USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 801 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 10 ASN : amide:sc= -2.12! C(o=-1.9!,f=-2.2!) USER MOD Set 1.2: A 92 THR OG1 : rot 125:sc= 0.25 USER MOD Set 2.1: A 62 GLN : amide:sc= -5.16! C(o=-5.5!,f=-14!) USER MOD Set 2.2: A 63 ASN : amide:sc= -0.363! C(o=-5.5!,f=-24!) USER MOD Single : A 5 GLN : amide:sc= -0.396 K(o=-0.4,f=-1.8!) USER MOD Single : A 11 THR OG1 : rot 142:sc= -8.05! USER MOD Single : A 14 HIS : no HD1:sc= -8.51! C(o=-8.5!,f=-8.6!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0232 USER MOD Single : A 43 TYR OH : rot -152:sc= -3.47! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -3.4! C(o=-3.4!,f=-10!) USER MOD Single : A 58 THR OG1 : rot -55:sc= 0.56 USER MOD Single : A 64 GLN : amide:sc= -7.4! C(o=-7.4!,f=-18!) USER MOD Single : A 72 LYS NZ :NH3+ -154:sc= -0.549 (180deg=-2.21!) USER MOD Single : A 74 CYS SG : rot -57:sc= 0.326 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N GLN A 5 3.576 30.859 -11.150 1.00 0.00 N ATOM 56 CA GLN A 5 2.102 30.638 -11.099 1.00 0.00 C ATOM 57 C GLN A 5 1.486 31.425 -9.939 1.00 0.00 C ATOM 58 O GLN A 5 2.146 31.743 -8.971 1.00 0.00 O ATOM 59 CB GLN A 5 1.935 29.134 -10.878 1.00 0.00 C ATOM 60 CG GLN A 5 0.526 28.715 -11.298 1.00 0.00 C ATOM 61 CD GLN A 5 0.599 27.913 -12.598 1.00 0.00 C ATOM 62 OE1 GLN A 5 1.579 27.243 -12.859 1.00 0.00 O ATOM 63 NE2 GLN A 5 -0.405 27.954 -13.430 1.00 0.00 N ATOM 0 HA GLN A 5 1.603 30.974 -12.008 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.678 28.585 -11.457 1.00 0.00 H new ATOM 0 HB3 GLN A 5 2.103 28.888 -9.829 1.00 0.00 H new ATOM 0 HG2 GLN A 5 0.064 28.115 -10.514 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -0.101 29.596 -11.436 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -1.227 28.517 -13.210 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -0.368 27.424 -14.300 1.00 0.00 H new ATOM 72 N VAL A 6 0.223 31.743 -10.031 1.00 0.00 N ATOM 73 CA VAL A 6 -0.432 32.513 -8.934 1.00 0.00 C ATOM 74 C VAL A 6 -1.544 31.682 -8.285 1.00 0.00 C ATOM 75 O VAL A 6 -1.602 30.478 -8.435 1.00 0.00 O ATOM 76 CB VAL A 6 -1.015 33.750 -9.616 1.00 0.00 C ATOM 77 CG1 VAL A 6 0.120 34.604 -10.183 1.00 0.00 C ATOM 78 CG2 VAL A 6 -1.939 33.315 -10.755 1.00 0.00 C ATOM 0 H VAL A 6 -0.383 31.504 -10.816 1.00 0.00 H new ATOM 0 HA VAL A 6 0.268 32.774 -8.140 1.00 0.00 H new ATOM 0 HB VAL A 6 -1.580 34.332 -8.888 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -0.296 35.486 -10.669 1.00 0.00 H new ATOM 0 HG12 VAL A 6 0.781 34.914 -9.374 1.00 0.00 H new ATOM 0 HG13 VAL A 6 0.685 34.021 -10.911 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -2.356 34.196 -11.242 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -1.372 32.733 -11.481 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -2.749 32.705 -10.354 1.00 0.00 H new ATOM 88 N VAL A 7 -2.425 32.318 -7.561 1.00 0.00 N ATOM 89 CA VAL A 7 -3.530 31.567 -6.898 1.00 0.00 C ATOM 90 C VAL A 7 -4.729 31.436 -7.840 1.00 0.00 C ATOM 91 O VAL A 7 -5.664 32.209 -7.784 1.00 0.00 O ATOM 92 CB VAL A 7 -3.896 32.399 -5.670 1.00 0.00 C ATOM 93 CG1 VAL A 7 -5.012 31.698 -4.893 1.00 0.00 C ATOM 94 CG2 VAL A 7 -2.665 32.548 -4.773 1.00 0.00 C ATOM 0 H VAL A 7 -2.427 33.325 -7.400 1.00 0.00 H new ATOM 0 HA VAL A 7 -3.233 30.554 -6.628 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.238 33.384 -5.986 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.273 32.291 -4.017 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -5.888 31.590 -5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.671 30.713 -4.575 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -2.924 33.141 -3.896 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -2.324 31.562 -4.457 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -1.870 33.047 -5.327 1.00 0.00 H new ATOM 104 N LEU A 8 -4.709 30.455 -8.699 1.00 0.00 N ATOM 105 CA LEU A 8 -5.847 30.260 -9.642 1.00 0.00 C ATOM 106 C LEU A 8 -7.174 30.345 -8.885 1.00 0.00 C ATOM 107 O LEU A 8 -7.211 30.198 -7.679 1.00 0.00 O ATOM 108 CB LEU A 8 -5.635 28.853 -10.214 1.00 0.00 C ATOM 109 CG LEU A 8 -4.790 28.902 -11.502 1.00 0.00 C ATOM 110 CD1 LEU A 8 -3.905 30.154 -11.532 1.00 0.00 C ATOM 111 CD2 LEU A 8 -3.894 27.663 -11.560 1.00 0.00 C ATOM 0 H LEU A 8 -3.952 29.778 -8.789 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.883 31.018 -10.424 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.139 28.226 -9.473 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.600 28.393 -10.425 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.465 28.930 -12.357 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.319 30.164 -12.451 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.533 31.044 -11.492 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.233 30.145 -10.674 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.293 27.691 -12.469 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.237 27.648 -10.691 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.513 26.766 -11.562 1.00 0.00 H new ATOM 123 N PRO A 9 -8.225 30.586 -9.621 1.00 0.00 N ATOM 124 CA PRO A 9 -9.572 30.697 -9.009 1.00 0.00 C ATOM 125 C PRO A 9 -10.069 29.321 -8.560 1.00 0.00 C ATOM 126 O PRO A 9 -10.544 29.151 -7.455 1.00 0.00 O ATOM 127 CB PRO A 9 -10.434 31.249 -10.140 1.00 0.00 C ATOM 128 CG PRO A 9 -9.731 30.843 -11.396 1.00 0.00 C ATOM 129 CD PRO A 9 -8.260 30.773 -11.075 1.00 0.00 C ATOM 0 HA PRO A 9 -9.591 31.329 -8.121 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -11.443 30.840 -10.103 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -10.527 32.333 -10.072 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -10.095 29.878 -11.747 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -9.918 31.563 -12.193 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -7.776 29.947 -11.596 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -7.742 31.685 -11.373 1.00 0.00 H new ATOM 137 N ASN A 10 -9.965 28.336 -9.410 1.00 0.00 N ATOM 138 CA ASN A 10 -10.432 26.972 -9.033 1.00 0.00 C ATOM 139 C ASN A 10 -9.832 25.928 -9.981 1.00 0.00 C ATOM 140 O ASN A 10 -10.438 24.916 -10.270 1.00 0.00 O ATOM 141 CB ASN A 10 -11.953 27.021 -9.178 1.00 0.00 C ATOM 142 CG ASN A 10 -12.577 27.506 -7.868 1.00 0.00 C ATOM 143 OD1 ASN A 10 -13.279 28.498 -7.847 1.00 0.00 O ATOM 144 ND2 ASN A 10 -12.350 26.844 -6.766 1.00 0.00 N ATOM 0 H ASN A 10 -9.577 28.417 -10.350 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.129 26.694 -8.024 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -12.230 27.689 -9.994 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -12.336 26.033 -9.431 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -12.762 27.159 -5.888 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -11.761 26.011 -6.783 1.00 0.00 H new ATOM 151 N THR A 11 -8.645 26.170 -10.467 1.00 0.00 N ATOM 152 CA THR A 11 -8.000 25.196 -11.397 1.00 0.00 C ATOM 153 C THR A 11 -6.902 24.418 -10.668 1.00 0.00 C ATOM 154 O THR A 11 -6.484 24.788 -9.587 1.00 0.00 O ATOM 155 CB THR A 11 -7.385 26.053 -12.504 1.00 0.00 C ATOM 156 OG1 THR A 11 -6.203 26.666 -12.016 1.00 0.00 O ATOM 157 CG2 THR A 11 -8.378 27.133 -12.938 1.00 0.00 C ATOM 0 H THR A 11 -8.092 27.002 -10.260 1.00 0.00 H new ATOM 0 HA THR A 11 -8.711 24.467 -11.785 1.00 0.00 H new ATOM 0 HB THR A 11 -7.147 25.422 -13.361 1.00 0.00 H new ATOM 0 HG1 THR A 11 -5.526 26.682 -12.725 1.00 0.00 H new ATOM 0 HG21 THR A 11 -7.934 27.740 -13.727 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.288 26.662 -13.311 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.621 27.767 -12.086 1.00 0.00 H new ATOM 165 N ALA A 12 -6.420 23.350 -11.247 1.00 0.00 N ATOM 166 CA ALA A 12 -5.345 22.576 -10.567 1.00 0.00 C ATOM 167 C ALA A 12 -4.366 22.006 -11.593 1.00 0.00 C ATOM 168 O ALA A 12 -4.675 21.876 -12.759 1.00 0.00 O ATOM 169 CB ALA A 12 -6.065 21.447 -9.829 1.00 0.00 C ATOM 0 H ALA A 12 -6.721 22.985 -12.151 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.763 23.199 -9.887 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.335 20.832 -9.303 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.767 21.871 -9.111 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.608 20.831 -10.546 1.00 0.00 H new ATOM 175 N LEU A 13 -3.188 21.658 -11.168 1.00 0.00 N ATOM 176 CA LEU A 13 -2.202 21.087 -12.127 1.00 0.00 C ATOM 177 C LEU A 13 -1.563 19.833 -11.523 1.00 0.00 C ATOM 178 O LEU A 13 -1.455 19.698 -10.321 1.00 0.00 O ATOM 179 CB LEU A 13 -1.187 22.221 -12.387 1.00 0.00 C ATOM 180 CG LEU A 13 0.089 22.059 -11.549 1.00 0.00 C ATOM 181 CD1 LEU A 13 1.243 22.783 -12.247 1.00 0.00 C ATOM 182 CD2 LEU A 13 -0.129 22.675 -10.167 1.00 0.00 C ATOM 0 H LEU A 13 -2.864 21.742 -10.205 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.648 20.764 -13.068 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.925 22.237 -13.445 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.650 23.181 -12.159 1.00 0.00 H new ATOM 0 HG LEU A 13 0.326 21.000 -11.443 1.00 0.00 H new ATOM 0 HD11 LEU A 13 2.153 22.672 -11.657 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.398 22.352 -13.236 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.002 23.841 -12.346 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.776 22.561 -9.571 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.362 23.734 -10.274 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.957 22.170 -9.670 1.00 0.00 H new ATOM 194 N HIS A 14 -1.154 18.911 -12.348 1.00 0.00 N ATOM 195 CA HIS A 14 -0.539 17.660 -11.819 1.00 0.00 C ATOM 196 C HIS A 14 0.988 17.777 -11.800 1.00 0.00 C ATOM 197 O HIS A 14 1.610 18.095 -12.795 1.00 0.00 O ATOM 198 CB HIS A 14 -0.990 16.565 -12.786 1.00 0.00 C ATOM 199 CG HIS A 14 -2.493 16.481 -12.777 1.00 0.00 C ATOM 200 ND1 HIS A 14 -3.288 17.412 -13.427 1.00 0.00 N ATOM 201 CD2 HIS A 14 -3.359 15.584 -12.201 1.00 0.00 C ATOM 202 CE1 HIS A 14 -4.571 17.058 -13.229 1.00 0.00 C ATOM 203 NE2 HIS A 14 -4.671 15.950 -12.487 1.00 0.00 N ATOM 0 H HIS A 14 -1.218 18.968 -13.364 1.00 0.00 H new ATOM 0 HA HIS A 14 -0.844 17.450 -10.794 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -0.633 16.783 -13.792 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -0.559 15.607 -12.495 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.066 14.725 -11.615 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -5.417 17.602 -13.622 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -5.525 15.475 -12.194 1.00 0.00 H new ATOM 211 N LEU A 15 1.592 17.517 -10.671 1.00 0.00 N ATOM 212 CA LEU A 15 3.079 17.608 -10.573 1.00 0.00 C ATOM 213 C LEU A 15 3.678 16.227 -10.322 1.00 0.00 C ATOM 214 O LEU A 15 3.059 15.373 -9.718 1.00 0.00 O ATOM 215 CB LEU A 15 3.359 18.494 -9.355 1.00 0.00 C ATOM 216 CG LEU A 15 2.669 19.848 -9.506 1.00 0.00 C ATOM 217 CD1 LEU A 15 2.859 20.375 -10.928 1.00 0.00 C ATOM 218 CD2 LEU A 15 1.179 19.694 -9.211 1.00 0.00 C ATOM 0 H LEU A 15 1.118 17.245 -9.810 1.00 0.00 H new ATOM 0 HA LEU A 15 3.511 18.006 -11.491 1.00 0.00 H new ATOM 0 HB2 LEU A 15 3.007 17.999 -8.450 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.434 18.638 -9.242 1.00 0.00 H new ATOM 0 HG LEU A 15 3.109 20.556 -8.803 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.364 21.341 -11.027 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.923 20.490 -11.134 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.426 19.671 -11.638 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.685 20.660 -9.318 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.741 18.983 -9.911 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.046 19.330 -8.192 1.00 0.00 H new ATOM 230 N LYS A 16 4.891 16.009 -10.745 1.00 0.00 N ATOM 231 CA LYS A 16 5.532 14.694 -10.485 1.00 0.00 C ATOM 232 C LYS A 16 6.614 14.878 -9.424 1.00 0.00 C ATOM 233 O LYS A 16 7.585 15.578 -9.632 1.00 0.00 O ATOM 234 CB LYS A 16 6.148 14.261 -11.815 1.00 0.00 C ATOM 235 CG LYS A 16 5.791 12.797 -12.087 1.00 0.00 C ATOM 236 CD LYS A 16 6.916 12.133 -12.885 1.00 0.00 C ATOM 237 CE LYS A 16 6.975 12.738 -14.289 1.00 0.00 C ATOM 238 NZ LYS A 16 8.415 12.689 -14.667 1.00 0.00 N ATOM 0 H LYS A 16 5.463 16.681 -11.257 1.00 0.00 H new ATOM 0 HA LYS A 16 4.827 13.946 -10.122 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.779 14.893 -12.623 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.231 14.383 -11.784 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.638 12.269 -11.146 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.854 12.738 -12.641 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.869 12.275 -12.376 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.746 11.058 -12.948 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.363 12.170 -14.990 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.600 13.761 -14.