USER MOD reduce.3.24.130724 H: found=0, std=0, add=536, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 538 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 Single : A 7 THR OG1 : rot 7:sc= 0.771 USER MOD Single : A 9 CYS SG : rot 26:sc= 0.242 USER MOD Single : A 13 GLN : amide:sc=-0.00215 X(o=-0.0022,f=0) USER MOD Single : A 14 ASN : amide:sc= -0.602 K(o=-0.6,f=-1.2) USER MOD Single : A 32 ASN : amide:sc= -0.0899 X(o=-0.09,f=-0.018) USER MOD Single : A 33 SER OG : rot -81:sc= 0.0372 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0.00207 USER MOD Single : A 41 GLN : amide:sc= -15.8! C(o=-16!,f=-12!) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.289 K(o=-0.29,f=-2.4!) USER MOD Single : A 91 THR OG1 : rot 59:sc= 0.145 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0.0046) USER MOD Single : A 98 LYS NZ :NH3+ -161:sc= -1.08 (180deg=-1.5) USER MOD Single : A 100 GLN : amide:sc= -1.21 K(o=-1.2,f=-1.7) USER MOD Single : A 102 THR OG1 : rot -77:sc= 0.304 USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.601 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -1.88 X(o=-1.9,f=-1.5) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.132 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N THR A 7 17.157 1.768 12.898 1.00 0.00 N ATOM 91 CA THR A 7 16.733 2.067 11.535 1.00 0.00 C ATOM 92 C THR A 7 16.685 0.795 10.694 1.00 0.00 C ATOM 93 O THR A 7 17.562 -0.062 10.806 1.00 0.00 O ATOM 94 CB THR A 7 17.681 3.084 10.899 1.00 0.00 C ATOM 95 OG1 THR A 7 18.761 3.384 11.767 1.00 0.00 O ATOM 96 CG2 THR A 7 16.996 4.385 10.552 1.00 0.00 C ATOM 0 HA THR A 7 15.730 2.493 11.572 1.00 0.00 H new ATOM 0 HB THR A 7 18.039 2.616 9.982 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.725 2.796 12.550 1.00 0.00 H new ATOM 0 HG21 THR A 7 17.718 5.068 10.104 1.00 0.00 H new ATOM 0 HG22 THR A 7 16.189 4.194 9.844 1.00 0.00 H new ATOM 0 HG23 THR A 7 16.586 4.833 11.457 1.00 0.00 H new ATOM 104 N PHE A 8 15.658 0.670 9.855 1.00 0.00 N ATOM 105 CA PHE A 8 15.520 -0.514 9.011 1.00 0.00 C ATOM 106 C PHE A 8 14.929 -0.201 7.643 1.00 0.00 C ATOM 107 O PHE A 8 14.051 0.648 7.502 1.00 0.00 O ATOM 108 CB PHE A 8 14.651 -1.574 9.691 1.00 0.00 C ATOM 109 CG PHE A 8 13.363 -1.065 10.287 1.00 0.00 C ATOM 110 CD1 PHE A 8 12.835 0.175 9.938 1.00 0.00 C ATOM 111 CD2 PHE A 8 12.671 -1.845 11.200 1.00 0.00 C ATOM 112 CE1 PHE A 8 11.649 0.616 10.492 1.00 0.00 C ATOM 113 CE2 PHE A 8 11.486 -1.405 11.755 1.00 0.00 C ATOM 114 CZ PHE A 8 10.974 -0.174 11.401 1.00 0.00 C ATOM 0 H PHE A 8 14.919 1.364 9.742 1.00 0.00 H new ATOM 0 HA PHE A 8 16.531 -0.894 8.866 1.00 0.00 H new ATOM 0 HB2 PHE A 8 14.414 -2.348 8.961 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.235 -2.048 10.480 1.00 0.00 H new ATOM 0 HD1 PHE A 8 13.358 0.798 9.227 1.00 0.00 H new ATOM 0 HD2 PHE A 8 13.064 -2.811 11.481 1.00 0.00 H new ATOM 0 HE1 PHE A 8 11.249 1.580 10.214 1.00 0.00 H new ATOM 0 HE2 PHE A 8 10.960 -2.024 12.466 1.00 0.00 H new ATOM 0 HZ PHE A 8 10.047 0.171 11.834 1.00 0.00 H new ATOM 124 N CYS A 9 15.388 -0.936 6.643 1.00 0.00 N ATOM 125 CA CYS A 9 14.880 -0.782 5.293 1.00 0.00 C ATOM 126 C CYS A 9 13.765 -1.800 5.079 1.00 0.00 C ATOM 127 O CYS A 9 13.917 -2.970 5.433 1.00 0.00 O ATOM 128 CB CYS A 9 15.997 -0.994 4.270 1.00 0.00 C ATOM 129 SG CYS A 9 16.877 -2.563 4.452 1.00 0.00 S ATOM 0 H CYS A 9 16.113 -1.646 6.743 1.00 0.00 H new ATOM 0 HA CYS A 9 14.493 0.228 5.159 1.00 0.00 H new ATOM 0 HB2 CYS A 9 15.572 -0.942 3.268 1.00 0.00 H new ATOM 0 HB3 CYS A 9 16.713 -0.176 4.355 1.00 0.00 H new ATOM 0 HG CYS A 9 16.101 -3.432 5.029 1.00 0.00 H new ATOM 135 N VAL A 10 12.643 -1.364 4.523 1.00 0.00 N ATOM 136 CA VAL A 10 11.519 -2.270 4.305 1.00 0.00 C ATOM 137 C VAL A 10 11.307 -2.561 2.835 1.00 0.00 C ATOM 138 O VAL A 10 11.553 -1.725 1.975 1.00 0.00 O ATOM 139 CB VAL A 10 10.203 -1.721 4.908 1.00 0.00 C ATOM 140 CG1 VAL A 10 9.223 -1.282 3.823 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.559 -2.765 5.803 1.00 0.00 C ATOM 0 H VAL A 10 12.485 -0.404 4.218 1.00 0.00 H new ATOM 0 HA VAL A 10 11.780 -3.196 4.817 1.00 0.00 H new ATOM 0 HB VAL A 10 10.454 -0.843 5.503 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.312 -0.903 4.287 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.677 -0.496 3.219 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.979 -2.133 3.187 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.635 -2.366 6.221 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.338 -3.658 5.219 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.242 -3.021 6.613 1.00 0.00 H new ATOM 151 N VAL A 11 10.832 -3.758 2.563 1.00 0.00 N ATOM 152 CA VAL A 11 10.567 -4.179 1.206 1.00 0.00 C ATOM 153 C VAL A 11 9.252 -4.939 1.146 1.00 0.00 C ATOM 154 O VAL A 11 9.173 -6.110 1.517 1.00 0.00 O ATOM 155 CB VAL A 11 11.725 -5.031 0.670 1.00 0.00 C ATOM 156 CG1 VAL A 11 12.156 -6.055 1.703 1.00 0.00 C ATOM 157 CG2 VAL A 11 11.363 -5.696 -0.652 1.00 0.00 C ATOM 0 H VAL A 11 10.620 -4.461 3.271 1.00 0.00 H new ATOM 0 HA VAL A 11 10.483 -3.297 0.571 1.00 0.00 H new ATOM 0 HB VAL A 11 12.569 -4.368 0.476 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.978 -6.650 1.305 1.00 0.00 H new ATOM 0 HG12 VAL A 11 12.483 -5.543 2.608 1.00 0.00 H new ATOM 0 HG13 VAL A 11 11.317 -6.709 1.939 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.206 -6.291 -1.003 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.497 -6.342 -0.509 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.127 -4.931 -1.392 1.00 0.00 H new ATOM 167 N VAL A 12 8.220 -4.245 0.695 1.00 0.00 N ATOM 168 CA VAL A 12 6.889 -4.816 0.601 1.00 0.00 C ATOM 169 C VAL A 12 6.643 -5.416 -0.778 1.00 0.00 C ATOM 170 O VAL A 12 6.986 -4.822 -1.798 1.00 0.00 O ATOM 171 CB VAL A 12 5.823 -3.741 0.890 1.00 0.00 C ATOM 172 CG1 VAL A 12 4.429 -4.274 0.615 1.00 0.00 C ATOM 173 CG2 VAL A 12 5.944 -3.252 2.324 1.00 0.00 C ATOM 0 H VAL A 12 8.282 -3.275 0.386 1.00 0.00 H new ATOM 0 HA VAL A 12 6.816 -5.610 1.344 1.00 0.00 H new