 1.00 0.00 O ATOM 1716 CB GLN A 155 -14.173 29.938 3.288 1.00 0.00 C ATOM 1717 CG GLN A 155 -14.930 28.780 2.647 1.00 0.00 C ATOM 1718 CD GLN A 155 -16.408 29.125 2.507 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -16.821 30.239 2.826 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -17.236 28.225 2.050 1.00 0.00 N ATOM 0 H GLN A 155 -13.337 28.131 4.738 1.00 0.00 H new ATOM 0 HA GLN A 155 -12.320 29.285 2.394 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -14.569 30.137 4.284 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -14.313 30.846 2.702 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -14.507 28.559 1.667 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -14.815 27.882 3.254 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -16.891 27.302 1.786 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -18.228 28.445 1.957 1.00 0.00 H new ATOM 1729 N ALA A 156 -12.031 31.133 5.128 1.00 0.00 N ATOM 1730 CA ALA A 156 -11.325 32.276 5.697 1.00 0.00 C ATOM 1731 C ALA A 156 -9.847 31.946 5.880 1.00 0.00 C ATOM 1732 O ALA A 156 -8.989 32.827 5.822 1.00 0.00 O ATOM 1733 CB ALA A 156 -11.938 32.656 7.043 1.00 0.00 C ATOM 0 H ALA A 156 -12.600 30.610 5.794 1.00 0.00 H new ATOM 0 HA ALA A 156 -11.419 33.118 5.011 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -11.403 33.510 7.458 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -12.987 32.917 6.904 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -11.862 31.812 7.729 1.00 0.00 H new ATOM 1739 N LEU A 157 -9.560 30.671 6.101 1.00 0.00 N ATOM 1740 CA LEU A 157 -8.189 30.228 6.296 1.00 0.00 C ATOM 1741 C LEU A 157 -7.345 30.542 5.074 1.00 0.00 C ATOM 1742 O LEU A 157 -6.190 30.951 5.192 1.00 0.00 O ATOM 1743 CB LEU A 157 -8.154 28.723 6.566 1.00 0.00 C ATOM 1744 CG LEU A 157 -8.489 28.418 8.031 1.00 0.00 C ATOM 1745 CD1 LEU A 157 -7.196 28.094 8.761 1.00 0.00 C ATOM 1746 CD2 LEU A 157 -9.164 29.614 8.711 1.00 0.00 C ATOM 0 H LEU A 157 -10.257 29.928 6.149 1.00 0.00 H new ATOM 0 HA LEU A 157 -7.779 30.760 7.155 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -8.866 28.217 5.914 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -7.166 28.330 6.326 1.00 0.00 H new ATOM 0 HG LEU A 157 -9.180 27.576 8.065 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -7.414 27.874 9.806 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -6.724 27.227 8.298 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -6.521 28.948 8.703 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -9.388 29.364 9.748 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -8.495 30.474 8.681 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -10.089 29.855 8.188 1.00 0.00 H new ATOM 1758 N LEU A 158 -7.921 30.347 3.898 1.00 0.00 N ATOM 1759 CA LEU A 158 -7.198 30.608 2.667 1.00 0.00 C ATOM 1760 C LEU A 158 -7.332 32.081 2.285 1.00 0.00 C ATOM 1761 O LEU A 158 -6.665 32.556 1.366 1.00 0.00 O ATOM 1762 CB LEU A 158 -7.760 29.739 1.552 1.00 0.00 C ATOM 1763 CG LEU A 158 -7.744 28.278 1.991 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -8.347 27.405 0.890 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.308 27.833 2.258 1.00 0.00 C ATOM 0 H LEU A 158 -8.876 30.013 3.772 1.00 0.00 H new ATOM 0 HA LEU A 158 -6.144 30.373 2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -8.778 30.047 1.314 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.168 29.864 0.645 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.331 28.174 2.904 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -8.335 26.362 1.205 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -9.375 27.715 0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -7.762 27.515 -0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.303 26.789 2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -5.718 27.942 1.348 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -5.876 28.450 3.046 1.00 0.00 H new