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 8.538 13.087 -15.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.972 13.243 -13.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.742 11.702 -14.660 1.00 0.00 H new ATOM 252 N ALA A 17 6.454 14.268 -8.287 1.00 0.00 N ATOM 253 CA ALA A 17 7.473 14.423 -7.220 1.00 0.00 C ATOM 254 C ALA A 17 8.677 13.531 -7.516 1.00 0.00 C ATOM 255 O ALA A 17 8.601 12.316 -7.465 1.00 0.00 O ATOM 256 CB ALA A 17 6.773 13.999 -5.929 1.00 0.00 C ATOM 0 H ALA A 17 5.662 13.670 -8.051 1.00 0.00 H new ATOM 0 HA ALA A 17 7.850 15.443 -7.148 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.467 14.087 -5.093 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.911 14.642 -5.754 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.442 12.964 -6.018 1.00 0.00 H new ATOM 262 N LEU A 18 9.784 14.138 -7.834 1.00 0.00 N ATOM 263 CA LEU A 18 11.014 13.364 -8.146 1.00 0.00 C ATOM 264 C LEU A 18 11.921 13.304 -6.914 1.00 0.00 C ATOM 265 O LEU A 18 12.625 14.246 -6.602 1.00 0.00 O ATOM 266 CB LEU A 18 11.681 14.160 -9.267 1.00 0.00 C ATOM 267 CG LEU A 18 10.781 14.154 -10.502 1.00 0.00 C ATOM 268 CD1 LEU A 18 11.513 14.812 -11.672 1.00 0.00 C ATOM 269 CD2 LEU A 18 10.430 12.710 -10.867 1.00 0.00 C ATOM 0 H LEU A 18 9.890 15.151 -7.892 1.00 0.00 H new ATOM 0 HA LEU A 18 10.807 12.334 -8.435 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.863 15.184 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 18 12.651 13.725 -9.509 1.00 0.00 H new ATOM 0 HG LEU A 18 9.867 14.709 -10.289 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.870 14.807 -12.552 1.00 0.00 H new ATOM 0 HD12 LEU A 18 11.764 15.840 -11.412 1.00 0.00 H new ATOM 0 HD13 LEU A 18 12.427 14.258 -11.887 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.788 12.703 -11.748 1.00 0.00 H new ATOM 0 HD22 LEU A 18 11.344 12.156 -11.080 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.907 12.241 -10.033 1.00 0.00 H new ATOM 281 N LEU A 19 11.908 12.206 -6.208 1.00 0.00 N ATOM 282 CA LEU A 19 12.764 12.084 -4.994 1.00 0.00 C ATOM 283 C LEU A 19 12.974 10.610 -4.644 1.00 0.00 C ATOM 284 O LEU A 19 12.043 9.828 -4.632 1.00 0.00 O ATOM 285 CB LEU A 19 11.975 12.787 -3.887 1.00 0.00 C ATOM 286 CG LEU A 19 12.942 13.378 -2.860 1.00 0.00 C ATOM 287 CD1 LEU A 19 13.777 12.256 -2.236 1.00 0.00 C ATOM 288 CD2 LEU A 19 13.871 14.377 -3.553 1.00 0.00 C ATOM 0 H LEU A 19 11.340 11.386 -6.421 1.00 0.00 H new ATOM 0 HA LEU A 19 13.752 12.522 -5.137 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.356 13.576 -4.314 1.00 0.00 H new ATOM 0 HB3 LEU A 19 11.302 12.080 -3.402 1.00 0.00 H new ATOM 0 HG LEU A 19 12.376 13.886 -2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.466 12.679 -1.504 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.117 11.542 -1.743 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.344 11.747 -3.016 1.00 0.00 H new ATOM 0 HD21 LEU A 19 14.561 14.799 -2.823 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.436 13.867 -4.334 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.279 15.177 -3.997 1.00 0.00 H new ATOM 300 N ASP A 20 14.184 10.219 -4.356 1.00 0.00 N ATOM 301 CA ASP A 20 14.437 8.792 -4.004 1.00 0.00 C ATOM 302 C ASP A 20 13.952 8.518 -2.578 1.00 0.00 C ATOM 303 O ASP A 20 14.607 8.860 -1.614 1.00 0.00 O ATOM 304 CB ASP A 20 15.953 8.617 -4.101 1.00 0.00 C ATOM 305 CG ASP A 20 16.333 8.250 -5.536 1.00 0.00 C ATOM 306 OD1 ASP A 20 15.557 7.561 -6.177 1.00 0.00 O ATOM 307 OD2 ASP A 20 17.395 8.666 -5.971 1.00 0.00 O ATOM 0 H ASP A 20 15.006 10.822 -4.349 1.00 0.00 H new ATOM 0 HA ASP A 20 13.911 8.101 -4.662 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.456 9.538 -3.804 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.284 7.838 -3.415 1.00 0.00 H new ATOM 312 N PHE A 21 12.808 7.908 -2.439 1.00 0.00 N ATOM 313 CA PHE A 21 12.278 7.619 -1.076 1.00 0.00 C ATOM 314 C PHE A 21 11.960 6.128 -0.931 1.00 0.00 C ATOM 315 O PHE A 21 10.822 5.711 -1.043 1.00 0.00 O ATOM 316 CB PHE A 21 11.001 8.454 -0.967 1.00 0.00 C ATOM 317 CG PHE A 21 10.960 9.151 0.372 1.00 0.00 C ATOM 318 CD1 PHE A 21 11.881 10.164 0.665 1.00 0.00 C ATOM 319 CD2 PHE A 21 9.996 8.787 1.320 1.00 0.00 C ATOM 320 CE1 PHE A 21 11.838 10.812 1.905 1.00 0.00 C ATOM 321 CE2 PHE A 21 9.954 9.435 2.561 1.00 0.00 C ATOM 322 CZ PHE A 21 10.874 10.448 2.853 1.00 0.00 C ATOM 0 H PHE A 21 12.217 7.597 -3.210 1.00 0.00 H new ATOM 0 HA PHE A 21 12.996 7.864 -0.293 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.966 9.189 -1.771 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.126 7.814 -1.081 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.625 10.445 -0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 21 9.285 8.006 1.094 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.549 11.593 2.131 1.00 0.00 H new ATOM 0 HE2 PHE A 21 9.211 9.153 3.293 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.841 10.949 3.809 1.00 0.00 H new ATOM 434 N VAL A 29 8.811 4.880 -2.962 1.00 0.00 N ATOM 435 CA VAL A 29 8.833 5.841 -4.107 1.00 0.00 C ATOM 436 C VAL A 29 10.279 6.040 -4.583 1.00 0.00 C ATOM 437 O VAL A 29 11.198 6.121 -3.792 1.00 0.00 O ATOM 438 CB VAL A 29 8.204 7.167 -3.592 1.00 0.00 C ATOM 439 CG1 VAL A 29 7.472 6.944 -2.262 1.00 0.00 C ATOM 440 CG2 VAL A 29 9.277 8.245 -3.390 1.00 0.00 C ATOM 0 HA VAL A 29 8.265 5.473 -4.962 1.00 0.00 H new ATOM 0 HB VAL A 29 7.494 7.502 -4.348 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.041 7.885 -1.922 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.678 6.211 -2.402 1.00 0.00 H new ATOM 0 HG13 VAL A 29 8.177 6.577 -1.516 1.00 0.00 H new ATOM 0 HG21 VAL A 29 8.809 9.161 -3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.007 7.899 -2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 29 9.778 8.442 -4.338 1.00 0.00 H new ATOM 450 N VAL A 30 10.486 6.117 -5.868 1.00 0.00 N ATOM 451 CA VAL A 30 11.869 6.311 -6.387 1.00 0.00 C ATOM 452 C VAL A 30 11.857 7.276 -7.573 1.00 0.00 C ATOM 453 O VAL A 30 11.841 6.871 -8.717 1.00 0.00 O ATOM 454 CB VAL A 30 12.322 4.922 -6.825 1.00 0.00 C ATOM 455 CG1 VAL A 30 12.387 4.009 -5.602 1.00 0.00 C ATOM 456 CG2 VAL A 30 11.322 4.352 -7.833 1.00 0.00 C ATOM 0 H VAL A 30 9.759 6.054 -6.580 1.00 0.00 H new ATOM 0 HA VAL A 30 12.537 6.739 -5.640 1.00 0.00 H new ATOM 0 HB VAL A 30 13.306 4.987 -7.290 1.00 0.00 H new ATOM 0 HG11 VAL A 30 12.710 3.014 -5.908 1.00 0.00 H new ATOM 0 HG12 VAL A 30 13.097 4.416 -4.882 1.00 0.00 H new ATOM 0 HG13 VAL A 30 11.400 3.945 -5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.646 3.359 -8.146 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.338 4.283 -7.370 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.269 5.007 -8.703 1.00 0.00 H new ATOM 466 N ALA A 31 11.869 8.550 -7.302 1.00 0.00 N ATOM 467 CA ALA A 31 11.860 9.549 -8.408 1.00 0.00 C ATOM 468 C ALA A 31 10.786 9.198 -9.441 1.00 0.00 C ATOM 469 O ALA A 31 11.088 8.786 -10.543 1.00 0.00 O ATOM 470 CB ALA A 31 13.251 9.460 -9.034 1.00 0.00 C ATOM 0 H ALA A 31 11.885 8.944 -6.361 1.00 0.00 H new ATOM 0 HA ALA A 31 11.635 10.553 -8.049 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.324 10.168 -9.859 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.004 9.699 -8.283 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.418 8.449 -9.407 1.00 0.00 H new ATOM 476 N GLY A 32 9.534 9.358 -9.101 1.00 0.00 N ATOM 477 CA GLY A 32 8.462 9.031 -10.085 1.00 0.00 C ATOM 478 C GLY A 32 7.074 9.183 -9.452 1.00 0.00 C ATOM 479 O GLY A 32 6.132 8.532 -9.860 1.00 0.00 O ATOM 0 H GLY A 32 9.210 9.697 -8.195 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.545 9.688 -10.951 1.00 0.00 H new ATOM 0 HA3 GLY A 32 8.592 8.010 -10.445 1.00 0.00 H new ATOM 483 N ASP A 33 6.921 10.036 -8.472 1.00 0.00 N ATOM 484 CA ASP A 33 5.570 10.203 -7.857 1.00 0.00 C ATOM 485 C ASP A 33 4.831 11.367 -8.524 1.00 0.00 C ATOM 486 O ASP A 33 5.439 12.251 -9.087 1.00 0.00 O ATOM 487 CB ASP A 33 5.832 10.504 -6.380 1.00 0.00 C ATOM 488 CG ASP A 33 6.179 9.205 -5.651 1.00 0.00 C ATOM 489 OD1 ASP A 33 6.865 8.384 -6.238 1.00 0.00 O ATOM 490 OD2 ASP A 33 5.753 9.051 -4.518 1.00 0.00 O ATOM 0 H ASP A 33 7.661 10.616 -8.076 1.00 0.00 H new ATOM 0 HA ASP A 33 4.948 9.317 -7.981 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.650 11.218 -6.282 1.00 0.00 H new ATOM 0 HB3 ASP A 33 4.952 10.963 -5.929 1.00 0.00 H new ATOM 495 N GLU A 34 3.527 11.376 -8.471 1.00 0.00 N ATOM 496 CA GLU A 34 2.762 12.488 -9.108 1.00 0.00 C ATOM 497 C GLU A 34 1.465 12.757 -8.339 1.00 0.00 C ATOM 498 O GLU A 34 0.844 11.855 -7.814 1.00 0.00 O ATOM 499 CB GLU A 34 2.457 12.002 -10.526 1.00 0.00 C ATOM 500 CG GLU A 34 2.300 13.208 -11.454 1.00 0.00 C ATOM 501 CD GLU A 34 2.075 12.726 -12.889 1.00 0.00 C ATOM 502 OE1 GLU A 34 2.960 12.071 -13.417 1.00 0.00 O ATOM 503 OE2 GLU A 34 1.025 13.019 -13.435 1.00 0.00 O ATOM 0 H GLU A 34 2.958 10.663 -8.015 1.00 0.00 H new ATOM 0 HA GLU A 34 3.324 13.422 -9.110 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.261 11.357 -10.882 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.545 11.405 -10.529 1.00 0.00 H new ATOM 0 HG2 GLU A 34 1.460 13.822 -11.130 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.190 13.835 -11.406 1.00 0.00 H new ATOM 510 N TRP A 35 1.052 13.995 -8.270 1.00 0.00 N ATOM 511 CA TRP A 35 -0.204 14.327 -7.535 1.00 0.00 C ATOM 512 C TRP A 35 -0.878 15.556 -8.158 1.00 0.00 C ATOM 513 O TRP A 35 -0.287 16.263 -8.950 1.00 0.00 O ATOM 514 CB TRP A 35 0.242 14.620 -6.097 1.00 0.00 C ATOM 515 CG TRP A 35 0.846 15.986 -6.014 1.00 0.00 C ATOM 516 CD1 TRP A 35 0.177 17.108 -5.667 1.00 0.00 C ATOM 517 CD2 TRP A 35 2.222 16.391 -6.267 1.00 0.00 C ATOM 518 NE1 TRP A 35 1.052 18.179 -5.695 1.00 0.00 N ATOM 519 CE2 TRP A 35 2.326 17.788 -6.059 1.00 0.00 C ATOM 520 CE3 TRP A 35 3.376 15.692 -6.655 1.00 0.00 C ATOM 521 CZ2 TRP A 35 3.534 18.464 -6.230 1.00 0.00 C ATOM 522 CZ3 TRP A 35 4.592 16.369 -6.827 1.00 0.00 C ATOM 523 CH2 TRP A 35 4.672 17.751 -6.615 1.00 0.00 C ATOM 0 H TRP A 35 1.531 14.791 -8.691 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.933 13.517 -7.576 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -0.611 14.550 -5.422 1.00 0.00 H new ATOM 0 HB3 TRP A 35 0.967 13.873 -5.774 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -0.871 17.160 -5.410 1.00 0.00 H new ATOM 0 HE1 TRP A 35 0.789 19.139 -5.474 1.00 0.00 H new ATOM 0 HE3 TRP A 35 3.327 14.626 -6.