ATOM 0 HB VAL A 12 5.994 -2.897 0.222 1.00 0.00 H new ATOM 0 HG11 VAL A 12 3.694 -3.497 0.826 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.353 -4.571 -0.431 1.00 0.00 H new ATOM 0 HG13 VAL A 12 4.237 -5.138 1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 12 5.185 -2.493 2.515 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.800 -4.089 3.007 1.00 0.00 H new ATOM 0 HG23 VAL A 12 6.934 -2.823 2.480 1.00 0.00 H new ATOM 183 N GLN A 13 6.039 -6.598 -0.793 1.00 0.00 N ATOM 184 CA GLN A 13 5.735 -7.288 -2.039 1.00 0.00 C ATOM 185 C GLN A 13 4.232 -7.502 -2.180 1.00 0.00 C ATOM 186 O GLN A 13 3.630 -8.263 -1.422 1.00 0.00 O ATOM 187 CB GLN A 13 6.463 -8.633 -2.093 1.00 0.00 C ATOM 188 CG GLN A 13 6.981 -8.988 -3.477 1.00 0.00 C ATOM 189 CD GLN A 13 6.011 -9.850 -4.260 1.00 0.00 C ATOM 190 OE1 GLN A 13 5.931 -11.061 -4.052 1.00 0.00 O ATOM 191 NE2 GLN A 13 5.264 -9.228 -5.165 1.00 0.00 N ATOM 0 H GLN A 13 5.750 -7.099 0.047 1.00 0.00 H new ATOM 0 HA GLN A 13 6.078 -6.667 -2.867 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.300 -8.612 -1.395 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.786 -9.417 -1.755 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.177 -8.071 -4.033 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.932 -9.513 -3.381 1.00 0.00 H new ATOM 0 HE21 GLN A 13 5.363 -8.222 -5.304 1.00 0.00 H new ATOM 0 HE22 GLN A 13 4.591 -9.756 -5.721 1.00 0.00 H new ATOM 200 N ASN A 14 3.629 -6.822 -3.149 1.00 0.00 N ATOM 201 CA ASN A 14 2.192 -6.934 -3.381 1.00 0.00 C ATOM 202 C ASN A 14 1.893 -7.940 -4.483 1.00 0.00 C ATOM 203 O ASN A 14 2.606 -8.013 -5.484 1.00 0.00 O ATOM 204 CB ASN A 14 1.586 -5.576 -3.755 1.00 0.00 C ATOM 205 CG ASN A 14 2.437 -4.403 -3.309 1.00 0.00 C ATOM 206 OD1 ASN A 14 2.205 -3.818 -2.251 1.00 0.00 O ATOM 207 ND2 ASN A 14 3.427 -4.054 -4.121 1.00 0.00 N ATOM 0 H ASN A 14 4.111 -6.188 -3.786 1.00 0.00 H new ATOM 0 HA ASN A 14 1.741 -7.280 -2.451 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.452 -5.530 -4.836 1.00 0.00 H new ATOM 0 HB3 ASN A 14 0.596 -5.491 -3.307 1.00 0.00 H new ATOM 0 HD21 ASN A 14 4.034 -3.271 -3.878 1.00 0.00 H new ATOM 0 HD22 ASN A 14 3.581 -4.569 -4.988 1.00 0.00 H new ATOM 482 N ASP A 31 7.897 -5.089 -5.879 1.00 0.00 N ATOM 483 CA ASP A 31 8.564 -4.947 -4.591 1.00 0.00 C ATOM 484 C ASP A 31 9.394 -3.671 -4.544 1.00 0.00 C ATOM 485 O ASP A 31 10.209 -3.414 -5.432 1.00 0.00 O ATOM 486 CB ASP A 31 9.456 -6.159 -4.310 1.00 0.00 C ATOM 487 CG ASP A 31 10.246 -6.595 -5.529 1.00 0.00 C ATOM 488 OD1 ASP A 31 10.990 -5.760 -6.084 1.00 0.00 O ATOM 489 OD2 ASP A 31 10.122 -7.773 -5.928 1.00 0.00 O ATOM 0 HA ASP A 31 7.794 -4.888 -3.822 1.00 0.00 H new ATOM 0 HB2 ASP A 31 10.146 -5.918 -3.501 1.00 0.00 H new ATOM 0 HB3 ASP A 31 8.838 -6.988 -3.966 1.00 0.00 H new ATOM 494 N ASN A 32 9.183 -2.872 -3.503 1.00 0.00 N ATOM 495 CA ASN A 32 9.914 -1.617 -3.344 1.00 0.00 C ATOM 496 C ASN A 32 10.620 -1.566 -1.993 1.00 0.00 C ATOM 497 O ASN A 32 10.023 -1.872 -0.961 1.00 0.00 O ATOM 498 CB ASN A 32 8.963 -0.427 -3.480 1.00 0.00 C ATOM 499 CG ASN A 32 7.791 -0.512 -2.522 1.00 0.00 C ATOM 500 OD1 ASN A 32 6.756 -1.100 -2.839 1.00 0.00 O ATOM 501 ND2 ASN A 32 7.946 0.078 -1.342 1.00 0.00 N ATOM 0 H ASN A 32 8.514 -3.069 -2.758 1.00 0.00 H new ATOM 0 HA ASN A 32 10.667 -1.563 -4.130 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.512 0.496 -3.297 1.00 0.00 H new ATOM 0 HB3 ASN A 32 8.590 -0.378 -4.503 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.191 0.055 -0.657 1.00 0.00 H new ATOM 0 HD22 ASN A 32 8.821 0.554 -1.121 1.00 0.00 H new ATOM 508 N SER A 33 11.892 -1.173 -2.005 1.00 0.00 N ATOM 509 CA SER A 33 12.671 -1.081 -0.776 1.00 0.00 C ATOM 510 C SER A 33 12.494 0.278 -0.117 1.00 0.00 C ATOM 511 O SER A 33 12.341 1.298 -0.788 1.00 0.00 O ATOM 512 CB SER A 33 14.155 -1.320 -1.039 1.00 0.00 C ATOM 513 OG SER A 33 14.522 -0.896 -2.340 1.00 0.00 O ATOM 0 H SER A 33 12.402 -0.914 -2.850 1.00 0.00 H new ATOM 0 HA SER A 33 12.301 -1.857 -0.106 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.749 -0.784 -0.299 1.00 0.00 H new ATOM 0 HB3 SER A 33 14.381 -2.380 -0.922 1.00 0.00 H new ATOM 0 HG SER A 33 14.281 -1.589 -2.990 1.00 0.00 H new ATOM 519 N LEU A 34 12.512 0.271 1.202 1.00 0.00 N ATOM 520 CA LEU A 34 12.353 1.484 1.986 1.00 0.00 C ATOM 521 C LEU A 34 13.650 1.804 2.733 1.00 0.00 C ATOM 522 O LEU A 34 14.344 0.901 3.195 1.00 0.00 O ATOM 523 CB LEU A 34 11.173 1.299 2.958 1.00 0.00 C ATOM 524 CG LEU A 34 10.984 2.357 4.032 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.810 1.974 5.241 1.00 0.00 C ATOM 526 CD2 LEU A 34 11.335 3.753 3.534 1.00 0.00 C ATOM 0 H LEU A 34 12.637 -0.573 1.761 1.00 0.00 H new ATOM 0 HA LEU A 34 12.137 2.328 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.256 1.247 2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 34 11.290 0.334 3.451 1.00 0.00 H new ATOM 0 HG LEU A 34 9.930 2.395 4.307 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.684 2.725 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.480 1.005 5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.861 1.916 4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.184 4.474 4.337 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.378 3.775 3.218 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.695 4.010 2.690 1.00 0.00 H new ATOM 538 N ALA A 35 13.971 3.089 2.843 1.00 0.00 N ATOM 539 CA ALA A 35 15.174 3.534 3.526 1.00 0.00 C ATOM 540 C ALA A 35 15.043 3.319 5.022 1.00 0.00 C ATOM 541 O ALA A 35 13.946 3.222 5.552 1.00 0.00 O ATOM 542 CB ALA A 35 15.444 4.995 3.226 1.00 0.00 C ATOM 0 H ALA A 35 13.405 3.847 2.462 1.00 0.00 H new ATOM 0 HA ALA A 35 16.015 2.944 3.162 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.348 5.312 3.745 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.577 5.127 2.152 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.601 5.598 3.564 1.00 0.00 H new ATOM 548 N ALA A 36 16.166 3.221 5.699 1.00 0.00 N ATOM 549 CA ALA A 36 16.154 