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 3.589 19.530 -6.066 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.473 15.821 -7.125 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.612 18.265 -6.749 1.00 0.00 H new ATOM 534 N LEU A 36 -2.108 15.818 -7.804 1.00 0.00 N ATOM 535 CA LEU A 36 -2.811 17.004 -8.376 1.00 0.00 C ATOM 536 C LEU A 36 -2.707 18.190 -7.410 1.00 0.00 C ATOM 537 O LEU A 36 -2.596 18.016 -6.213 1.00 0.00 O ATOM 538 CB LEU A 36 -4.266 16.567 -8.532 1.00 0.00 C ATOM 539 CG LEU A 36 -5.103 17.750 -9.019 1.00 0.00 C ATOM 540 CD1 LEU A 36 -4.539 18.263 -10.346 1.00 0.00 C ATOM 541 CD2 LEU A 36 -6.552 17.301 -9.221 1.00 0.00 C ATOM 0 H LEU A 36 -2.655 15.264 -7.145 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.380 17.324 -9.325 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.335 15.742 -9.241 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.652 16.202 -7.580 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.069 18.548 -8.277 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.136 19.106 -10.693 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.507 18.583 -10.203 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.572 17.465 -11.088 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.149 18.144 -9.568 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.586 16.503 -9.963 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.955 16.936 -8.276 1.00 0.00 H new ATOM 553 N PHE A 37 -2.738 19.393 -7.915 1.00 0.00 N ATOM 554 CA PHE A 37 -2.634 20.580 -7.016 1.00 0.00 C ATOM 555 C PHE A 37 -3.740 21.589 -7.331 1.00 0.00 C ATOM 556 O PHE A 37 -3.786 22.155 -8.404 1.00 0.00 O ATOM 557 CB PHE A 37 -1.260 21.181 -7.317 1.00 0.00 C ATOM 558 CG PHE A 37 -0.861 22.155 -6.227 1.00 0.00 C ATOM 559 CD1 PHE A 37 -1.779 22.528 -5.237 1.00 0.00 C ATOM 560 CD2 PHE A 37 0.435 22.689 -6.214 1.00 0.00 C ATOM 561 CE1 PHE A 37 -1.401 23.430 -4.235 1.00 0.00 C ATOM 562 CE2 PHE A 37 0.812 23.591 -5.212 1.00 0.00 C ATOM 563 CZ PHE A 37 -0.107 23.961 -4.223 1.00 0.00 C ATOM 0 H PHE A 37 -2.831 19.606 -8.908 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.744 20.311 -5.965 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.517 20.387 -7.394 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.282 21.691 -8.280 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.779 22.120 -5.247 1.00 0.00 H new ATOM 0 HD2 PHE A 37 1.143 22.404 -6.978 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.109 23.716 -3.471 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.811 24.001 -5.202 1.00 0.00 H new ATOM 0 HZ PHE A 37 0.183 24.657 -3.450 1.00 0.00 H new ATOM 573 N GLU A 38 -4.627 21.815 -6.402 1.00 0.00 N ATOM 574 CA GLU A 38 -5.735 22.786 -6.637 1.00 0.00 C ATOM 575 C GLU A 38 -5.380 24.153 -6.042 1.00 0.00 C ATOM 576 O GLU A 38 -5.144 24.278 -4.856 1.00 0.00 O ATOM 577 CB GLU A 38 -6.939 22.186 -5.909 1.00 0.00 C ATOM 578 CG GLU A 38 -8.219 22.889 -6.362 1.00 0.00 C ATOM 579 CD GLU A 38 -8.802 23.692 -5.196 1.00 0.00 C ATOM 580 OE1 GLU A 38 -8.766 23.194 -4.083 1.00 0.00 O ATOM 581 OE2 GLU A 38 -9.272 24.792 -5.437 1.00 0.00 O ATOM 0 H GLU A 38 -4.633 21.367 -5.486 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.929 22.943 -7.698 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.006 21.118 -6.117 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.815 22.294 -4.831 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.005 23.550 -7.202 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.945 22.155 -6.711 1.00 0.00 H new ATOM 588 N GLY A 39 -5.345 25.181 -6.848 1.00 0.00 N ATOM 589 CA GLY A 39 -5.011 26.532 -6.308 1.00 0.00 C ATOM 590 C GLY A 39 -3.518 26.604 -5.970 1.00 0.00 C ATOM 591 O GLY A 39 -3.146 27.062 -4.908 1.00 0.00 O ATOM 0 H GLY A 39 -5.532 25.145 -7.850 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.264 27.299 -7.040 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.605 26.734 -5.417 1.00 0.00 H new ATOM 595 N PRO A 40 -2.711 26.137 -6.884 1.00 0.00 N ATOM 596 CA PRO A 40 -1.237 26.140 -6.678 1.00 0.00 C ATOM 597 C PRO A 40 -0.704 27.574 -6.633 1.00 0.00 C ATOM 598 O PRO A 40 0.106 27.965 -7.453 1.00 0.00 O ATOM 599 CB PRO A 40 -0.707 25.384 -7.895 1.00 0.00 C ATOM 600 CG PRO A 40 -1.770 25.545 -8.932 1.00 0.00 C ATOM 601 CD PRO A 40 -3.080 25.584 -8.192 1.00 0.00 C ATOM 0 HA PRO A 40 -0.930 25.683 -5.737 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.243 25.796 -8.234 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.534 24.333 -7.664 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -1.619 26.460 -9.504 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.749 24.718 -9.642 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -3.812 26.211 -8.702 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.520 24.591 -8.100 1.00 0.00 H new ATOM 609 N GLY A 41 -1.166 28.344 -5.671 1.00 0.00 N ATOM 610 CA GLY A 41 -0.733 29.772 -5.512 1.00 0.00 C ATOM 611 C GLY A 41 0.577 30.045 -6.249 1.00 0.00 C ATOM 612 O GLY A 41 0.584 30.382 -7.416 1.00 0.00 O ATOM 0 H GLY A 41 -1.842 28.033 -4.973 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.511 30.434 -5.893 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -0.611 30.000 -4.453 1.00 0.00 H new ATOM 616 N THR A 42 1.687 29.909 -5.583 1.00 0.00 N ATOM 617 CA THR A 42 2.988 30.169 -6.256 1.00 0.00 C ATOM 618 C THR A 42 3.755 28.861 -6.455 1.00 0.00 C ATOM 619 O THR A 42 4.922 28.764 -6.133 1.00 0.00 O ATOM 620 CB THR A 42 3.747 31.095 -5.305 1.00 0.00 C ATOM 621 OG1 THR A 42 3.695 30.563 -3.989 1.00 0.00 O ATOM 622 CG2 THR A 42 3.106 32.483 -5.323 1.00 0.00 C ATOM 0 H THR A 42 1.750 29.630 -4.604 1.00 0.00 H new ATOM 0 HA THR A 42 2.859 30.613 -7.243 1.00 0.00 H new ATOM 0 HB THR A 42 4.786 31.174 -5.624 1.00 0.00 H new ATOM 0 HG1 THR A 42 4.182 31.154 -3.378 1.00 0.00 H new ATOM 0 HG21 THR A 42 3.647 33.143 -4.645 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.146 32.889 -6.334 1.00 0.00 H new ATOM 0 HG23 THR A 42 2.067 32.408 -5.003 1.00 0.00 H new ATOM 630 N TYR A 43 3.116 27.852 -6.982 1.00 0.00 N ATOM 631 CA TYR A 43 3.834 26.563 -7.188 1.00 0.00 C ATOM 632 C TYR A 43 4.878 26.706 -8.302 1.00 0.00 C ATOM 633 O TYR A 43 4.589 27.177 -9.384 1.00 0.00 O ATOM 634 CB TYR A 43 2.758 25.550 -7.596 1.00 0.00 C ATOM 635 CG TYR A 43 3.426 24.349 -8.228 1.00 0.00 C ATOM 636 CD1 TYR A 43 4.009 23.366 -7.420 1.00 0.00 C ATOM 637 CD2 TYR A 43 3.476 24.230 -9.623 1.00 0.00 C ATOM 638 CE1 TYR A 43 4.643 22.264 -8.007 1.00 0.00 C ATOM 639 CE2 TYR A 43 4.108 23.127 -10.208 1.00 0.00 C ATOM 640 CZ TYR A 43 4.692 22.144 -9.400 1.00 0.00 C ATOM 641 OH TYR A 43 5.317 21.058 -9.976 1.00 0.00 O ATOM 0 H TYR A 43 2.139 27.863 -7.276 1.00 0.00 H new ATOM 0 HA TYR A 43 4.364 26.249 -6.288 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.180 25.244 -6.724 1.00 0.00 H new ATOM 0 HB3 TYR A 43 2.059 26.005 -8.298 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.970 23.457 -6.345 1.00 0.00 H new ATOM 0 HD2 TYR A 43 3.027 24.989 -10.247 1.00 0.00 H new ATOM 0 HE1 TYR A 43 5.094 21.506 -7.384 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.145 23.034 -11.283 1.00 0.00 H new ATOM 0 HH TYR A 43 5.660 21.308 -10.859 1.00 0.00 H new ATOM 651 N ILE A 44 6.087 26.286 -8.045 1.00 0.00 N ATOM 652 CA ILE A 44 7.148 26.379 -9.086 1.00 0.00 C ATOM 653 C ILE A 44 7.766 24.997 -9.314 1.00 0.00 C ATOM 654 O ILE A 44 7.889 24.213 -8.393 1.00 0.00 O ATOM 655 CB ILE A 44 8.184 27.349 -8.520 1.00 0.00 C ATOM 656 CG1 ILE A 44 7.554 28.736 -8.369 1.00 0.00 C ATOM 657 CG2 ILE A 44 9.374 27.433 -9.477 1.00 0.00 C ATOM 658 CD1 ILE A 44 7.933 29.324 -7.010 1.00 0.00 C ATOM 0 H ILE A 44 6.385 25.882 -7.157 1.00 0.00 H new ATOM 0 HA ILE A 44 6.763 26.723 -10.046 1.00 0.00 H new ATOM 0 HB ILE A 44 8.522 26.995 -7.546 1.00 0.00 H new ATOM 0 HG12 ILE A 44 7.897 29.392 -9.169 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.470 28.666 -8.457 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.115 28.124 -9.076 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.822 26.445 -9.588 1.00 0.00 H new ATOM 0 HG23 ILE A 44 9.034 27.789 -10.450 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.484 30.312 -6.903 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.568 28.672 -6.217 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.017 29.409 -6.940 1.00 0.00 H new ATOM 670 N PRO A 45 8.129 24.743 -10.542 1.00 0.00 N ATOM 671 CA PRO A 45 8.732 23.435 -10.902 1.00 0.00 C ATOM 672 C PRO A 45 10.150 23.322 -10.336 1.00 0.00 C ATOM 673 O PRO A 45 11.115 23.700 -10.971 1.00 0.00 O ATOM 674 CB PRO A 45 8.753 23.460 -12.427 1.00 0.00 C ATOM 675 CG PRO A 45 8.762 24.911 -12.788 1.00 0.00 C ATOM 676 CD PRO A 45 8.016 25.636 -11.699 1.00 0.00 C ATOM 0 HA PRO A 45 8.181 22.584 -10.502 1.00 0.00 H new ATOM 0 HB2 PRO A 45 9.633 22.950 -12.818 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.881 22.955 -12.842 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.783 25.282 -12.870 1.00 0.00 H new ATOM 0 HG3 PRO A 45 8.286 25.071 -13.755 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.456 26.612 -11.495 1.00 0.00 H new ATOM 0 HD3 PRO A 45 6.975 25.806 -11.973 1.00 0.00 H new ATOM 684 N ARG A 46 10.283 22.799 -9.147 1.00 0.00 N ATOM 685 CA ARG A 46 11.639 22.657 -8.541 1.00 0.00 C ATOM 686 C ARG A 46 12.157 21.230 -8.743 1.00 0.00 C ATOM 687 O ARG A 46 11.393 20.296 -8.858 1.00 0.00 O ATOM 688 CB ARG A 46 11.440 22.951 -7.054 1.00 0.00 C ATOM 689 CG ARG A 46 11.432 24.465 -6.831 1.00 0.00 C ATOM 690 CD ARG A 46 10.128 24.877 -6.142 1.00 0.00 C ATOM 691 NE ARG A 46 10.068 24.050 -4.906 1.00 0.00 N ATOM 692 CZ ARG A 46 9.494 24.520 -3.832 1.00 0.00 C ATOM 693 NH1 ARG A 46 8.758 25.596 -3.903 1.00 0.00 N ATOM 694 NH2 ARG A 46 9.655 23.913 -2.689 1.00 0.00 N ATOM 0 H ARG A 46 9.512 22.464 -8.569 1.00 0.00 H new ATOM 0 HA ARG A 46 12.369 23.328 -8.994 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.502 22.517 -6.709 1.00 0.00 H new ATOM 0 HB3 ARG A 46 12.238 22.491 -6.471 1.00 0.00 H new ATOM 0 HG2 ARG A 46 12.286 24.757 -6.220 1.00 0.00 H new ATOM 0 HG3 ARG A 46 11.531 24.984 -7.785 1.00 0.00 H new ATOM 0 HD2 ARG A 46 10.126 25.941 -5.906 1.00 0.00 H new ATOM 0 HD3 ARG A 46 9.267 24.691 -6.784 1.00 0.00 H new ATOM 0 HE ARG A 46 10.476 23.115 -4.898 1.00 0.00 H new ATOM 0 HH11 ARG A 46 8.632 26.069 -4.798 1.00 0.00 H new ATOM 0 HH12 ARG A 46 8.309 25.963 -3.064 1.00 0.00 H new ATOM 0 HH21 ARG A 46 10.229 23.072 -2.635 1.00 0.00 H new ATOM 0 HH22 ARG A 46 9.207 24.280 -1.849 1.00 0.00 H new ATOM 708 N LYS A 47 13.449 21.058 -8.790 1.00 0.00 N ATOM 709 CA LYS A 47 14.014 19.691 -8.990 1.00 0.00 C ATOM 710 C LYS A 47 13.239 18.664 -8.159 1.00 0.00 C ATOM 711 O LYS A 47 13.103 17.518 -8.542 1.00 0.00 O ATOM 712 CB LYS A 47 15.462 19.790 -8.508 1.00 0.00 C ATOM 713 CG LYS A 47 16.185 18.469 -8.786 1.00 0.00 C ATOM 714 CD LYS A 47 17.658 18.604 -8.397 1.00 0.00 C ATOM 715 CE LYS A 47 18.346 17.244 -8.528 1.00 0.00 C ATOM 716 NZ LYS A 47 18.363 16.690 -7.146 1.00 0.00 N ATOM 0 H LYS A 47 14.139 21.804 -8.699 1.00 0.00 H new ATOM 0 HA LYS A 47 13.949 19.366 -10.028 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.970 20.609 -9.017 1.00 0.00 H new ATOM 0 HB3 LYS A 47 15.487 20.013 -7.441 1.00 0.00 H new ATOM 0 HG2 LYS A 47 15.721 17.662 -8.220 1.00 0.00 H new ATOM 0 HG3 LYS A 47 16.098 18.209 -9.841 1.00 0.00 H new ATOM 0 HD2 LYS A 47 18.149 19.335 -9.039 1.00 0.00 H new ATOM 0 HD3 LYS A 47 17.743 18.970 -7.374 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.802 16.590 -9.209 1.00 0.00 H new ATOM 0 HE3 LYS A 47 19.356 17.348 -8.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 18.820 15.756 -7.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 18.893 17.331 -6.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.388 16.596 -6.798 1.00 0.00 H new ATOM 730 N GLU A 48 12.727 19.062 -7.027 1.00 0.00 N ATOM 731 CA GLU A 48 11.960 18.103 -6.180 1.00 0.00 C ATOM 732 C GLU A 48 10.846 17.454 -7.005 1.00 0.00 C ATOM 733 O GLU A 48 10.601 16.272 -6.907 1.00 0.00 O ATOM 734 CB GLU A 48 11.372 18.949 -5.052 1.00 0.00 C ATOM 735 CG GLU A 48 11.102 18.058 -3.838 1.00 0.00 C ATOM 736 CD GLU A 48 10.321 18.846 -2.785 1.00 0.00 C ATOM 737 OE1 GLU A 48 9.138 19.060 -2.991 1.00 0.00 O ATOM 738 OE2 GLU A 48 10.917 19.218 -1.788 1.00 0.00 O ATOM 0 H GLU A 48 12.806 20.007 -6.652 1.00 0.00 H new ATOM 0 HA GLU A 48 12.585 17.297 -5.796 1.00 0.00 H new ATOM 0 HB2 GLU A 48 12.063 19.749 -4.784 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.448 19.423 -5.382 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.537 17.176 -4.140 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.043 17.704 -3.418 1.00 0.00 H new ATOM 745 N VAL A 49 10.178 18.227 -7.819 1.00 0.00 N ATOM 746 CA VAL A 49 9.081 17.675 -8.668 1.00 0.00 C ATOM 747 C VAL A 49 9.056 18.415 -10.013 1.00 0.00 C ATOM 748 O VAL A 49 9.743 19.398 -10.198 1.00 0.00 O ATOM 749 CB VAL A 49 7.787 17.927 -7.876 1.00 0.00 C ATOM 750 CG1 VAL A 49 8.025 17.649 -6.388 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.345 19.382 -8.051 1.00 0.00 C ATOM 0 H VAL A 49 10.347 19.226 -7.933 1.00 0.00 H new ATOM 0 HA VAL A 49 9.209 16.615 -8.885 1.00 0.00 H new ATOM 0 HB VAL A 49 7.009 17.262 -8.251 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.105 17.829 -5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.331 16.611 -6.256 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.809 18.308 -6.015 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.428 19.554 -7.488 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.127 20.047 -7.683 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.165 19.583 -9.107 1.00 0.00 H new ATOM 761 N GLU A 50 8.279 17.959 -10.956 1.00 0.00 N ATOM 762 CA GLU A 50 8.240 18.659 -12.275 1.00 0.00 C ATOM 763 C GLU A 50 6.800 18.873 -12.743 1.00 0.00 C ATOM 764 O GLU A 50 5.953 18.013 -12.599 1.00 0.00 O ATOM 765 CB GLU A 50 8.971 17.726 -13.242 1.00 0.00 C ATOM 766 CG GLU A 50 10.147 18.469 -13.880 1.00 0.00 C ATOM 767 CD GLU A 50 10.326 18.001 -15.325 1.00 0.00 C ATOM 768 OE1 GLU A 50 9.718 18.596 -16.199 1.00 0.00 O ATOM 769 OE2 GLU A 50 11.070 17.056 -15.533 1.00 0.00 O ATOM 0 H GLU A 50 7.675 17.141 -10.875 1.00 0.00 H new ATOM 0 HA GLU A 50 8.700 19.645 -12.217 1.00 0.00 H new ATOM 0 HB2 GLU A 50 9.330 16.844 -12.711 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.286 17.377 -14.015 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.968 19.544 -13.855 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.059 18.284 -13.312 1.00 0.00 H new ATOM 776 N VAL A 51 6.518 20.009 -13.324 1.00 0.00 N ATOM 777 CA VAL A 51 5.136 20.263 -13.821 1.00 0.00 C ATOM 778 C VAL A 51 4.746 19.156 -14.799 1.00 0.00 C ATOM 779 O VAL A 51 5.425 18.915 -15.778 1.00 0.00 O ATOM 780 CB VAL A 51 5.202 21.613 -14.535 1.00 0.00 C ATOM 781 CG1 VAL A 51 3.962 21.787 -15.415 1.00 0.00 C ATOM 782 CG2 VAL A 51 5.248 22.734 -13.496 1.00 0.00 C ATOM 0 H VAL A 51 7.182 20.768 -13.475 1.00 0.00 H new ATOM 0 HA VAL A 51 4.396 20.275 -13.021 1.00 0.00 H new ATOM 0 HB VAL A 51 6.097 21.653 -15.156 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.009 22.750 -15.924 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.925 20.987 -16.154 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.067 21.748 -14.794 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.295 23.698 -14.003 1.00 0.00 H new ATOM 0 HG22 VAL A 51 4.352 22.693 -12.877 1.00 0.00 H new ATOM 0 HG23 VAL A 51 6.130 22.611 -12.867 1.00 0.00 H new ATOM 792 N VAL A 52 3.670 18.470 -14.541 1.00 0.00 N ATOM 793 CA VAL A 52 3.261 17.370 -15.460 1.00 0.00 C ATOM 794 C VAL A 52 2.069 17.796 -16.317 1.00 0.00 C ATOM 795 O VAL A 52 2.142 17.822 -17.529 1.00 0.00 O ATOM 796 CB VAL A 52 2.871 16.216 -14.540 1.00 0.00 C ATOM 797 CG1 VAL A 52 2.752 14.929 -15.356 1.00 0.00 C ATOM 798 CG2 VAL A 52 3.945 16.041 -13.468 1.00 0.00 C ATOM 0 H VAL A 52 3.058 18.621 -13.739 1.00 0.00 H new ATOM 0 HA VAL A 52 4.059 17.097 -16.151 1.00 0.00 H new ATOM 0 HB VAL A 52 1.913 16.434 -14.067 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.474 14.106 -14.698 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.989 15.054 -16.124 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.709 14.708 -15.829 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.670 15.218 -12.809 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.901 15.822 -13.943 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.031 16.959 -12.886 1.00 0.00 H new ATOM 808 N GLU A 53 0.969 18.125 -15.699 1.00 0.00 N ATOM 809 CA GLU A 53 -0.224 18.539 -16.491 1.00 0.00 C ATOM 810 C GLU A 53 -0.908 19.740 -15.836 1.00 0.00 C ATOM 811 O GLU A 53 -0.688 20.040 -14.680 1.00 0.00 O ATOM 812 CB GLU A 53 -1.155 17.323 -16.479 1.00 0.00 C ATOM 813 CG GLU A 53 -0.339 16.043 -16.689 1.00 0.00 C ATOM 814 CD GLU A 53 0.309 16.070 -18.074 1.00 0.00 C ATOM 815 OE1 GLU A 53 -0.341 16.519 -19.003 1.00 0.00 O ATOM 816 OE2 GLU A 53 1.446 15.640 -18.182 1.00 0.00 O ATOM 0 H GLU A 53 0.844 18.126 -14.687 1.00 0.00 H new ATOM 0 HA GLU A 53 0.043 18.839 -17.504 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.690 17.273 -15.531 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.905 17.420 -17.264 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.428 15.958 -15.919 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.984 15.169 -16.595 1.00 0.00 H new ATOM 823 N ILE A 54 -1.739 20.430 -16.570 1.00 0.00 N ATOM 824 CA ILE A 54 -2.440 21.614 -15.992 1.00 0.00 C ATOM 825 C ILE A 54 -3.921 21.562 -16.374 1.00 0.00 C ATOM 826 O ILE A 54 -4.266 21.232 -17.491 1.00 0.00 O ATOM 827 CB ILE A 54 -1.774 22.856 -16.608 1.00 0.00 C ATOM 828 CG1 ILE A 54 -0.364 22.525 -17.119 1.00 0.00 C ATOM 829 CG2 ILE A 54 -1.676 23.948 -15.544 1.00 0.00 C ATOM 830 CD1 ILE A 54 0.543 22.168 -15.941 1.00 0.00 C ATOM 0 H ILE A 54 -1.963 20.226 -17.544 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.372 21.635 -14.904 1.00 0.00 H new ATOM 0 HB ILE A 54 -2.378 23.195 -17.449 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.408 21.693 -17.821 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.046 23.378 -17.660 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.205 24.832 -15.973 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -2.675 24.204 -15.192 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.078 23.588 -14.707 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.542 21.934 -16.309 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.598 23.013 -15.255 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.137 21.302 -15.418 1.00 0.00 H new ATOM 842 N ILE A 55 -4.804 21.868 -15.462 1.00 0.00 N ATOM 843 CA ILE A 55 -6.252 21.807 -15.800 1.00 0.00 C ATOM 844 C ILE A 55 -7.015 23.015 -15.236 1.00 0.00 C ATOM 845 O ILE A 55 -6.761 23.473 -14.139 1.00 0.00 O ATOM 846 CB ILE A 55 -6.731 20.498 -15.159 1.00 0.00 C ATOM 847 CG1 ILE A 55 -7.914 19.948 -15.960 1.00 0.00 C ATOM 848 CG2 ILE A 55 -7.156 20.736 -13.701 1.00 0.00 C ATOM 849 CD1 ILE A 55 -8.689 18.943 -15.108 1.00 0.00 C ATOM 0 H ILE A 55 -4.587 22.155 -14.507 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.426 21.834 -16.876 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.913 19.778 -15.167 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -8.570 20.763 -16.265 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.557 19.468 -16.871 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.493 19.797 -13.262 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.308 21.119 -13.133 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -7.969 21.462 -13.673 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.531 18.553 -15.681 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.031 18.122 -14.825 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -9.059 19.437 -14.210 1.00 0.00 H new ATOM 861 N GLN A 56 -7.966 23.516 -15.979 1.00 0.00 N ATOM 862 CA GLN A 56 -8.769 24.672 -15.490 1.00 0.00 C ATOM 863 C GLN A 56 -9.998 24.153 -14.740 1.00 0.00 C ATOM 864 O GLN A 56 -10.192 22.960 -14.610 1.00 0.00 O ATOM 865 CB GLN A 56 -9.183 25.441 -16.746 1.00 0.00 C ATOM 866 CG GLN A 56 -7.963 25.662 -17.649 1.00 0.00 C ATOM 867 CD GLN A 56 -6.753 26.074 -16.803 1.00 0.00 C ATOM 868 OE1 GLN A 56 -6.067 25.234 -16.257 1.00 0.00 O ATOM 869 NE2 GLN A 56 -6.465 27.339 -16.671 1.00 0.00 N ATOM 0 H GLN A 56 -8.221 23.173 -16.905 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.212 25.310 -14.803 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -9.950 24.886 -17.286 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.619 26.400 -16.468 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.738 24.749 -18.200 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.181 26.434 -18.387 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.042 28.044 -17.130 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.663 27.623 -16.109 1.00 0.00 H new ATOM 878 N ALA A 57 -10.832 25.024 -14.240 1.00 0.00 N ATOM 879 CA ALA A 57 -12.035 24.543 -13.500 1.00 0.00 C ATOM 880 C ALA A 57 -13.267 24.554 -14.407 1.00 0.00 C ATOM 881 O ALA A 57 -13.625 25.566 -14.975 1.00 0.00 O ATOM 882 CB ALA A 57 -12.221 25.515 -12.336 1.00 0.00 C ATOM 0 H ALA A 57 -10.735 26.037 -14.310 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.907 23.518 -13.153 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.091 25.218 -11.750 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.334 25.499 -11.703 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.371 26.523 -12.724 1.00 0.00 H new ATOM 888 N THR A 58 -13.917 23.431 -14.543 1.00 0.00 N ATOM 889 CA THR A 58 -15.128 23.364 -15.408 1.00 0.00 C ATOM 890 C THR A 58 -15.809 22.003 -15.243 1.00 0.00 C ATOM 891 O THR A 58 -16.105 21.329 -16.208 1.00 0.00 O ATOM 892 CB THR A 58 -14.596 23.524 -16.834 1.00 0.00 C ATOM 893 OG1 THR A 58 -15.681 23.504 -17.749 1.00 0.00 O ATOM 894 CG2 THR A 58 -13.636 22.376 -17.150 1.00 0.00 C ATOM 0 H THR A 58 -13.660 22.554 -14.090 1.00 0.00 H new ATOM 0 HA THR A 58 -15.866 24.126 -15.157 1.00 0.00 H new ATOM 0 HB THR A 58 -14.067 24.473 -16.922 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.207 22.688 -17.615 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.256 22.488 -18.165 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.803 22.394 -16.447 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.164 21.426 -17.063 1.00 0.00 H new ATOM 902 N ILE A 59 -16.046 21.582 -14.026 1.00 0.00 N ATOM 903 CA ILE A 59 -16.689 20.252 -13.825 1.00 0.00 C ATOM 904 C ILE A 59 -17.526 20.218 -12.531 1.00 0.00 C ATOM 905 O ILE A 59 -18.739 20.240 -12.573 1.00 0.00 O ATOM 906 CB ILE A 59 -15.503 19.269 -13.782 1.00 0.00 C ATOM 907 CG1 ILE A 59 -15.329 18.645 -15.168 1.00 0.00 C ATOM 908 CG2 ILE A 59 -15.728 18.161 -12.749 1.00 0.00 C ATOM 909 CD1 ILE A 59 -16.527 17.751 -15.483 1.00 0.00 C ATOM 0 H ILE A 59 -15.824 22.096 -13.173 1.00 0.00 H new ATOM 0 HA ILE A 59 -17.398 20.002 -14.614 1.00 0.00 H new ATOM 0 HB ILE A 59 -14.608 19.819 -13.493 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -15.239 19.428 -15.921 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -14.409 18.062 -15.202 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -14.872 17.487 -12.746 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -15.844 18.604 -11.760 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -16.629 17.603 -13.005 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -16.401 17.308 -16.471 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -16.597 16.960 -14.737 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -17.440 18.347 -15.467 1.00 0.00 H new ATOM 921 N ILE A 60 -16.895 20.132 -11.389 1.00 0.00 N ATOM 922 CA ILE A 60 -17.675 20.060 -10.115 1.00 0.00 C ATOM 923 C ILE A 60 -17.893 21.450 -9.510 1.00 0.00 C ATOM 924 O ILE A 60 -16.959 22.185 -9.267 1.00 0.00 O ATOM 925 CB ILE A 60 -16.824 19.204 -9.178 1.00 0.00 C ATOM 926 CG1 ILE A 60 -16.849 17.751 -9.650 1.00 0.00 C ATOM 927 CG2 ILE A 60 -17.389 19.287 -7.759 1.00 0.00 C ATOM 928 CD1 ILE A 60 -15.485 17.108 -9.385 1.00 0.00 C ATOM 0 H ILE A 60 -15.881 20.109 -11.282 1.00 0.00 H new ATOM 0 HA ILE A 60 -18.667 19.641 -10.281 1.00 0.00 H new ATOM 0 HB ILE A 60 -15.797 19.570 -9.184 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -17.631 17.200 -9.127 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -17.084 17.706 -10.713 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -16.783 18.677 -7.090 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -17.372 20.323 -7.421 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -18.416 18.921 -7.754 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -15.500 16.071 -9.721 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -14.714 17.654 -9.928 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -15.269 17.140 -8.317 1.00 0.00 H new ATOM 940 N ARG A 61 -19.126 21.805 -9.253 1.00 0.00 N ATOM 941 CA ARG A 61 -19.419 23.140 -8.654 1.00 0.00 C ATOM 942 C ARG A 61 -18.908 23.200 -7.208 1.00 0.00 C ATOM 943 O ARG A 61 -18.136 22.367 -6.778 1.00 0.00 O ATOM 944 CB ARG A 61 -20.942 23.261 -8.689 1.00 0.00 C ATOM 945 CG ARG A 61 -21.564 22.090 -7.925 1.00 0.00 C ATOM 946 CD ARG A 61 -22.789 21.577 -8.685 1.00 0.00 C ATOM 947 NE ARG A 61 -23.770 22.695 -8.632 1.00 0.00 N ATOM 948 CZ ARG A 61 -24.936 22.511 -8.076 1.00 0.00 C ATOM 949 NH1 ARG A 61 -25.017 21.928 -6.911 1.00 0.00 N ATOM 950 NH2 ARG A 61 -26.018 22.908 -8.686 1.00 0.00 N ATOM 0 H ARG A 61 -19.945 21.225 -9.433 1.00 0.00 H new ATOM 0 HA ARG A 61 -18.931 23.951 -9.195 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -21.253 24.206 -8.244 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -21.294 