2.970 7.132 1.00 0.00 C ATOM 550 C ALA A 36 15.647 4.178 7.907 1.00 0.00 C ATOM 551 O ALA A 36 16.258 5.247 7.901 1.00 0.00 O ATOM 552 CB ALA A 36 17.546 2.581 7.606 1.00 0.00 C ATOM 0 H ALA A 36 17.095 3.310 5.288 1.00 0.00 H new ATOM 0 HA ALA A 36 15.468 2.145 7.323 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.526 2.395 8.680 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.868 1.678 7.088 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.243 3.391 7.391 1.00 0.00 H new ATOM 558 N VAL A 37 14.503 3.983 8.568 1.00 0.00 N ATOM 559 CA VAL A 37 13.869 5.033 9.357 1.00 0.00 C ATOM 560 C VAL A 37 13.523 4.530 10.760 1.00 0.00 C ATOM 561 O VAL A 37 13.888 3.419 11.139 1.00 0.00 O ATOM 562 CB VAL A 37 12.586 5.572 8.666 1.00 0.00 C ATOM 563 CG1 VAL A 37 12.693 5.460 7.152 1.00 0.00 C ATOM 564 CG2 VAL A 37 11.342 4.843 9.157 1.00 0.00 C ATOM 0 H VAL A 37 13.996 3.098 8.569 1.00 0.00 H new ATOM 0 HA VAL A 37 14.587 5.849 9.437 1.00 0.00 H new ATOM 0 HB VAL A 37 12.493 6.625 8.933 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.782 5.844 6.693 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.547 6.041 6.804 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.827 4.415 6.873 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.463 5.245 8.654 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.433 3.779 8.936 1.00 0.00 H new ATOM 0 HG23 VAL A 37 11.239 4.983 10.233 1.00 0.00 H new ATOM 574 N SER A 38 12.816 5.357 11.522 1.00 0.00 N ATOM 575 CA SER A 38 12.422 4.999 12.880 1.00 0.00 C ATOM 576 C SER A 38 11.449 3.821 12.890 1.00 0.00 C ATOM 577 O SER A 38 11.723 2.786 13.496 1.00 0.00 O ATOM 578 CB SER A 38 11.787 6.202 13.580 1.00 0.00 C ATOM 579 OG SER A 38 11.947 6.118 14.985 1.00 0.00 O ATOM 0 H SER A 38 12.504 6.281 11.222 1.00 0.00 H new ATOM 0 HA SER A 38 13.322 4.699 13.417 1.00 0.00 H new ATOM 0 HB2 SER A 38 12.242 7.122 13.213 1.00 0.00 H new ATOM 0 HB3 SER A 38 10.726 6.251 13.334 1.00 0.00 H new ATOM 0 HG SER A 38 11.534 6.899 15.409 1.00 0.00 H new ATOM 585 N GLU A 39 10.307 3.988 12.228 1.00 0.00 N ATOM 586 CA GLU A 39 9.294 2.932 12.179 1.00 0.00 C ATOM 587 C GLU A 39 8.167 3.254 11.193 1.00 0.00 C ATOM 588 O GLU A 39 7.396 2.370 10.818 1.00 0.00 O ATOM 589 CB GLU A 39 8.708 2.705 13.574 1.00 0.00 C ATOM 590 CG GLU A 39 8.169 1.299 13.785 1.00 0.00 C ATOM 591 CD GLU A 39 6.984 1.267 14.731 1.00 0.00 C ATOM 592 OE1 GLU A 39 7.184 1.505 15.941 1.00 0.00 O ATOM 593 OE2 GLU A 39 5.857 1.002 14.262 1.00 0.00 O ATOM 0 H GLU A 39 10.059 4.837 11.721 1.00 0.00 H new ATOM 0 HA GLU A 39 9.788 2.025 11.830 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.477 2.906 14.320 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.905 3.422 13.743 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.874 0.879 12.824 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.962 0.665 14.180 1.00 0.00 H new ATOM 600 N SER A 40 8.061 4.520 10.792 1.00 0.00 N ATOM 601 CA SER A 40 7.016 4.959 9.868 1.00 0.00 C ATOM 602 C SER A 40 6.797 3.973 8.718 1.00 0.00 C ATOM 603 O SER A 40 5.661 3.724 8.323 1.00 0.00 O ATOM 604 CB SER A 40 7.362 6.337 9.303 1.00 0.00 C ATOM 605 OG SER A 40 7.670 7.252 10.342 1.00 0.00 O ATOM 0 H SER A 40 8.690 5.264 11.095 1.00 0.00 H new ATOM 0 HA SER A 40 6.088 5.009 10.437 1.00 0.00 H new ATOM 0 HB2 SER A 40 8.211 6.253 8.625 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.523 6.715 8.718 1.00 0.00 H new ATOM 0 HG SER A 40 7.889 8.125 9.955 1.00 0.00 H new ATOM 611 N GLN A 41 7.879 3.424 8.172 1.00 0.00 N ATOM 612 CA GLN A 41 7.768 2.483 7.056 1.00 0.00 C ATOM 613 C GLN A 41 6.898 1.288 7.407 1.00 0.00 C ATOM 614 O GLN A 41 6.082 0.844 6.599 1.00 0.00 O ATOM 615 CB GLN A 41 9.144 1.995 6.602 1.00 0.00 C ATOM 616 CG GLN A 41 10.115 1.672 7.729 1.00 0.00 C ATOM 617 CD GLN A 41 10.551 0.214 7.757 1.00 0.00 C ATOM 618 OE1 GLN A 41 11.678 -0.112 7.383 1.00 0.00 O ATOM 619 NE2 GLN A 41 9.675 -0.671 8.210 1.00 0.00 N ATOM 0 H GLN A 41 8.834 3.610 8.478 1.00 0.00 H new ATOM 0 HA GLN A 41 7.295 3.027 6.238 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.013 1.103 5.989 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.591 2.757 5.964 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.997 2.305 7.630 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.649 1.922 8.682 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.750 -0.365 8.511 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.926 -1.659 8.257 1.00 0.00 H new ATOM 628 N LEU A 42 7.088 0.760 8.603 1.00 0.00 N ATOM 629 CA LEU A 42 6.328 -0.401 9.043 1.00 0.00 C ATOM 630 C LEU A 42 4.848 -0.077 9.159 1.00 0.00 C ATOM 631 O LEU A 42 4.006 -0.743 8.558 1.00 0.00 O ATOM 632 CB LEU A 42 6.860 -0.908 10.385 1.00 0.00 C ATOM 633 CG LEU A 42 6.135 -2.133 10.946 1.00 0.00 C ATOM 634 CD1 LEU A 42 6.567 -3.394 10.211 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.395 -2.264 12.439 1.00 0.00 C ATOM 0 H LEU A 42 7.758 1.113 9.286 1.00 0.00 H new ATOM 0 HA LEU A 42 6.448 -1.183 8.293 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.917 -1.150 10.272 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.794 -0.100 11.114 1.00 0.00 H new ATOM 0 HG LEU A 42 5.064 -2.002 10.794 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.041 -4.254 10.624 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.329 -3.297 9.152 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.641 -3.535 10.330 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.873 -3.140 12.824 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.465 -2.374 12.614 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.034 -1.372 12.951 1.00 0.00 H new ATOM 647 N ALA A 43 4.536 0.948 9.936 1.00 0.00 N ATOM 648 CA ALA A 43 3.156 1.356 10.134 1.00 0.00 C ATOM 649 C ALA A 43 2.577 1.999 8.879 1.00 0.00 C ATOM 650 O ALA A 43 1.362 2.019 8.691 1.00 0.00 O ATOM 651 CB ALA A 43 3.059 2.307 11.311 1.00 0.00 C ATOM 0 H ALA A 43 5.220 1.512 10.440 1.00 0.00 H new ATOM 0 HA ALA A 43 2.568 0.463 10.347 