23.264 -9.721 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -20.834 21.289 -7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -21.851 22.408 -6.923 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -22.537 21.322 -9.714 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -23.192 20.676 -8.222 1.00 0.00 H new ATOM 0 HE ARG A 61 -23.531 23.603 -9.030 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -24.169 21.617 -6.436 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -25.928 21.784 -6.475 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -25.952 23.362 -9.597 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -26.930 22.765 -8.252 1.00 0.00 H new ATOM 964 N GLN A 62 -19.332 24.182 -6.455 1.00 0.00 N ATOM 965 CA GLN A 62 -18.862 24.289 -5.038 1.00 0.00 C ATOM 966 C GLN A 62 -19.814 23.559 -4.087 1.00 0.00 C ATOM 967 O GLN A 62 -19.493 23.318 -2.940 1.00 0.00 O ATOM 968 CB GLN A 62 -18.800 25.792 -4.713 1.00 0.00 C ATOM 969 CG GLN A 62 -20.046 26.527 -5.230 1.00 0.00 C ATOM 970 CD GLN A 62 -21.311 25.827 -4.732 1.00 0.00 C ATOM 971 OE1 GLN A 62 -22.033 25.229 -5.505 1.00 0.00 O ATOM 972 NE2 GLN A 62 -21.612 25.877 -3.463 1.00 0.00 N ATOM 0 H GLN A 62 -19.979 24.911 -6.756 1.00 0.00 H new ATOM 0 HA GLN A 62 -17.885 23.822 -4.913 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -18.715 25.930 -3.635 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.907 26.227 -5.161 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -20.035 27.562 -4.889 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -20.038 26.550 -6.320 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -21.006 26.379 -2.814 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -22.454 25.414 -3.120 1.00 0.00 H new ATOM 981 N ASN A 63 -20.976 23.194 -4.550 1.00 0.00 N ATOM 982 CA ASN A 63 -21.931 22.470 -3.662 1.00 0.00 C ATOM 983 C ASN A 63 -21.657 20.968 -3.734 1.00 0.00 C ATOM 984 O ASN A 63 -21.444 20.314 -2.734 1.00 0.00 O ATOM 985 CB ASN A 63 -23.320 22.793 -4.214 1.00 0.00 C ATOM 986 CG ASN A 63 -24.040 23.746 -3.260 1.00 0.00 C ATOM 987 OD1 ASN A 63 -23.855 24.945 -3.326 1.00 0.00 O ATOM 988 ND2 ASN A 63 -24.860 23.262 -2.368 1.00 0.00 N ATOM 0 H ASN A 63 -21.306 23.364 -5.500 1.00 0.00 H new ATOM 0 HA ASN A 63 -21.839 22.768 -2.618 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -23.234 23.247 -5.201 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -23.897 21.876 -4.334 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -25.345 23.890 -1.727 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -25.016 22.256 -2.312 1.00 0.00 H new ATOM 995 N GLN A 64 -21.654 20.418 -4.913 1.00 0.00 N ATOM 996 CA GLN A 64 -21.388 18.961 -5.053 1.00 0.00 C ATOM 997 C GLN A 64 -20.029 18.610 -4.439 1.00 0.00 C ATOM 998 O GLN A 64 -19.020 19.208 -4.752 1.00 0.00 O ATOM 999 CB GLN A 64 -21.382 18.712 -6.564 1.00 0.00 C ATOM 1000 CG GLN A 64 -20.623 17.420 -6.879 1.00 0.00 C ATOM 1001 CD GLN A 64 -21.314 16.239 -6.194 1.00 0.00 C ATOM 1002 OE1 GLN A 64 -20.681 15.468 -5.500 1.00 0.00 O ATOM 1003 NE2 GLN A 64 -22.596 16.063 -6.362 1.00 0.00 N ATOM 0 H GLN A 64 -21.824 20.914 -5.788 1.00 0.00 H new ATOM 0 HA GLN A 64 -22.130 18.349 -4.541 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -22.405 18.642 -6.933 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -20.915 19.552 -7.077 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -20.589 17.260 -7.957 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -19.591 17.500 -6.536 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -23.128 16.710 -6.944 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -23.067 15.278 -5.911 1.00 0.00 H new ATOM 1012 N ALA A 65 -19.997 17.632 -3.576 1.00 0.00 N ATOM 1013 CA ALA A 65 -18.707 17.225 -2.953 1.00 0.00 C ATOM 1014 C ALA A 65 -18.277 15.880 -3.539 1.00 0.00 C ATOM 1015 O ALA A 65 -19.093 15.005 -3.762 1.00 0.00 O ATOM 1016 CB ALA A 65 -19.003 17.095 -1.459 1.00 0.00 C ATOM 0 H ALA A 65 -20.811 17.096 -3.275 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.903 17.939 -3.134 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -18.096 16.797 -0.933 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -19.349 18.054 -1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -19.776 16.342 -1.305 1.00 0.00 H new ATOM 1022 N LEU A 66 -17.013 15.709 -3.808 1.00 0.00 N ATOM 1023 CA LEU A 66 -16.557 14.422 -4.400 1.00 0.00 C ATOM 1024 C LEU A 66 -15.524 13.745 -3.501 1.00 0.00 C ATOM 1025 O LEU A 66 -14.505 14.315 -3.167 1.00 0.00 O ATOM 1026 CB LEU A 66 -15.930 14.807 -5.740 1.00 0.00 C ATOM 1027 CG LEU A 66 -16.807 14.291 -6.883 1.00 0.00 C ATOM 1028 CD1 LEU A 66 -16.878 12.765 -6.828 1.00 0.00 C ATOM 1029 CD2 LEU A 66 -18.216 14.871 -6.744 1.00 0.00 C ATOM 0 H LEU A 66 -16.281 16.400 -3.645 1.00 0.00 H new ATOM 0 HA LEU A 66 -17.377 13.714 -4.515 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -15.827 15.890 -5.807 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -14.928 14.386 -5.818 1.00 0.00 H new ATOM 0 HG LEU A 66 -16.377 14.599 -7.836 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.503 12.400 -7.643 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.875 12.350 -6.927 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.307 12.455 -5.875 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.842 14.505 -7.557 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -18.644 14.563 -5.790 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.167 15.959 -6.786 1.00 0.00 H new ATOM 1041 N ARG A 67 -15.774 12.523 -3.122 1.00 0.00 N ATOM 1042 CA ARG A 67 -14.805 11.799 -2.258 1.00 0.00 C ATOM 1043 C ARG A 67 -13.813 11.049 -3.142 1.00 0.00 C ATOM 1044 O ARG A 67 -14.196 10.308 -4.024 1.00 0.00 O ATOM 1045 CB ARG A 67 -15.649 10.818 -1.445 1.00 0.00 C ATOM 1046 CG ARG A 67 -16.780 11.572 -0.743 1.00 0.00 C ATOM 1047 CD ARG A 67 -16.706 11.308 0.763 1.00 0.00 C ATOM 1048 NE ARG A 67 -17.987 10.626 1.099 1.00 0.00 N ATOM 1049 CZ ARG A 67 -18.311 10.426 2.348 1.00 0.00 C ATOM 1050 NH1 ARG A 67 -18.400 11.435 3.170 1.00 0.00 N ATOM 1051 NH2 ARG A 67 -18.544 9.215 2.775 1.00 0.00 N ATOM 0 H ARG A 67 -16.609 11.995 -3.374 1.00 0.00 H new ATOM 0 HA ARG A 67 -14.234 12.465 -1.610 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -16.062 10.049 -2.099 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -15.026 10.310 -0.709 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -16.698 12.641 -0.941 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.745 11.249 -1.133 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -15.849 10.683 1.012 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -16.596 12.237 1.322 1.00 0.00 H new ATOM 0 HE ARG A 67 -18.611 10.315 0.354 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -18.216 12.382 2.837 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -18.653 11.277 4.145 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -18.473 8.425 2.133 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -18.797 9.058 3.751 1.00 0.00 H new ATOM 1065 N LEU A 68 -12.544 11.254 -2.938 1.00 0.00 N ATOM 1066 CA LEU A 68 -11.546 10.559 -3.802 1.00 0.00 C ATOM 1067 C LEU A 68 -10.612 9.663 -2.981 1.00 0.00 C ATOM 1068 O LEU A 68 -10.283 9.957 -1.849 1.00 0.00 O ATOM 1069 CB LEU A 68 -10.759 11.686 -4.468 1.00 0.00 C ATOM 1070 CG LEU A 68 -11.728 12.741 -5.005 1.00 0.00 C ATOM 1071 CD1 LEU A 68 -10.962 13.736 -5.879 1.00 0.00 C ATOM 1072 CD2 LEU A 68 -12.810 12.060 -5.844 1.00 0.00 C ATOM 0 H LEU A 68 -12.155 11.865 -2.220 1.00 0.00 H new ATOM 0 HA LEU A 68 -12.030 9.901 -4.523 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -10.074 12.138 -3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -10.152 11.288 -5.281 1.00 0.00 H new ATOM 0 HG LEU A 68 -12.191 13.267 -4.170 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -11.651 14.489 -6.263 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -10.188 14.222 -5.285 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -10.501 13.207 -6.713 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -13.501 12.812 -6.227 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -12.346 11.535 -6.679 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.356 11.348 -5.225 1.00 0.00 H new ATOM 1084 N ARG A 69 -10.180 8.570 -3.558 1.00 0.00 N ATOM 1085 CA ARG A 69 -9.260 7.645 -2.833 1.00 0.00 C ATOM 1086 C ARG A 69 -8.005 7.380 -3.672 1.00 0.00 C ATOM 1087 O ARG A 69 -7.981 7.626 -4.863 1.00 0.00 O ATOM 1088 CB ARG A 69 -10.062 6.355 -2.645 1.00 0.00 C ATOM 1089 CG ARG A 69 -9.527 5.594 -1.429 1.00 0.00 C ATOM 1090 CD ARG A 69 -9.795 4.097 -1.605 1.00 0.00 C ATOM 1091 NE ARG A 69 -11.259 3.939 -1.385 1.00 0.00 N ATOM 1092 CZ ARG A 69 -11.951 3.138 -2.148 1.00 0.00 C ATOM 1093 NH1 ARG A 69 -11.971 3.323 -3.440 1.00 0.00 N ATOM 1094 NH2 ARG A 69 -12.625 2.153 -1.620 1.00 0.00 N ATOM 0 H ARG A 69 -10.427 8.279 -4.504 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.924 8.059 -1.882 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.118 6.588 -2.506 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.987 5.734 -3.538 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.458 5.772 -1.317 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -10.007 5.956 -0.520 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.507 3.759 -2.600 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.222 3.507 -0.890 1.00 0.00 H new ATOM 0 HE ARG A 69 -11.721 4.457 -0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -11.446 4.094 -3.853 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -12.512 2.697 -4.037 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -12.611 2.009 -0.610 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -13.166 1.527 -2.217 1.00 0.00 H new ATOM 1108 N ALA A 70 -6.962 6.885 -3.062 1.00 0.00 N ATOM 1109 CA ALA A 70 -5.708 6.609 -3.825 1.00 0.00 C ATOM 1110 C ALA A 70 -5.833 5.303 -4.613 1.00 0.00 C ATOM 1111 O ALA A 70 -6.568 4.408 -4.246 1.00 0.00 O ATOM 1112 CB ALA A 70 -4.611 6.483 -2.767 1.00 0.00 C ATOM 0 H ALA A 70 -6.923 6.659 -2.068 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.494 7.397 -4.547 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.657 6.279 -3.254 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.540 7.414 -2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.853 5.666 -2.087 1.00 0.00 H new ATOM 1118 N ARG A 71 -5.109 5.188 -5.693 1.00 0.00 N ATOM 1119 CA ARG A 71 -5.169 3.943 -6.509 1.00 0.00 C ATOM 1120 C ARG A 71 -3.756 3.391 -6.722 1.00 0.00 C ATOM 1121 O ARG A 71 -3.552 2.197 -6.826 1.00 0.00 O ATOM 1122 CB ARG A 71 -5.787 4.373 -7.839 1.00 0.00 C ATOM 1123 CG ARG A 71 -5.905 3.160 -8.764 1.00 0.00 C ATOM 1124 CD ARG A 71 -6.687 2.053 -8.055 1.00 0.00 C ATOM 1125 NE ARG A 71 -7.953 2.698 -7.612 1.00 0.00 N ATOM 1126 CZ ARG A 71 -9.037 2.560 -8.324 1.00 0.00 C ATOM 1127 NH1 ARG A 71 -8.950 2.403 -9.616 1.00 0.00 N ATOM 1128 NH2 ARG A 71 -10.207 2.579 -7.745 1.00 0.00 N ATOM 0 H ARG A 71 -4.476 5.906 -6.046 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.750 3.156 -6.029 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.770 4.812 -7.670 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.171 5.141 -8.306 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.409 3.442 -9.688 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.913 2.801 -9.039 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.884 1.217 -8.726 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.129 1.656 -7.207 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.973 3.247 -6.753 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -8.036 2.388 -10.068 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -9.796 2.295 -10.175 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -10.274 2.702 -6.735 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -11.054 2.471 -8.303 1.00 0.00 H new ATOM 1142 N LYS A 72 -2.777 4.253 -6.778 1.00 0.00 N ATOM 1143 CA LYS A 72 -1.376 3.785 -6.973 1.00 0.00 C ATOM 1144 C LYS A 72 -0.507 4.250 -5.801 1.00 0.00 C ATOM 1145 O LYS A 72 -0.501 5.411 -5.447 1.00 0.00 O ATOM 1146 CB LYS A 72 -0.917 4.442 -8.275 1.00 0.00 C ATOM 1147 CG LYS A 72 0.508 3.992 -8.599 1.00 0.00 C ATOM 1148 CD LYS A 72 0.520 2.485 -8.866 1.00 0.00 C ATOM 1149 CE LYS A 72 1.909 2.061 -9.347 1.00 0.00 C ATOM 1150 NZ LYS A 72 2.287 3.072 -10.373 1.00 0.00 N ATOM 0 H LYS A 72 -2.888 5.264 -6.697 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.301 2.699 -7.019 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.589 4.170 -9.089 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.954 5.527 -8.180 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.881 4.529 -9.471 1.00 0.00 H new ATOM 0 HG3 LYS A 72 1.173 4.230 -7.769 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.257 1.942 -7.958 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.229 2.232 -9.617 1.00 0.00 H new ATOM 0 HE2 LYS A 72 2.624 2.047 -8.525 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.890 1.057 -9.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.963 2.652 -11.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.437 3.379 -10.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.725 3.892 -9.907 1.00 0.00 H new ATOM 1164 N GLU A 73 0.222 3.354 -5.193 1.00 0.00 N ATOM 1165 CA GLU A 73 1.085 3.753 -4.041 1.00 0.00 C ATOM 1166 C GLU A 73 2.216 4.671 -4.514 1.00 0.00 C ATOM 1167 O GLU A 73 3.381 4.377 -4.341 1.00 0.00 O ATOM 1168 CB GLU A 73 1.652 2.441 -3.498 1.00 0.00 C ATOM 1169 CG GLU A 73 2.585 1.821 -4.538 1.00 0.00 C ATOM 1170 CD GLU A 73 2.649 0.307 -4.327 1.00 0.00 C ATOM 1171 OE1 GLU A 73 3.195 -0.108 -3.317 1.00 0.00 O ATOM 1172 OE2 GLU A 73 2.150 -0.410 -5.178 1.00 0.00 O ATOM 0 H GLU A 73 0.258 2.366 -5.442 1.00 0.00 H new ATOM 0 HA GLU A 73 0.529 4.303 -3.282 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.194 2.623 -2.570 1.00 0.00 H new ATOM 0 HB3 GLU A 73 0.841 1.751 -3.264 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.226 2.044 -5.543 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.582 2.253 -4.452 1.00 0.00 H new ATOM 1179 N CYS A 74 1.877 5.780 -5.112 1.00 0.00 N ATOM 1180 CA CYS A 74 2.929 6.721 -5.602 1.00 0.00 C ATOM 1181 C CYS A 74 2.429 8.174 -5.563 1.00 0.00 C ATOM 1182 O CYS A 74 3.209 9.103 -5.490 1.00 0.00 O ATOM 1183 CB CYS A 74 3.205 6.287 -7.043 1.00 0.00 C ATOM 1184 SG CYS A 74 4.934 5.771 -7.196 1.00 0.00 S ATOM 0 H CYS A 74 0.916 6.077 -5.284 1.00 0.00 H new ATOM 0 HA CYS A 74 3.824 6.687 -4.981 1.00 0.00 H new ATOM 0 HB2 CYS A 74 2.543 5.466 -7.320 1.00 0.00 H new ATOM 0 HB3 CYS A 74 2.997 7.109 -7.728 1.00 0.00 H new ATOM 0 HG CYS A 74 5.712 6.742 -6.818 1.00 0.00 H new ATOM 1190 N TRP A 75 1.138 8.381 -5.612 1.00 0.00 N ATOM 1191 CA TRP A 75 0.604 9.772 -5.578 1.00 0.00 C ATOM 1192 C TRP A 75 0.731 10.341 -4.158 1.00 0.00 C ATOM 1193 O TRP A 75 0.149 9.833 -3.220 1.00 0.00 O ATOM 1194 CB TRP A 75 -0.868 9.628 -6.003 1.00 0.00 C ATOM 1195 CG TRP A 75 -1.699 10.707 -5.378 1.00 0.00 C ATOM 1196 CD1 TRP A 75 -1.410 12.025 -5.431 1.00 0.00 C ATOM 1197 CD2 TRP A 75 -2.936 10.588 -4.615 1.00 0.00 C ATOM 1198 NE1 TRP A 75 -2.390 12.726 -4.752 1.00 0.00 N ATOM 1199 CE2 TRP A 75 -3.353 11.885 -4.233 1.00 0.00 C ATOM 1200 CE3 TRP A 75 -3.733 9.494 -4.223 1.00 0.00 C ATOM 1201 CZ2 TRP A 75 -4.514 12.091 -3.489 1.00 0.00 C ATOM 1202 CZ3 TRP A 75 -4.903 9.699 -3.474 1.00 0.00 C ATOM 1203 CH2 TRP A 75 -5.293 10.993 -3.108 1.00 0.00 C ATOM 0 H TRP A 75 0.433 7.647 -5.674 1.00 0.00 H new ATOM 0 HA TRP A 75 1.143 10.458 -6.232 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -0.947 9.682 -7.089 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -1.246 8.650 -5.704 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -0.553 12.461 -5.923 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -2.400 13.741 -4.648 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.442 8.492 -4.500 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -4.810 13.091 -3.209 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -5.506 8.853 -3.178 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -6.194 11.143 -2.532 1.00 0.00 H new ATOM 1214 N ASP A 76 1.498 11.386 -3.996 1.00 0.00 N ATOM 1215 CA ASP A 76 1.676 11.982 -2.640 1.00 0.00 C ATOM 1216 C ASP A 76 0.503 12.904 -2.290 1.00 0.00 C ATOM 1217 O ASP A 76 0.277 13.910 -2.933 1.00 0.00 O ATOM 1218 CB ASP A 76 2.973 12.790 -2.727 1.00 0.00 C ATOM 1219 CG ASP A 76 4.034 11.985 -3.480 1.00 0.00 C ATOM 1220 OD1 ASP A 76 4.040 10.773 -3.342 1.00 0.00 O ATOM 1221 OD2 ASP A 76 4.824 12.595 -4.183 1.00 0.00 O ATOM 0 H ASP A 76 2.009 11.853 -4.745 1.00 0.00 H new ATOM 0 HA ASP A 76 1.715 11.216 -1.866 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.790 13.735 -3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.329 13.032 -1.726 1.00 0.00 H new ATOM 1226 N ARG A 77 -0.235 12.573 -1.265 1.00 0.00 N ATOM 1227 CA ARG A 77 -1.385 13.433 -0.855 1.00 0.00 C ATOM 1228 C ARG A 77 -0.875 14.604 -0.007 1.00 0.00 C ATOM 1229 O ARG A 77 -1.253 15.742 -0.206 1.00 0.00 O ATOM 1230 CB ARG A 77 -2.282 12.518 -0.018 1.00 0.00 C ATOM 1231 CG ARG A 77 -3.757 12.842 -0.274 1.00 0.00 C ATOM 1232 CD ARG A 77 -3.999 14.345 -0.126 1.00 0.00 C ATOM 1233 NE ARG A 77 -4.177 14.562 1.335 1.00 0.00 N ATOM 1234 CZ ARG A 77 -4.925 15.543 1.762 1.00 0.00 C ATOM 1235 NH1 ARG A 77 -4.500 16.774 1.674 1.00 0.00 N ATOM 1236 NH2 ARG A 77 -6.097 15.292 2.278 1.00 0.00 N ATOM 0 H ARG A 77 -0.091 11.742 -0.692 1.00 0.00 H new ATOM 0 HA ARG A 77 -1.918 13.856 -1.707 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.083 11.476 -0.267 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -2.054 12.642 1.041 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.040 12.517 -1.275 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -4.385 12.294 0.428 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -3.157 14.921 -0.511 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.882 14.660 -0.683 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.715 13.945 2.003 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.583 16.970 1.272 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -5.085 17.540 2.008 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -6.428 14.330 2.348 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -6.682 16.058 2.612 1.00 0.00 H new ATOM 1250 N ASP A 78 -0.016 14.328 0.939 1.00 0.00 N ATOM 1251 CA ASP A 78 0.522 15.419 1.803 1.00 0.00 C ATOM 1252 C ASP A 78 1.619 16.191 1.064 1.00 0.00 C ATOM 1253 O ASP A 78 2.170 17.147 1.574 1.00 0.00 O ATOM 1254 CB ASP A 78 1.100 14.704 3.028 1.00 0.00 C ATOM 1255 CG ASP A 78 0.132 14.841 4.204 1.00 0.00 C ATOM 1256 OD1 ASP A 78 -1.007 14.426 4.060 1.00 0.00 O ATOM 1257 OD2 ASP A 78 0.545 15.359 5.228 1.00 0.00 O ATOM 0 H ASP A 78 0.336 13.394 1.150 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.244 16.144 2.077 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.267 13.651 2.802 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.068 15.132 3.289 1.00 0.00 H new ATOM 1262 N GLY A 79 1.940 15.786 -0.136 1.00 0.00 N ATOM 1263 CA GLY A 79 2.999 16.499 -0.905 1.00 0.00 C ATOM 1264 C GLY A 79 4.313 15.721 -0.814 1.00 0.00 C ATOM 1265 O GLY A 79 5.086 15.680 -1.750 1.00 0.00 O ATOM 0 H GLY A 79 1.515 14.993 -0.616 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.698 16.603 -1.947 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.133 17.506 -0.510 1.00 0.00 H new ATOM 1269 N LYS A 80 4.572 15.105 0.306 1.00 0.00 N ATOM 1270 CA LYS A 80 5.839 14.331 0.455 1.00 0.00 C ATOM 1271 C LYS A 80 5.709 12.967 -0.237 1.00 0.00 C ATOM 1272 O LYS A 80 5.764 12.872 -1.447 1.00 0.00 O ATOM 1273 CB LYS A 80 6.023 14.168 1.964 1.00 0.00 C ATOM 1274 CG LYS A 80 6.304 15.532 2.596 1.00 0.00 C ATOM 1275 CD LYS A 80 7.692 15.522 3.237 1.00 0.00 C ATOM 1276 CE LYS A 80 7.549 15.410 4.756 1.00 0.00 C ATOM 1277 NZ LYS A 80 8.920 15.640 5.289 1.00 0.00 N ATOM 0 H LYS A 80 3.963 15.103 1.124 1.00 0.00 H new ATOM 0 HA LYS A 80 6.693 14.831 -0.003 1.00 0.00 H new ATOM 0 HB2 LYS A 80 5.128 13.729 2.405 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.847 13.484 2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.247 16.314 1.839 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.547 15.760 3.346 1.00 0.00 H new ATOM 0 HD2 LYS A 80 8.276 14.686 2.853 1.00 0.00 H new ATOM 0 HD3 LYS A 80 8.231 16.433 2.978 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.846 16.148 5.142 1.00 0.00 H new ATOM 0 HE3 LYS A 80 7.172 14.429 5.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.904 15.579 6.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.566 14.918 4.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 9.250 16.584 5.003 1.00 0.00 H new ATOM 1291 N GLU A 81 5.533 11.910 0.513 1.00 0.00 N ATOM 1292 CA GLU A 81 5.397 10.564 -0.115 1.00 0.00 C ATOM 1293 C GLU A 81 4.284 9.776 0.581 1.00 0.00 C ATOM 1294 O GLU A 81 4.272 9.635 1.788 1.00 0.00 O ATOM 1295 CB GLU A 81 6.751 9.886 0.099 1.00 0.00 C ATOM 1296 CG GLU A 81 7.852 10.713 -0.568 1.00 0.00 C ATOM 1297 CD GLU A 81 7.554 10.853 -2.063 1.00 0.00 C ATOM 1298 OE1 GLU A 81 6.739 10.093 -2.557 1.00 0.00 O ATOM 1299 OE2 GLU A 81 8.147 11.718 -2.687 1.00 0.00 O ATOM 0 H GLU A 81 5.478 11.922 1.531 1.00 0.00 H new ATOM 0 HA GLU A 81 5.137 10.622 -1.172 1.00 0.00 H new ATOM 0 HB2 GLU A 81 6.954 9.785 1.165 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.735 8.879 -0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 81 7.912 11.698 -0.105 1.00 0.00 H new ATOM 0 HG3 GLU A 81 8.820 10.233 -0.423 1.00 0.00 H new ATOM 1306 N ARG A 82 3.348 9.264 -0.169 1.00 0.00 N ATOM 1307 CA ARG A 82 2.236 8.492 0.456 1.00 0.00 C ATOM 1308 C ARG A 82 2.032 7.162 -0.276 1.00 0.00 C ATOM 1309 O ARG A 82 2.619 6.912 -1.310 1.00 0.00 O ATOM 1310 CB ARG A 82 1.003 9.381 0.308 1.00 0.00 C ATOM 1311 CG ARG A 82 0.892 10.307 1.522 1.00 0.00 C ATOM 1312 CD ARG A 82 0.255 9.547 2.688 1.00 0.00 C ATOM 1313 NE ARG A 82 0.143 10.551 3.784 1.00 0.00 N ATOM 1314 CZ ARG A 82 -0.270 10.185 4.967 1.00 0.00 C ATOM 1315 NH1 ARG A 82 -1.544 10.217 5.251 1.00 0.00 N ATOM 1316 NH2 ARG A 82 0.590 9.788 5.865 1.00 0.00 N ATOM 0 H ARG A 82 3.304 9.346 -1.185 1.00 0.00 H new ATOM 0 HA ARG A 82 2.440 8.249 1.499 1.00 0.00 H new ATOM 0 HB2 ARG A 82 1.074 9.970 -0.607 1.00 0.00 H new ATOM 0 HB3 ARG A 82 0.107 8.767 0.223 1.00 0.00 H new ATOM 0 HG2 ARG A 82 1.879 10.670 1.807 1.00 0.00 H new ATOM 0 HG3 ARG A 82 0.291 11.181 1.272 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -0.723 9.150 2.414 1.00 0.00 H new ATOM 0 HD3 ARG A 82 0.870 8.699 2.990 1.00 0.00 H new ATOM 0 HE ARG A 82 0.389 11.525 3.609 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -2.215 10.528 4.549 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -1.868 9.931 6.175 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.585 9.764 5.642 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.267 9.502 6.789 1.00 0.00 H new ATOM 1330 N VAL A 83 1.201 6.309 0.257 1.00 0.00 N ATOM 1331 CA VAL A 83 0.950 4.992 -0.397 1.00 0.00 C ATOM 1332 C VAL A 83 -0.507 4.898 -0.843 1.00 0.00 C ATOM 1333 O VAL A 83 -1.321 5.732 -0.504 1.00 0.00 O ATOM 1334 CB VAL A 83 1.216 3.957 0.695 1.00 0.00 C ATOM 1335 CG1 VAL A 83 0.495 4.383 1.977 1.00 0.00 C ATOM 1336 CG2 VAL A 83 0.680 2.596 0.244 1.00 0.00 C ATOM 0 H VAL A 83 0.683 6.468 1.121 1.00 0.00 H new ATOM 0 HA VAL A 83 1.576 4.845 -1.277 1.00 0.00 H new ATOM 0 HB VAL A 83 2.288 3.885 0.880 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.681 3.648 2.760 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.866 5.356 2.297 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.576 4.448 1.787 1.00 0.00 H new ATOM 0 HG21 VAL A 83 0.868 1.855 1.021 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.393 2.669 0.064 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.182 2.294 -0.675 1.00 0.00 H new ATOM 1346 N THR A 84 -0.851 3.877 -1.582 1.00 0.00 N ATOM 1347 CA THR A 84 -2.268 3.735 -2.011 1.00 0.00 C ATOM 1348 C THR A 84 -3.153 3.705 -0.765 1.00 0.00 C ATOM 1349 O THR A 84 -2.723 4.075 0.309 1.00 0.00 O ATOM 1350 CB THR A 84 -2.338 2.406 -2.765 1.00 0.00 C ATOM 1351 OG1 THR A 84 -3.629 2.262 -3.342 1.00 0.00 O ATOM 1352 CG2 THR A 84 -2.077 1.250 -1.798 1.00 0.00 C ATOM 0 H THR A 84 -0.218 3.144 -1.903 1.00 0.00 H new ATOM 0 HA THR A 84 -2.607 4.556 -2.643 1.00 0.00 H new ATOM 0 HB THR A 84 -1.582 2.393 -3.550 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.677 