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.021 2.607 11.452 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.418 1.809 12.212 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.669 3.189 11.117 1.00 0.00 H new ATOM 657 N GLN A 44 3.446 2.523 8.017 1.00 0.00 N ATOM 658 CA GLN A 44 2.994 3.157 6.784 1.00 0.00 C ATOM 659 C GLN A 44 2.223 2.159 5.929 1.00 0.00 C ATOM 660 O GLN A 44 1.091 2.419 5.521 1.00 0.00 O ATOM 661 CB GLN A 44 4.185 3.717 5.999 1.00 0.00 C ATOM 662 CG GLN A 44 3.816 4.246 4.622 1.00 0.00 C ATOM 663 CD GLN A 44 4.235 5.690 4.418 1.00 0.00 C ATOM 664 OE1 GLN A 44 5.276 5.967 3.822 1.00 0.00 O ATOM 665 NE2 GLN A 44 3.425 6.617 4.915 1.00 0.00 N ATOM 0 H GLN A 44 4.457 2.521 8.149 1.00 0.00 H new ATOM 0 HA GLN A 44 2.332 3.983 7.044 1.00 0.00 H new ATOM 0 HB2 GLN A 44 4.644 4.520 6.576 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.936 2.935 5.889 1.00 0.00 H new ATOM 0 HG2 GLN A 44 4.287 3.624 3.860 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.738 4.161 4.481 1.00 0.00 H new ATOM 0 HE21 GLN A 44 2.572 6.341 5.402 1.00 0.00 H new ATOM 0 HE22 GLN A 44 3.655 7.605 4.810 1.00 0.00 H new ATOM 674 N LEU A 45 2.844 1.016 5.667 1.00 0.00 N ATOM 675 CA LEU A 45 2.218 -0.026 4.866 1.00 0.00 C ATOM 676 C LEU A 45 1.216 -0.821 5.694 1.00 0.00 C ATOM 677 O LEU A 45 0.037 -0.907 5.352 1.00 0.00 O ATOM 678 CB LEU A 45 3.283 -0.956 4.290 1.00 0.00 C ATOM 679 CG LEU A 45 4.117 -0.349 3.159 1.00 0.00 C ATOM 680 CD1 LEU A 45 5.596 -0.349 3.513 1.00 0.00 C ATOM 681 CD2 LEU A 45 3.867 -1.085 1.852 1.00 0.00 C ATOM 0 H LEU A 45 3.781 0.788 5.998 1.00 0.00 H new ATOM 0 HA LEU A 45 1.680 0.449 4.046 1.00 0.00 H new ATOM 0 HB2 LEU A 45 3.953 -1.261 5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.797 -1.859 3.920 1.00 0.00 H new ATOM 0 HG LEU A 45 3.807 0.688 3.027 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.166 0.087 2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.754 0.238 4.418 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.930 -1.373 3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 45 4.469 -0.638 1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.140 -2.134 1.967 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.812 -1.012 1.589 1.00 0.00 H new ATOM 692 N LYS A 46 1.699 -1.401 6.786 1.00 0.00 N ATOM 693 CA LYS A 46 0.858 -2.197 7.677 1.00 0.00 C ATOM 694 C LYS A 46 -0.398 -1.434 8.096 1.00 0.00 C ATOM 695 O LYS A 46 -1.402 -2.040 8.473 1.00 0.00 O ATOM 696 CB LYS A 46 1.647 -2.617 8.919 1.00 0.00 C ATOM 697 CG LYS A 46 1.427 -4.067 9.316 1.00 0.00 C ATOM 698 CD LYS A 46 1.480 -4.245 10.825 1.00 0.00 C ATOM 699 CE LYS A 46 0.985 -5.622 11.241 1.00 0.00 C ATOM 700 NZ LYS A 46 1.993 -6.352 12.059 1.00 0.00 N ATOM 0 H LYS A 46 2.674 -1.335 7.078 1.00 0.00 H new ATOM 0 HA LYS A 46 0.547 -3.085 7.127 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.709 -2.456 8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.366 -1.974 9.753 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.461 -4.405 8.942 1.00 0.00 H new ATOM 0 HG3 LYS A 46 2.187 -4.693 8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.503 -4.104 11.173 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.872 -3.478 11.305 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.061 -5.519 11.811 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.747 -6.206 10.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 1.617 -7.285 12.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.866 -6.474 11.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 2.201 -5.808 12.920 1.00 0.00 H new ATOM 714 N ALA A 47 -0.338 -0.103 8.033 1.00 0.00 N ATOM 715 CA ALA A 47 -1.472 0.740 8.412 1.00 0.00 C ATOM 716 C ALA A 47 -2.787 0.190 7.862 1.00 0.00 C ATOM 717 O ALA A 47 -3.842 0.350 8.475 1.00 0.00 O ATOM 718 CB ALA A 47 -1.253 2.165 7.927 1.00 0.00 C ATOM 0 H ALA A 47 0.485 0.414 7.723 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.540 0.739 9.500 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.104 2.782 8.215 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.345 2.567 8.376 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.153 2.169 6.842 1.00 0.00 H new ATOM 724 N ASP A 48 -2.712 -0.460 6.705 1.00 0.00 N ATOM 725 CA ASP A 48 -3.894 -1.038 6.076 1.00 0.00 C ATOM 726 C ASP A 48 -3.675 -2.520 5.775 1.00 0.00 C ATOM 727 O ASP A 48 -2.680 -2.891 5.152 1.00 0.00 O ATOM 728 CB ASP A 48 -4.230 -0.286 4.787 1.00 0.00 C ATOM 729 CG ASP A 48 -5.691 0.113 4.713 1.00 0.00 C ATOM 730 OD1 ASP A 48 -6.555 -0.786 4.769 1.00 0.00 O ATOM 731 OD2 ASP A 48 -5.971 1.325 4.601 1.00 0.00 O ATOM 0 H ASP A 48 -1.846 -0.600 6.184 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.730 -0.945 6.769 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -3.609 0.607 4.718 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.984 -0.912 3.930 1.00 0.00 H new ATOM 736 N PRO A 49 -4.602 -3.390 6.214 1.00 0.00 N ATOM 737 CA PRO A 49 -4.496 -4.832 5.985 1.00 0.00 C ATOM 738 C PRO A 49 -4.797 -5.210 4.538 1.00 0.00 C ATOM 739 O PRO A 49 -5.884 -5.695 4.226 1.00 0.00 O ATOM 740 CB PRO A 49 -5.554 -5.413 6.922 1.00 0.00 C ATOM 741 CG PRO A 49 -6.578 -4.340 7.039 1.00 0.00 C ATOM 742 CD PRO A 49 -5.824 -3.039 6.966 1.00 0.00 C ATOM 0 HA PRO A 49 -3.489 -5.206 6.172 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -5.984 -6.329 6.516 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.129 -5.664 7.894 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.312 -4.411 6.236 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.124 -4.422 7.979 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.402 -2.268 6.456 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.588 -2.656 7.959 1.00 0.00 H new ATOM 750 N ARG A 50 -3.828 -4.980 3.658 1.00 0.00 N ATOM 751 CA ARG A 50 -3.993 -5.294 2.245 1.00 0.00 C ATOM 752 C ARG A 50 -2.672 -5.735 1.620 1.00 0.00 C ATOM 753 O ARG A 50 -2.622 -6.725 0.890 1.00 0.00 O ATOM 754 CB ARG A 50 -4.553 -4.081 1.498 1.00 0.00 C ATOM 755 CG ARG A 50 -5.624 -4.438 0.479 1.00 0.00 C ATOM 756 CD ARG A 50 -6.970 -3.835 0.849 1.00 0.00 C ATOM 757 NE ARG A 50 -8.059 -4.397 0.053 1.00 0.00 N ATOM 758 CZ ARG A 50 -9.343 -4.326 0.400 1.00 0.00 C ATOM 759 NH1 ARG A 50 -9.702 -3.719 1.525 1.00 0.00 N ATOM 760 NH2 ARG A 50 -10.270 -4.864 -0.381 1.00 0.00 N ATOM 0 H ARG A 50 -2.922 -4.578 3.899 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.698 -6.121 2.162 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.970 -3.380 2.221 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.736 -3.568 0.990 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.323 -4.082 -0.506 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -5.716 -5.522 0.411 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -7.167 -4.009 1.907 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.935 -2.755 0.705 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.822 -4.871 -0.819 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.993 -3.304 2.129 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -10.687 -3.668 1.785 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -9.999 -5.331 -1.246 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -11.254 -4.810 -0.116 1.00 0.00 H new ATOM 774 N LEU A 51 -1.602 -5.001 1.914 1.00 0.00 N ATOM 775 CA LEU A 51 -0.284 -5.329 1.381 1.00 0.00 C ATOM 776 C LEU A 51 0.639 -5.829 2.487 1.00 0.00 C ATOM 777 O LEU A 51 0.838 -5.156 3.499 1.00 0.00 O ATOM 778 CB LEU A 51 0.346 -4.111 0.694 1.00 0.00 C ATOM 779 CG LEU A 51 -0.605 -3.249 -0.148 1.00 0.00 C ATOM 780 CD1 LEU A 51 -1.600 -4.113 -0.913 1.00 0.00 C ATOM 781 CD2 LEU A 51 -1.329 -2.241 0.733 1.00 0.00 C ATOM 0 H LEU A 51 -1.622 -4.178 2.516 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.413 -6.122 0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.796 -3.479 1.460 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.155 -4.459 0.051 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.009 -2.703 -0.880 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.260 -3.475 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.060 -4.787 -1.579 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.192 -4.697 -0.208 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.999 -1.638 0.121 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.907 -2.769 1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.600 -1.593 1.219 1.00 0.00 H new ATOM 793 N VAL A 52 1.197 -7.018 2.288 1.00 0.00 N ATOM 794 CA VAL A 52 2.099 -7.620 3.267 1.00 0.00 C ATOM 795 C VAL A 52 3.377 -6.804 3.430 1.00 0.00 C ATOM 796 O VAL A 52 4.258 -6.832 2.571 1.00 0.00 O ATOM 797 CB VAL A 52 2.489 -9.050 2.861 1.00 0.00 C ATOM 798 CG1 VAL A 52 3.159 -9.783 4.014 1.00 0.00 C ATOM 799 CG2 VAL A 52 1.278 -9.820 2.358 1.00 0.00 C ATOM 0 H VAL A 52 1.041 -7.587 1.456 1.00 0.00 H new ATOM 0 HA VAL A 52 1.557 -7.639 4.212 1.00 0.00 H new ATOM 0 HB VAL A 52 3.209 -8.982 2.045 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.424 -10.792 3.699 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.060 -9.247 4.311 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.473 -9.836 4.859 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.579 -10.829 2.077 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.527 -9.872 3.146 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.858 -9.312 1.490 1.00 0.00 H new ATOM 809 N VAL A 53 3.478 -6.099 4.547 1.00 0.00 N ATOM 810 CA VAL A 53 4.655 -5.288 4.844 1.00 0.00 C ATOM 811 C VAL A 53 5.585 -6.039 5.789 1.00 0.00 C ATOM 812 O VAL A 53 5.176 -6.471 6.867 1.00 0.00 O ATOM 813 CB VAL A 53 4.263 -3.931 5.468 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.312 -4.128 6.639 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.493 -3.142 5.899 1.00 0.00 C ATOM 0 H VAL A 53 2.757 -6.071 5.267 1.00 0.00 H new ATOM 0 HA VAL A 53 5.170 -5.094 3.903 1.00 0.00 H new ATOM 0 HB VAL A 53 3.748 -3.352 4.702 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.050 -3.158 7.062 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.408 -4.629 6.293 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.796 -4.738 7.402 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.182 -2.192 6.334 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.052 -3.715 6.639 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.127 -2.954 5.032 1.00 0.00 H new ATOM 825 N GLN A 54 6.832 -6.208 5.369 1.00 0.00 N ATOM 826 CA GLN A 54 7.815 -6.932 6.175 1.00 0.00 C ATOM 827 C GLN A 54 9.089 -6.120 6.392 1.00 0.00 C ATOM 828 O GLN A 54 9.568 -5.437 5.486 1.00 0.00 O ATOM 829 CB GLN A 54 8.160 -8.265 5.511 1.00 0.00 C ATOM 830 CG GLN A 54 8.498 -8.140 4.035 1.00 0.00 C ATOM 831 CD GLN A 54 8.792 -9.479 3.387 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.565 -10.280 3.914 1.00 0.00 O ATOM 833 NE2 GLN A 54 8.175 -9.729 2.239 1.00 0.00 N ATOM 0 H GLN A 54 7.189 -5.857 4.480 1.00 0.00 H new ATOM 0 HA GLN A 54 7.365 -7.111 7.151 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.006 -8.713 6.032 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.318 -8.947 5.626 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.667 -7.664 3.515 1.00 0.00 H new ATOM 0 HG3 GLN A 54 9.363 -7.487 3.918 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.543 -9.036 1.839 1.00 0.00 H new ATOM 0 HE22 GLN A 54 8.333 -10.614 1.757 1.00 0.00 H new ATOM 842 N ILE A 55 9.639 -6.215 7.603 1.00 0.00 N ATOM 843 CA ILE A 55 10.864 -5.505 7.957 1.00 0.00 C ATOM 844 C ILE A 55 12.072 -6.435 7.900 1.00 0.00 C ATOM 845 O ILE A 55 12.193 -7.359 8.703 1.00 0.00 O ATOM 846 CB ILE A 55 10.774 -4.898 9.370 1.00 0.00 C ATOM 847 CG1 ILE A 55 10.396 -5.976 10.387 1.00 0.00 C ATOM 848 CG2 ILE A 55 9.768 -3.755 9.398 1.00 0.00 C ATOM 849 CD1 ILE A 55 11.396 -6.119 11.513 1.00 0.00 C ATOM 0 H ILE A 55 9.251 -6.781 8.358 1.00 0.00 H new ATOM 0 HA ILE A 55 10.985 -4.703 7.229 1.00 0.00 H new ATOM 0 HB ILE A 55 11.751 -4.497 9.639 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.418 -5.741 10.807 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.300 -6.932 9.873 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.718 -3.339 10.404 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.080 -2.979 8.699 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.785 -4.128 9.111 1.00 0.00 H new ATOM 0 HD11 ILE A 55 11.065 -6.901 12.197 1.00 0.00 H new ATOM 0 HD12 ILE A 55 12.370 -6.385 11.103 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.474 -5.175 12.052 1.00 0.00 H new ATOM 861 N THR A 56 12.964 -6.182 6.947 1.00 0.00 N ATOM 862 CA THR A 56 14.163 -6.995 6.789 1.00 0.00 C ATOM 863 C THR A 56 15.417 -6.134 6.888 1.00 0.00 C ATOM 864 O THR A 56 15.757 -5.404 5.956 1.00 0.00 O ATOM 865 CB THR A 56 14.136 -7.727 5.447 1.00 0.00 C ATOM 866 OG1 THR A 56 15.366 -8.391 5.213 1.00 0.00 O ATOM 867 CG2 THR A 56 13.877 -6.811 4.270 1.00 0.00 C ATOM 0 H THR A 56 12.878 -5.421 6.273 1.00 0.00 H new ATOM 0 HA THR A 56 14.183 -7.730 7.593 1.00 0.00 H new ATOM 0 HB THR A 56 13.312 -8.437 5.522 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.329 -8.855 4.350 1.00 0.00 H new ATOM 0 HG21 THR A 56 13.871 -7.394 3.349 1.00 0.00 H new ATOM 0 HG22 THR A 56 12.911 -6.321 4.396 1.00 0.00 H new ATOM 0 HG23 THR A 56 14.662 -6.057 4.216 1.00 0.00 H new ATOM 1312 N LEU A 89 -24.317 24.907 -28.108 1.00 0.00 N ATOM 1313 CA LEU A 89 -23.958 25.607 -26.871 1.00 0.00 C ATOM 1314 C LEU A 89 -23.371 26.992 -27.151 1.00 0.00 C ATOM 1315 O LEU A 89 -23.750 27.970 -26.508 1.00 0.00 O ATOM 1316 CB LEU A 89 -22.977 24.774 -26.037 1.00 0.00 C ATOM 1317 CG LEU A 89 -23.620 23.912 -24.948 1.00 0.00 C ATOM 1318 CD1 LEU A 89 -24.536 24.752 -24.068 1.00 0.00 C ATOM 1319 CD2 LEU A 89 -24.388 22.757 -25.572 1.00 0.00 C ATOM 0 HA LEU A 89 -24.877 25.743 -26.301 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -22.414 24.125 -26.708 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -22.259 25.448 -25.569 1.00 0.00 H new ATOM 0 HG LEU A 89 -22.828 23.502 -24.321 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -24.983 24.120 -23.300 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -23.958 25.545 -23.594 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -25.324 25.193 -24.679 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -24.840 22.153 -24.785 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -25.170 23.149 -26.222 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -23.706 22.140 -26.157 1.00 0.00 H new ATOM 1331 N ASN A 90 -22.443 27.076 -28.103 1.00 0.00 N ATOM 1332 CA ASN A 90 -21.812 28.349 -28.446 1.00 0.00 C ATOM 1333 C ASN A 90 -22.855 29.450 -28.645 1.00 0.00 C ATOM 1334 O ASN A 90 -22.690 30.565 -28.151 1.00 0.00 O ATOM 1335 CB ASN A 90 -20.966 28.196 -29.711 1.00 0.00 C ATOM 1336 CG ASN A 90 -19.483 28.097 -29.406 1.00 0.00 C ATOM 1337 OD1 ASN A 90 -19.028 28.515 -28.342 1.00 0.00 O ATOM 1338 ND2 ASN A 90 -18.722 27.539 -30.340 1.00 0.00 N ATOM 0 H ASN A 90 -22.112 26.280 -28.649 1.00 0.00 H new ATOM 0 HA ASN A 90 -21.168 28.638 -27.616 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -21.283 27.304 -30.252 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -21.143 29.047 -30.368 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -17.718 27.443 -30.190 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -19.142 27.206 -31.208 1.00 0.00 H new ATOM 1345 N THR A 91 -23.925 29.135 -29.370 1.00 0.00 N ATOM 1346 CA THR A 91 -24.984 30.108 -29.628 1.00 0.00 C ATOM 1347 C THR A 91 -25.664 30.573 -28.333 1.00 0.00 C ATOM 1348 O THR A 91 -26.397 31.562 -28.337 1.00 0.00 O ATOM 1349 CB THR A 91 -26.027 29.511 -30.573 1.00 0.00 C ATOM 1350 OG1 THR A 91 -26.180 28.123 -30.340 1.00 0.00 O ATOM 1351 CG2 THR A 91 -25.685 29.695 -32.036 1.00 0.00 C ATOM 0 H THR A 91 -24.082 28.218 -29.788 1.00 0.00 H new ATOM 0 HA THR A 91 -24.521 30.979 -30.093 1.00 0.00 H new ATOM 0 HB THR A 91 -26.950 30.051 -30.361 1.00 0.00 H new ATOM 0 HG1 THR A 91 -26.452 27.975 -29.410 1.00 0.00 H new ATOM 0 HG21 THR A 91 -26.466 29.248 -32.651 1.00 0.00 H new ATOM 0 HG22 THR A 91 -25.610 30.759 -32.261 1.00 0.00 H new ATOM 0 HG23 THR A 91 -24.733 29.210 -32.251 1.00 0.00 H new ATOM 1359 N PHE A 92 -25.419 29.869 -27.226 1.00 0.00 N ATOM 1360 CA PHE A 92 -26.010 30.228 -25.943 1.00 0.00 C ATOM 1361 C PHE A 92 -25.100 31.196 -25.189 1.00 0.00 C ATOM 1362 O PHE A 92 -23.976 30.849 -24.828 1.00 0.00 O ATOM 1363 CB PHE A 92 -26.256 28.967 -25.112 1.00 0.00 C ATOM 1364 CG PHE A 92 -27.283 28.046 -25.708 1.00 0.00 C ATOM 1365 CD1 PHE A 92 -27.068 27.451 -26.942 1.00 0.00 C ATOM 1366 CD2 PHE A 92 -28.464 27.775 -25.036 1.00 0.00 C ATOM 1367 CE1 PHE A 92 -28.010 26.604 -27.492 1.00 0.00 C ATOM 1368 CE2 PHE A 92 -29.410 26.928 -25.581 1.00 0.00 C ATOM 1369 CZ PHE A 92 -29.183 26.342 -26.812 1.00 0.00 C ATOM 0 H PHE A 92 -24.815 29.048 -27.196 1.00 0.00 H new ATOM 0 HA PHE A 92 -26.964 30.724 -26.121 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -25.316 28.426 -25.000 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -26.577 29.258 -24.112 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -26.153 27.652 -27.479 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -28.647 28.231 -24.074 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -27.829 26.147 -28.454 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -30.326 26.724 -25.046 1.00 0.00 H new ATOM 0 HZ PHE A 92 -29.921 25.681 -27.241 1.00 0.00 H new ATOM 1379 N THR A 93 -25.586 32.416 -24.971 1.00 0.00 N ATOM 1380 CA THR A 93 -24.804 33.437 -24.279 1.00 0.00 C ATOM 1381 C THR A 93 -25.057 33.419 -22.763 1.00 0.00 C ATOM 1382 O THR A 93 -24.598 32.511 -22.070 1.00 0.00 O ATOM 1383 CB THR A 93 -25.102 34.818 -24.874 1.00 0.00 C ATOM 1384 OG1 THR A 93 -24.826 34.834 -26.263 1.00 0.00 O ATOM 1385 CG2 THR A 93 -24.301 35.933 -24.236 1.00 0.00 C ATOM 0 H THR A 93 -26.515 32.721 -25.263 1.00 0.00 H new ATOM 0 HA THR A 93 -23.748 33.213 -24.426 1.00 0.00 H new ATOM 0 HB THR A 93 -26.159 34.994 -24.677 1.00 0.00 H new