1.412 -3.828 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.128 0.305 -2.339 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.087 1.362 -1.355 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.830 1.258 -1.010 1.00 0.00 H new ATOM 1360 N GLY A 85 -4.376 3.280 -0.884 1.00 0.00 N ATOM 1361 CA GLY A 85 -5.259 3.254 0.317 1.00 0.00 C ATOM 1362 C GLY A 85 -5.566 4.695 0.732 1.00 0.00 C ATOM 1363 O GLY A 85 -6.707 5.109 0.769 1.00 0.00 O ATOM 0 H GLY A 85 -4.802 2.952 -1.751 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.183 2.720 0.095 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.771 2.722 1.133 1.00 0.00 H new ATOM 1367 N GLU A 86 -4.552 5.469 1.030 1.00 0.00 N ATOM 1368 CA GLU A 86 -4.787 6.886 1.423 1.00 0.00 C ATOM 1369 C GLU A 86 -5.822 7.502 0.480 1.00 0.00 C ATOM 1370 O GLU A 86 -5.948 7.102 -0.660 1.00 0.00 O ATOM 1371 CB GLU A 86 -3.417 7.560 1.264 1.00 0.00 C ATOM 1372 CG GLU A 86 -3.567 9.087 1.186 1.00 0.00 C ATOM 1373 CD GLU A 86 -3.314 9.693 2.567 1.00 0.00 C ATOM 1374 OE1 GLU A 86 -3.597 9.024 3.547 1.00 0.00 O ATOM 1375 OE2 GLU A 86 -2.843 10.817 2.622 1.00 0.00 O ATOM 0 H GLU A 86 -3.574 5.178 1.017 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.172 6.999 2.436 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.776 7.295 2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.928 7.191 0.362 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.862 9.496 0.462 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.567 9.348 0.840 1.00 0.00 H new ATOM 1382 N GLU A 87 -6.568 8.462 0.944 1.00 0.00 N ATOM 1383 CA GLU A 87 -7.597 9.083 0.065 1.00 0.00 C ATOM 1384 C GLU A 87 -7.736 10.575 0.365 1.00 0.00 C ATOM 1385 O GLU A 87 -7.366 11.049 1.420 1.00 0.00 O ATOM 1386 CB GLU A 87 -8.893 8.354 0.412 1.00 0.00 C ATOM 1387 CG GLU A 87 -9.151 8.465 1.916 1.00 0.00 C ATOM 1388 CD GLU A 87 -10.628 8.186 2.202 1.00 0.00 C ATOM 1389 OE1 GLU A 87 -11.091 7.122 1.829 1.00 0.00 O ATOM 1390 OE2 GLU A 87 -11.269 9.042 2.790 1.00 0.00 O ATOM 0 H GLU A 87 -6.512 8.843 1.889 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.338 8.998 -0.990 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -9.726 8.785 -0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -8.823 7.306 0.120 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -8.525 7.756 2.457 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -8.883 9.461 2.269 1.00 0.00 H new ATOM 1397 N TRP A 88 -8.280 11.315 -0.560 1.00 0.00 N ATOM 1398 CA TRP A 88 -8.464 12.777 -0.342 1.00 0.00 C ATOM 1399 C TRP A 88 -9.867 13.185 -0.804 1.00 0.00 C ATOM 1400 O TRP A 88 -10.480 12.525 -1.619 1.00 0.00 O ATOM 1401 CB TRP A 88 -7.352 13.442 -1.181 1.00 0.00 C ATOM 1402 CG TRP A 88 -7.907 14.510 -2.078 1.00 0.00 C ATOM 1403 CD1 TRP A 88 -8.374 14.303 -3.331 1.00 0.00 C ATOM 1404 CD2 TRP A 88 -8.058 15.937 -1.817 1.00 0.00 C ATOM 1405 NE1 TRP A 88 -8.801 15.510 -3.856 1.00 0.00 N ATOM 1406 CE2 TRP A 88 -8.627 16.547 -2.961 1.00 0.00 C ATOM 1407 CE3 TRP A 88 -7.760 16.753 -0.710 1.00 0.00 C ATOM 1408 CZ2 TRP A 88 -8.890 17.916 -3.006 1.00 0.00 C ATOM 1409 CZ3 TRP A 88 -8.024 18.132 -0.752 1.00 0.00 C ATOM 1410 CH2 TRP A 88 -8.588 18.712 -1.898 1.00 0.00 C ATOM 0 H TRP A 88 -8.607 10.968 -1.462 1.00 0.00 H new ATOM 0 HA TRP A 88 -8.388 13.077 0.703 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -6.603 13.875 -0.518 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.847 12.686 -1.782 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -8.408 13.350 -3.839 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -9.196 15.620 -4.790 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -7.326 16.316 0.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.324 18.358 -3.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -7.791 18.749 0.103 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -8.789 19.773 -1.924 1.00 0.00 H new ATOM 1421 N LEU A 89 -10.377 14.266 -0.290 1.00 0.00 N ATOM 1422 CA LEU A 89 -11.735 14.714 -0.700 1.00 0.00 C ATOM 1423 C LEU A 89 -11.636 16.032 -1.466 1.00 0.00 C ATOM 1424 O LEU A 89 -10.655 16.742 -1.376 1.00 0.00 O ATOM 1425 CB LEU A 89 -12.495 14.907 0.608 1.00 0.00 C ATOM 1426 CG LEU A 89 -13.946 14.459 0.432 1.00 0.00 C ATOM 1427 CD1 LEU A 89 -14.601 14.319 1.801 1.00 0.00 C ATOM 1428 CD2 LEU A 89 -14.710 15.499 -0.383 1.00 0.00 C ATOM 0 H LEU A 89 -9.912 14.860 0.397 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.233 14.000 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.021 14.332 1.403 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.462 15.954 0.908 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.966 13.501 -0.088 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -15.636 14.000 1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.060 13.578 2.389 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.576 15.279 2.316 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.744 15.177 -0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.688 16.457 0.137 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.244 15.608 -1.362 1.00 0.00 H new ATOM 1440 N VAL A 90 -12.642 16.366 -2.222 1.00 0.00 N ATOM 1441 CA VAL A 90 -12.594 17.639 -2.991 1.00 0.00 C ATOM 1442 C VAL A 90 -13.926 18.384 -2.882 1.00 0.00 C ATOM 1443 O VAL A 90 -14.974 17.861 -3.211 1.00 0.00 O ATOM 1444 CB VAL A 90 -12.331 17.222 -4.435 1.00 0.00 C ATOM 1445 CG1 VAL A 90 -13.285 16.091 -4.821 1.00 0.00 C ATOM 1446 CG2 VAL A 90 -12.561 18.422 -5.357 1.00 0.00 C ATOM 0 H VAL A 90 -13.492 15.815 -2.341 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.826 18.314 -2.614 1.00 0.00 H new ATOM 0 HB VAL A 90 -11.302 16.877 -4.535 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.097 15.793 -5.853 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -13.124 15.238 -4.162 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.315 16.435 -4.724 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -12.374 18.128 -6.390 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -13.591 18.765 -5.258 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -11.882 19.229 -5.081 1.00 0.00 H new ATOM 1456 N THR A 91 -13.888 19.607 -2.431 1.00 0.00 N ATOM 1457 CA THR A 91 -15.141 20.402 -2.306 1.00 0.00 C ATOM 1458 C THR A 91 -14.953 21.762 -2.986 1.00 0.00 C ATOM 1459 O THR A 91 -15.507 22.760 -2.572 1.00 0.00 O ATOM 1460 CB THR A 91 -15.361 20.575 -0.801 1.00 0.00 C ATOM 1461 OG1 THR A 91 -14.439 19.762 -0.086 1.00 0.00 O ATOM 1462 CG2 THR A 91 -16.790 20.164 -0.443 1.00 0.00 C ATOM 0 H THR A 91 -13.038 20.092 -2.142 1.00 0.00 H new ATOM 0 HA THR A 91 -15.994 19.916 -2.780 1.00 0.00 H new ATOM 0 HB THR A 91 -15.205 21.620 -0.531 1.00 0.00 H new ATOM 0 HG1 THR A 91 -14.581 19.876 0.877 1.00 0.00 H new ATOM 0 HG21 THR A 91 -16.946 20.287 0.629 1.00 0.00 H new ATOM 0 HG22 THR A 91 -17.496 20.791 -0.987 1.00 0.00 H new ATOM 0 HG23 THR A 91 -16.947 19.120 -0.715 1.00 0.00 H new ATOM 1470 N THR A 92 -14.165 21.803 -4.027 1.00 0.00 N ATOM 1471 CA THR A 92 -13.925 23.092 -4.741 1.00 0.00 C ATOM 1472 C THR A 92 -15.134 23.458 -5.606 1.00 0.00 C ATOM 1473 O THR A 92 -16.054 22.682 -5.768 1.00 0.00 O ATOM 1474 CB THR A 92 -12.698 22.836 -5.615 1.00 0.00 C ATOM 1475 OG1 THR A 92 -12.312 24.047 -6.252 1.00 0.00 O ATOM 1476 CG2 THR A 92 -13.033 21.783 -6.673 1.00 0.00 C ATOM 0 H THR A 92 -13.675 20.997 -4.415 1.00 0.00 H new ATOM 0 HA THR A 92 -13.771 23.922 -4.051 1.00 0.00 H new ATOM 0 HB THR A 92 -11.878 22.474 -4.995 1.00 0.00 H new ATOM 0 HG1 THR A 92 -11.371 24.236 -6.053 1.00 0.00 H new ATOM 0 HG21 THR A 92 -12.157 21.601 -7.296 1.00 0.00 H new ATOM 0 HG22 THR A 92 -13.328 20.855 -6.182 1.00 0.00 H new ATOM 0 HG23 THR A 92 -13.853 22.141 -7.296 1.00 0.00 H new ATOM 1484 N VAL A 93 -15.137 24.641 -6.158 1.00 0.00 N ATOM 1485 CA VAL A 93 -16.285 25.069 -7.010 1.00 0.00 C ATOM 1486 C VAL A 93 -16.148 24.480 -8.417 1.00 0.00 C ATOM 1487 O VAL A 93 -15.284 23.664 -8.670 1.00 0.00 O ATOM 1488 CB VAL A 93 -16.213 26.599 -7.054 1.00 0.00 C ATOM 1489 CG1 VAL A 93 -17.587 27.163 -7.416 1.00 0.00 C ATOM 1490 CG2 VAL A 93 -15.794 27.141 -5.683 1.00 0.00 C ATOM 0 H VAL A 93 -14.393 25.331 -6.056 1.00 0.00 H new ATOM 0 HA VAL A 93 -17.240 24.724 -6.613 1.00 0.00 H new ATOM 0 HB VAL A 93 -15.480 26.900 -7.802 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -17.537 28.251 -7.448 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -17.890 26.785 -8.393 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -18.316 26.855 -6.666 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -15.745 28.229 -5.721 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -16.524 26.837 -4.933 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -14.815 26.743 -5.418 1.00 0.00 H new ATOM 1500 N GLY A 94 -17.002 24.889 -9.327 1.00 0.00 N ATOM 1501 CA GLY A 94 -16.949 24.366 -10.727 1.00 0.00 C ATOM 1502 C GLY A 94 -15.503 24.081 -11.133 1.00 0.00 C ATOM 1503 O GLY A 94 -14.779 24.968 -11.542 1.00 0.00 O ATOM 0 H GLY A 94 -17.741 25.571 -9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -17.542 23.455 -10.805 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.389 25.092 -11.410 1.00 0.00 H new ATOM 1507 N ALA A 95 -15.072 22.854 -11.023 1.00 0.00 N ATOM 1508 CA ALA A 95 -13.672 22.530 -11.405 1.00 0.00 C ATOM 1509 C ALA A 95 -13.470 21.027 -11.592 1.00 0.00 C ATOM 1510 O ALA A 95 -14.097 20.211 -10.944 1.00 0.00 O ATOM 1511 CB ALA A 95 -12.819 23.036 -10.243 1.00 0.00 C ATOM 0 H ALA A 95 -15.627 22.067 -10.687 1.00 0.00 H new ATOM 0 HA ALA A 95 -13.405 22.992 -12.356 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -11.768 22.834 -10.448 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.966 24.110 -10.124 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.114 22.526 -9.326 1.00 0.00 H new ATOM 1517 N TYR A 96 -12.579 20.666 -12.472 1.00 0.00 N ATOM 1518 CA TYR A 96 -12.294 19.227 -12.720 1.00 0.00 C ATOM 1519 C TYR A 96 -10.911 18.889 -12.159 1.00 0.00 C ATOM 1520 O TYR A 96 -9.904 19.337 -12.668 1.00 0.00 O ATOM 1521 CB TYR A 96 -12.313 19.085 -14.244 1.00 0.00 C ATOM 1522 CG TYR A 96 -12.239 17.629 -14.626 1.00 0.00 C ATOM 1523 CD1 TYR A 96 -12.905 16.668 -13.860 1.00 0.00 C ATOM 1524 CD2 TYR A 96 -11.512 17.247 -15.757 1.00 0.00 C ATOM 1525 CE1 TYR A 96 -12.843 15.321 -14.224 1.00 0.00 C ATOM 1526 CE2 TYR A 96 -11.450 15.900 -16.123 1.00 0.00 C ATOM 1527 CZ TYR A 96 -12.115 14.935 -15.356 1.00 0.00 C ATOM 1528 OH TYR A 96 -12.053 13.605 -15.718 1.00 0.00 O ATOM 0 H TYR A 96 -12.030 21.315 -13.036 1.00 0.00 H new ATOM 0 HA TYR A 96 -13.011 18.557 -12.246 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -13.223 19.530 -14.648 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -11.473 19.627 -14.679 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -13.467 16.967 -12.987 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -10.999 17.992 -16.347 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -13.356 14.577 -13.632 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -10.889 15.603 -16.997 1.00 0.00 H new ATOM 0 HH TYR A 96 -11.508 13.511 -16.527 1.00 0.00 H new ATOM 1538 N LEU A 97 -10.848 18.122 -11.106 1.00 0.00 N ATOM 1539 CA LEU A 97 -9.520 17.789 -10.517 1.00 0.00 C ATOM 1540 C LEU A 97 -9.352 16.278 -10.348 1.00 0.00 C ATOM 1541 O LEU A 97 -9.252 15.785 -9.243 1.00 0.00 O ATOM 1542 CB LEU A 97 -9.513 18.484 -9.156 1.00 0.00 C ATOM 1543 CG LEU A 97 -8.743 19.800 -9.264 1.00 0.00 C ATOM 1544 CD1 LEU A 97 -9.729 20.951 -9.470 1.00 0.00 C ATOM 1545 CD2 LEU A 97 -7.946 20.033 -7.980 1.00 0.00 C ATOM 0 H LEU A 97 -11.653 17.714 -10.630 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.700 18.116 -11.157 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -10.535 18.673 -8.826 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.051 17.839 -8.408 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.058 19.752 -10.111 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -9.181 21.890 -9.547 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -10.296 20.785 -10.386 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -10.414 20.999 -8.624 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -7.397 20.972 -8.058 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.629 