ATOM 0 HG1 THR A 93 -25.024 35.723 -26.626 1.00 0.00 H new ATOM 0 HG21 THR A 93 -24.561 36.882 -24.705 1.00 0.00 H new ATOM 0 HG22 THR A 93 -24.527 35.980 -23.171 1.00 0.00 H new ATOM 0 HG23 THR A 93 -23.237 35.741 -24.373 1.00 0.00 H new ATOM 1393 N VAL A 94 -25.776 34.419 -22.248 1.00 0.00 N ATOM 1394 CA VAL A 94 -26.060 34.493 -20.816 1.00 0.00 C ATOM 1395 C VAL A 94 -27.521 34.854 -20.553 1.00 0.00 C ATOM 1396 O VAL A 94 -28.107 34.426 -19.567 1.00 0.00 O ATOM 1397 CB VAL A 94 -25.155 35.525 -20.117 1.00 0.00 C ATOM 1398 CG1 VAL A 94 -23.730 35.003 -20.013 1.00 0.00 C ATOM 1399 CG2 VAL A 94 -25.190 36.855 -20.854 1.00 0.00 C ATOM 0 H VAL A 94 -26.169 35.183 -22.798 1.00 0.00 H new ATOM 0 HA VAL A 94 -25.858 33.503 -20.407 1.00 0.00 H new ATOM 0 HB VAL A 94 -25.534 35.686 -19.108 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -23.106 35.746 -19.516 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -23.722 34.078 -19.436 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -23.339 34.810 -21.012 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -24.544 37.570 -20.345 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -24.839 36.714 -21.876 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -26.211 37.235 -20.870 1.00 0.00 H new ATOM 1409 N GLU A 95 -28.104 35.640 -21.439 1.00 0.00 N ATOM 1410 CA GLU A 95 -29.499 36.038 -21.305 1.00 0.00 C ATOM 1411 C GLU A 95 -30.433 34.966 -21.868 1.00 0.00 C ATOM 1412 O GLU A 95 -31.628 34.952 -21.569 1.00 0.00 O ATOM 1413 CB GLU A 95 -29.742 37.371 -22.017 1.00 0.00 C ATOM 1414 CG GLU A 95 -29.541 37.303 -23.522 1.00 0.00 C ATOM 1415 CD GLU A 95 -29.563 38.672 -24.175 1.00 0.00 C ATOM 1416 OE1 GLU A 95 -30.663 39.252 -24.299 1.00 0.00 O ATOM 1417 OE2 GLU A 95 -28.482 39.162 -24.562 1.00 0.00 O ATOM 0 H GLU A 95 -27.635 36.018 -22.262 1.00 0.00 H new ATOM 0 HA GLU A 95 -29.715 36.157 -20.243 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -30.759 37.704 -21.809 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -29.070 38.122 -21.603 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -28.589 36.817 -23.736 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -30.322 36.682 -23.962 1.00 0.00 H new ATOM 1424 N GLN A 96 -29.891 34.098 -22.723 1.00 0.00 N ATOM 1425 CA GLN A 96 -30.680 33.058 -23.374 1.00 0.00 C ATOM 1426 C GLN A 96 -30.898 31.838 -22.493 1.00 0.00 C ATOM 1427 O GLN A 96 -31.938 31.188 -22.585 1.00 0.00 O ATOM 1428 CB GLN A 96 -30.002 32.639 -24.683 1.00 0.00 C ATOM 1429 CG GLN A 96 -30.820 32.962 -25.922 1.00 0.00 C ATOM 1430 CD GLN A 96 -29.973 33.030 -27.178 1.00 0.00 C ATOM 1431 OE1 GLN A 96 -29.047 32.239 -27.360 1.00 0.00 O ATOM 1432 NE2 GLN A 96 -30.287 33.979 -28.053 1.00 0.00 N ATOM 0 H GLN A 96 -28.904 34.097 -22.980 1.00 0.00 H new ATOM 0 HA GLN A 96 -31.664 33.483 -23.575 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -29.035 33.136 -24.757 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -29.808 31.567 -24.655 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -31.593 32.204 -26.050 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -31.328 33.915 -25.779 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -31.063 34.613 -27.861 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -29.752 34.074 -28.917 1.00 0.00 H new ATOM 1441 N LEU A 97 -29.935 31.518 -21.645 1.00 0.00 N ATOM 1442 CA LEU A 97 -30.083 30.359 -20.779 1.00 0.00 C ATOM 1443 C LEU A 97 -30.999 30.697 -19.612 1.00 0.00 C ATOM 1444 O LEU A 97 -31.951 29.972 -19.325 1.00 0.00 O ATOM 1445 CB LEU A 97 -28.737 29.803 -20.272 1.00 0.00 C ATOM 1446 CG LEU A 97 -27.491 30.678 -20.435 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -27.236 31.040 -21.892 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -27.614 31.914 -19.580 1.00 0.00 C ATOM 0 H LEU A 97 -29.060 32.031 -21.537 1.00 0.00 H new ATOM 0 HA LEU A 97 -30.531 29.568 -21.380 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -28.848 29.574 -19.212 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -28.551 28.859 -20.784 1.00 0.00 H new ATOM 0 HG LEU A 97 -26.629 30.102 -20.099 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -26.343 31.661 -21.962 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -27.091 30.129 -22.473 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -28.091 31.589 -22.286 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -26.724 32.531 -19.702 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -28.493 32.482 -19.885 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -27.714 31.624 -18.534 1.00 0.00 H new ATOM 1460 N LYS A 98 -30.712 31.807 -18.951 1.00 0.00 N ATOM 1461 CA LYS A 98 -31.518 32.252 -17.825 1.00 0.00 C ATOM 1462 C LYS A 98 -32.954 32.551 -18.254 1.00 0.00 C ATOM 1463 O LYS A 98 -33.880 32.444 -17.450 1.00 0.00 O ATOM 1464 CB LYS A 98 -30.897 33.497 -17.189 1.00 0.00 C ATOM 1465 CG LYS A 98 -30.720 34.658 -18.153 1.00 0.00 C ATOM 1466 CD LYS A 98 -29.866 35.763 -17.547 1.00 0.00 C ATOM 1467 CE LYS A 98 -28.528 35.233 -17.049 1.00 0.00 C ATOM 1468 NZ LYS A 98 -27.391 36.076 -17.506 1.00 0.00 N ATOM 0 H LYS A 98 -29.926 32.417 -19.175 1.00 0.00 H new ATOM 0 HA LYS A 98 -31.541 31.445 -17.092 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -31.524 33.820 -16.358 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -29.925 33.233 -16.771 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -30.256 34.301 -19.072 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -31.697 35.059 -18.424 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -29.695 36.540 -18.292 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -30.404 36.227 -16.720 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -28.536 35.194 -15.960 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -28.388 34.212 -17.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -26.506 35.534 -17.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -27.544 36.359 -18.