20.081 -7.132 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.243 19.213 -7.834 1.00 0.00 H new ATOM 1557 N PRO A 98 -9.304 15.595 -11.459 1.00 0.00 N ATOM 1558 CA PRO A 98 -9.120 14.124 -11.439 1.00 0.00 C ATOM 1559 C PRO A 98 -7.667 13.791 -11.081 1.00 0.00 C ATOM 1560 O PRO A 98 -6.814 13.684 -11.940 1.00 0.00 O ATOM 1561 CB PRO A 98 -9.448 13.703 -12.869 1.00 0.00 C ATOM 1562 CG PRO A 98 -9.191 14.918 -13.702 1.00 0.00 C ATOM 1563 CD PRO A 98 -9.419 16.121 -12.823 1.00 0.00 C ATOM 0 HA PRO A 98 -9.743 13.613 -10.705 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -8.824 12.868 -13.187 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -10.485 13.377 -12.956 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.171 14.911 -14.087 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -9.857 14.941 -14.564 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -8.680 16.900 -13.014 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -10.400 16.563 -12.998 1.00 0.00 H new ATOM 1571 N ALA A 99 -7.377 13.647 -9.815 1.00 0.00 N ATOM 1572 CA ALA A 99 -5.977 13.341 -9.392 1.00 0.00 C ATOM 1573 C ALA A 99 -5.365 12.237 -10.258 1.00 0.00 C ATOM 1574 O ALA A 99 -6.050 11.361 -10.748 1.00 0.00 O ATOM 1575 CB ALA A 99 -6.087 12.878 -7.940 1.00 0.00 C ATOM 0 H ALA A 99 -8.050 13.728 -9.053 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.330 14.211 -9.500 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -5.095 12.635 -7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.522 13.674 -7.336 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.723 11.994 -7.887 1.00 0.00 H new ATOM 1581 N VAL A 100 -4.073 12.279 -10.442 1.00 0.00 N ATOM 1582 CA VAL A 100 -3.394 11.239 -11.272 1.00 0.00 C ATOM 1583 C VAL A 100 -3.772 9.828 -10.790 1.00 0.00 C ATOM 1584 O VAL A 100 -4.481 9.109 -11.467 1.00 0.00 O ATOM 1585 CB VAL A 100 -1.888 11.499 -11.106 1.00 0.00 C ATOM 1586 CG1 VAL A 100 -1.472 12.647 -12.029 1.00 0.00 C ATOM 1587 CG2 VAL A 100 -1.562 11.883 -9.657 1.00 0.00 C ATOM 0 H VAL A 100 -3.455 12.991 -10.052 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.693 11.295 -12.319 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.346 10.589 -11.362 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.405 12.836 -11.916 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -1.685 12.378 -13.063 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.030 13.546 -11.766 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.491 12.063 -9.560 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.108 12.788 -9.389 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.855 11.072 -8.991 1.00 0.00 H new ATOM 1597 N PHE A 101 -3.318 9.423 -9.631 1.00 0.00 N ATOM 1598 CA PHE A 101 -3.674 8.062 -9.130 1.00 0.00 C ATOM 1599 C PHE A 101 -4.814 8.168 -8.120 1.00 0.00 C ATOM 1600 O PHE A 101 -4.661 7.834 -6.963 1.00 0.00 O ATOM 1601 CB PHE A 101 -2.418 7.534 -8.432 1.00 0.00 C ATOM 1602 CG PHE A 101 -1.203 7.761 -9.297 1.00 0.00 C ATOM 1603 CD1 PHE A 101 -1.289 7.604 -10.685 1.00 0.00 C ATOM 1604 CD2 PHE A 101 0.013 8.125 -8.707 1.00 0.00 C ATOM 1605 CE1 PHE A 101 -0.158 7.811 -11.483 1.00 0.00 C ATOM 1606 CE2 PHE A 101 1.143 8.333 -9.504 1.00 0.00 C ATOM 1607 CZ PHE A 101 1.059 8.177 -10.892 1.00 0.00 C ATOM 0 H PHE A 101 -2.720 9.972 -9.014 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.996 7.405 -9.938 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.289 8.036 -7.473 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.530 6.470 -8.223 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.227 7.323 -11.140 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.079 8.245 -7.636 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.223 7.689 -12.554 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.081 8.614 -9.048 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.932 8.339 -11.508 1.00 0.00 H new ATOM 1617 N GLU A 102 -5.951 8.646 -8.536 1.00 0.00 N ATOM 1618 CA GLU A 102 -7.080 8.784 -7.578 1.00 0.00 C ATOM 1619 C GLU A 102 -8.406 8.402 -8.236 1.00 0.00 C ATOM 1620 O GLU A 102 -8.607 8.599 -9.418 1.00 0.00 O ATOM 1621 CB GLU A 102 -7.078 10.261 -7.199 1.00 0.00 C ATOM 1622 CG GLU A 102 -8.195 10.530 -6.196 1.00 0.00 C ATOM 1623 CD GLU A 102 -7.661 11.404 -5.059 1.00 0.00 C ATOM 1624 OE1 GLU A 102 -6.808 12.234 -5.327 1.00 0.00 O ATOM 1625 OE2 GLU A 102 -8.116 11.229 -3.941 1.00 0.00 O ATOM 0 H GLU A 102 -6.147 8.945 -9.491 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.968 8.129 -6.714 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.115 10.536 -6.769 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.217 10.876 -8.088 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.030 11.027 -6.690 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.575 9.589 -5.798 1.00 0.00 H new ATOM 1632 N GLU A 103 -9.314 7.862 -7.471 1.00 0.00 N ATOM 1633 CA GLU A 103 -10.636 7.470 -8.036 1.00 0.00 C ATOM 1634 C GLU A 103 -11.758 7.990 -7.132 1.00 0.00 C ATOM 1635 O GLU A 103 -11.585 8.139 -5.939 1.00 0.00 O ATOM 1636 CB GLU A 103 -10.619 5.940 -8.053 1.00 0.00 C ATOM 1637 CG GLU A 103 -10.319 5.449 -9.471 1.00 0.00 C ATOM 1638 CD GLU A 103 -11.599 5.486 -10.308 1.00 0.00 C ATOM 1639 OE1 GLU A 103 -11.935 6.553 -10.793 1.00 0.00 O ATOM 1640 OE2 GLU A 103 -12.221 4.446 -10.450 1.00 0.00 O ATOM 0 H GLU A 103 -9.197 7.675 -6.475 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.808 7.882 -9.030 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -9.865 5.566 -7.360 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.581 5.551 -7.718 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.554 6.076 -9.930 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.922 4.434 -9.439 1.00 0.00 H new ATOM 1647 N VAL A 104 -12.905 8.270 -7.687 1.00 0.00 N ATOM 1648 CA VAL A 104 -14.027 8.781 -6.848 1.00 0.00 C ATOM 1649 C VAL A 104 -14.771 7.620 -6.192 1.00 0.00 C ATOM 1650 O VAL A 104 -14.861 6.538 -6.736 1.00 0.00 O ATOM 1651 CB VAL A 104 -14.952 9.519 -7.813 1.00 0.00 C ATOM 1652 CG1 VAL A 104 -14.133 10.472 -8.680 1.00 0.00 C ATOM 1653 CG2 VAL A 104 -15.665 8.503 -8.707 1.00 0.00 C ATOM 0 H VAL A 104 -13.114 8.168 -8.680 1.00 0.00 H new ATOM 0 HA VAL A 104 -13.671 9.429 -6.048 1.00 0.00 H new ATOM 0 HB VAL A 104 -15.688 10.089 -7.246 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -14.795 10.998 -9.368 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -13.623 11.195 -8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -13.396 9.905 -9.248 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.326 9.027 -9.397 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -14.927 7.935 -9.273 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -16.251 7.823 -8.089 1.00 0.00 H new ATOM 1663 N LEU A 105 -15.312 7.842 -5.031 1.00 0.00 N ATOM 1664 CA LEU A 105 -16.061 6.757 -4.336 1.00 0.00 C ATOM 1665 C LEU A 105 -17.563 7.007 -4.481 1.00 0.00 C ATOM 1666 O LEU A 105 -18.374 6.157 -4.174 1.00 0.00 O ATOM 1667 CB LEU A 105 -15.646 6.834 -2.856 1.00 0.00 C ATOM 1668 CG LEU A 105 -14.255 7.470 -2.708 1.00 0.00 C ATOM 1669 CD1 LEU A 105 -13.781 7.336 -1.260 1.00 0.00 C ATOM 1670 CD2 LEU A 105 -13.258 6.770 -3.636 1.00 0.00 C ATOM 0 H LEU A 105 -15.269 8.729 -4.530 1.00 0.00 H new ATOM 0 HA LEU A 105 -15.842 5.774 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -16.378 7.418 -2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -15.641 5.834 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.316 8.525 -2.977 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -12.794 7.788 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -14.483 7.844 -0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -13.727 6.281 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.275 7.227 -3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -13.199 5.713 -3.375 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -13.590 6.871 -4.669 1.00 0.00 H new ATOM 1682 N ASP A 106 -17.933 8.172 -4.954 1.00 0.00 N ATOM 1683 CA ASP A 106 -19.382 8.504 -5.131 1.00 0.00 C ATOM 1684 C ASP A 106 -19.550 10.016 -5.297 1.00 0.00 C ATOM 1685 O ASP A 106 -18.618 10.777 -5.124 1.00 0.00 O ATOM 1686 CB ASP A 106 -20.085 8.038 -3.850 1.00 0.00 C ATOM 1687 CG ASP A 106 -19.216 8.366 -2.634 1.00 0.00 C ATOM 1688 OD1 ASP A 106 -19.084 9.538 -2.324 1.00 0.00 O ATOM 1689 OD2 ASP A 106 -18.700 7.438 -2.031 1.00 0.00 O ATOM 0 H ASP A 106 -17.288 8.913 -5.227 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.800 8.021 -6.014 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -21.055 8.527 -3.758 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -20.272 6.965 -3.896 1.00 0.00 H new ATOM 1694 N LEU A 107 -20.733 10.460 -5.620 1.00 0.00 N ATOM 1695 CA LEU A 107 -20.962 11.924 -5.785 1.00 0.00 C ATOM 1696 C LEU A 107 -21.963 12.413 -4.735 1.00 0.00 C ATOM 1697 O LEU A 107 -23.068 11.914 -4.642 1.00 0.00 O ATOM 1698 CB LEU A 107 -21.540 12.079 -7.191 1.00 0.00 C ATOM 1699 CG LEU A 107 -20.397 12.166 -8.205 1.00 0.00 C ATOM 1700 CD1 LEU A 107 -20.196 10.804 -8.870 1.00 0.00 C ATOM 1701 CD2 LEU A 107 -20.746 13.205 -9.272 1.00 0.00 C ATOM 0 H LEU A 107 -21.552 9.872 -5.777 1.00 0.00 H new ATOM 0 HA LEU A 107 -20.050 12.507 -5.657 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -22.185 11.233 -7.426 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -22.158 12.975 -7.245 1.00 0.00 H new ATOM 0 HG LEU A 107 -19.480 12.458 -7.694 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -19.382 10.868 -9.592 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -19.951 10.061 -8.111 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -21.112 10.510 -9.382 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -19.934 13.270 -9.996 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -21.663 12.910 -9.781 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -20.890 14.177 -8.800 1.00 0.00 H new ATOM 1713 N VAL A 108 -21.591 13.377 -3.938 1.00 0.00 N ATOM 1714 CA VAL A 108 -22.533 13.875 -2.894 1.00 0.00 C ATOM 1715 C VAL A 108 -22.896 15.340 -3.148 1.00 0.00 C ATOM 1716 O VAL A 108 -22.156 16.075 -3.771 1.00 0.00 O ATOM 1717 CB VAL A 108 -21.775 13.732 -1.575 1.00 0.00 C ATOM 1718 CG1 VAL A 108 -20.561 14.666 -1.576 1.00 0.00 C ATOM 1719 CG2 VAL A 108 -22.703 14.103 -0.416 1.00 0.00 C ATOM 0 H VAL A 108 -20.682 13.839 -3.963 1.00 0.00 H new ATOM 0 HA VAL A 108 -23.470 13.318 -2.891 1.00 0.00 H new ATOM 0 HB VAL A 108 -21.438 12.702 -1.459 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -20.022 14.563 -0.634 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -19.901 14.404 -2.403 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -20.895 15.697 -1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -22.166 14.002 0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -23.039 15.133 -0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -23.567 13.438 -0.414 1.00 0.00 H new ATOM 1729 N ASP A 109 -24.029 15.769 -2.662 1.00 0.00 N ATOM 1730 CA ASP A 109 -24.441 17.188 -2.864 1.00 0.00 C ATOM 1731 C ASP A 109 -24.375 17.936 -1.530 1.00 0.00 C ATOM 1732 O ASP A 109 -25.024 17.570 -0.570 1.00 0.00 O ATOM 1733 CB ASP A 109 -25.880 17.120 -3.376 1.00 0.00 C ATOM 1734 CG ASP A 109 -26.478 18.528 -3.410 1.00 0.00 C ATOM 1735 OD1 ASP A 109 -25.742 19.470 -3.168 1.00 0.00 O ATOM 1736 OD2 ASP A 109 -27.663 18.640 -3.678 1.00 0.00 O ATOM 0 H ASP A 109 -24.688 15.198 -2.133 1.00 0.00 H new ATOM 0 HA ASP A 109 -23.793 17.716 -3.564 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -25.902 16.680 -4.373 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -26.477 16.476 -2.730 1.00 0.00 H new ATOM 1741 N ALA A 110 -23.588 18.974 -1.460 1.00 0.00 N ATOM 1742 CA ALA A 110 -23.473 19.737 -0.182 1.00 0.00 C ATOM 1743 C ALA A 110 -24.835 20.284 0.253 1.00 0.00 C ATOM 1744 O ALA A 110 -25.548 20.894 -0.520 1.00 0.00 O ATOM 1745 CB ALA A 110 -22.514 20.885 -0.491 1.00 0.00 C ATOM 0 H ALA A 110 -23.020 19.327 -2.230 1.00 0.00 H new ATOM 0 HA ALA A 110 -23.116 19.108 0.633 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -22.377 21.495 0.402 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -21.552 20.481 -0.806 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -22.928 21.500 -1.290 1.00 0.00 H new