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -27.326 36.925 -16.909 1.00 0.00 H new ATOM 1482 N ALA A 99 -33.140 32.936 -19.518 1.00 0.00 N ATOM 1483 CA ALA A 99 -34.475 33.256 -20.020 1.00 0.00 C ATOM 1484 C ALA A 99 -35.220 32.017 -20.483 1.00 0.00 C ATOM 1485 O ALA A 99 -36.447 31.952 -20.411 1.00 0.00 O ATOM 1486 CB ALA A 99 -34.389 34.281 -21.142 1.00 0.00 C ATOM 0 H ALA A 99 -32.392 33.033 -20.205 1.00 0.00 H new ATOM 0 HA ALA A 99 -35.042 33.684 -19.193 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -35.391 34.508 -21.505 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -33.923 35.192 -20.767 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -33.791 33.877 -21.959 1.00 0.00 H new ATOM 1492 N GLN A 100 -34.474 31.043 -20.956 1.00 0.00 N ATOM 1493 CA GLN A 100 -35.061 29.799 -21.434 1.00 0.00 C ATOM 1494 C GLN A 100 -35.246 28.808 -20.290 1.00 0.00 C ATOM 1495 O GLN A 100 -36.140 27.964 -20.330 1.00 0.00 O ATOM 1496 CB GLN A 100 -34.198 29.181 -22.536 1.00 0.00 C ATOM 1497 CG GLN A 100 -34.997 28.376 -23.549 1.00 0.00 C ATOM 1498 CD GLN A 100 -34.344 27.050 -23.889 1.00 0.00 C ATOM 1499 OE1 GLN A 100 -34.798 25.992 -23.450 1.00 0.00 O ATOM 1500 NE2 GLN A 100 -33.274 27.099 -24.672 1.00 0.00 N ATOM 0 H GLN A 100 -33.457 31.083 -21.022 1.00 0.00 H new ATOM 0 HA GLN A 100 -36.042 30.030 -21.849 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -33.662 29.975 -23.056 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -33.448 28.535 -22.080 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -35.997 28.193 -23.155 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -35.116 28.962 -24.460 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -32.932 27.998 -25.013 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -32.793 26.238 -24.933 1.00 0.00 H new ATOM 1509 N LEU A 101 -34.403 28.918 -19.266 1.00 0.00 N ATOM 1510 CA LEU A 101 -34.493 28.029 -18.114 1.00 0.00 C ATOM 1511 C LEU A 101 -35.808 28.260 -17.389 1.00 0.00 C ATOM 1512 O LEU A 101 -36.526 27.318 -17.052 1.00 0.00 O ATOM 1513 CB LEU A 101 -33.331 28.269 -17.143 1.00 0.00 C ATOM 1514 CG LEU A 101 -32.085 27.397 -17.347 1.00 0.00 C ATOM 1515 CD1 LEU A 101 -31.199 27.446 -16.111 1.00 0.00 C ATOM 1516 CD2 LEU A 101 -32.455 25.952 -17.678 1.00 0.00 C ATOM 0 H LEU A 101 -33.655 29.609 -19.211 1.00 0.00 H new ATOM 0 HA LEU A 101 -34.442 27.001 -18.473 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -33.033 29.315 -17.218 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -33.696 28.113 -16.128 1.00 0.00 H new ATOM 0 HG LEU A 101 -31.534 27.800 -18.197 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -30.319 26.823 -16.269 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -30.888 28.474 -15.927 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -31.755 27.076 -15.250 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -31.546 25.366 -17.815 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -33.039 25.530 -16.860 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -33.044 25.928 -18.595 1.00 0.00 H new ATOM 1528 N THR A 102 -36.118 29.527 -17.158 1.00 0.00 N ATOM 1529 CA THR A 102 -37.350 29.893 -16.486 1.00 0.00 C ATOM 1530 C THR A 102 -38.533 29.604 -17.391 1.00 0.00 C ATOM 1531 O THR A 102 -39.605 29.215 -16.930 1.00 0.00 O ATOM 1532 CB THR A 102 -37.330 31.371 -16.097 1.00 0.00 C ATOM 1533 OG1 THR A 102 -36.296 32.060 -16.777 1.00 0.00 O ATOM 1534 CG2 THR A 102 -37.127 31.584 -14.617 1.00 0.00 C ATOM 0 H THR A 102 -35.532 30.317 -17.427 1.00 0.00 H new ATOM 0 HA THR A 102 -37.444 29.301 -15.576 1.00 0.00 H new ATOM 0 HB THR A 102 -38.308 31.761 -16.380 1.00 0.00 H new ATOM 0 HG1 THR A 102 -35.436 31.864 -16.350 1.00 0.00 H new ATOM 0 HG21 THR A 102 -37.122 32.652 -14.401 1.00 0.00 H new ATOM 0 HG22 THR A 102 -37.937 31.106 -14.066 1.00 0.00 H new ATOM 0 HG23 THR A 102 -36.175 31.148 -14.314 1.00 0.00 H new ATOM 1542 N GLU A 103 -38.325 29.794 -18.688 1.00 0.00 N ATOM 1543 CA GLU A 103 -39.374 29.548 -19.662 1.00 0.00 C ATOM 1544 C GLU A 103 -39.629 28.054 -19.837 1.00 0.00 C ATOM 1545 O GLU A 103 -40.629 27.652 -20.432 1.00 0.00 O ATOM 1546 CB GLU A 103 -39.022 30.188 -21.006 1.00 0.00 C ATOM 1547 CG GLU A 103 -39.628 31.569 -21.201 1.00 0.00 C ATOM 1548 CD GLU A 103 -40.712 31.587 -22.261 1.00 0.00 C ATOM 1549 OE1 GLU A 103 -41.587 30.697 -22.231 1.00 0.00 O ATOM 1550 OE2 GLU A 103 -40.683 32.491 -23.123 1.00 0.00 O ATOM 0 H GLU A 103 -37.443 30.116 -19.086 1.00 0.00 H new ATOM 0 HA GLU A 103 -40.290 30.004 -19.286 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -37.938 30.261 -21.091 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -39.362 29.535 -21.810 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -40.044 31.916 -20.255 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -38.842 32.271 -21.479 1.00 0.00 H new ATOM 1557 N ARG A 104 -38.727 27.237 -19.310 1.00 0.00 N ATOM 1558 CA ARG A 104 -38.865 25.786 -19.401 1.00 0.00 C ATOM 1559 C ARG A 104 -39.159 25.175 -18.030 1.00 0.00 C ATOM 1560 O ARG A 104 -39.592 24.027 -17.934 1.00 0.00 O ATOM 1561 CB ARG A 104 -37.604 25.157 -20.003 1.00 0.00 C ATOM 1562 CG ARG A 104 -36.382 25.246 -19.104 1.00 0.00 C ATOM 1563 CD ARG A 104 -35.152 24.654 -19.774 1.00 0.00 C ATOM 1564 NE ARG A 104 -35.309 23.228 -20.051 1.00 0.00 N ATOM 1565 CZ ARG A 104 -35.121 22.270 -19.145 1.00 0.00 C ATOM 1566 NH1 ARG A 104 -34.778 22.580 -17.902 1.00 0.00 N ATOM 1567 NH2 ARG A 104 -35.278 20.997 -19.485 1.00 0.00 N ATOM 0 H ARG A 104 -37.892 27.552 -18.815 1.00 0.00 H new ATOM 0 HA ARG A 104 -39.708 25.573 -20.059 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -37.804 24.109 -20.226 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -37.382 25.648 -20.951 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -36.192 26.289 -18.849 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -36.577 24.720 -18.170 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -34.957 25.184 -20.706 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -34.283 24.805 -19.134 1.00 0.00 H new ATOM 0 HE ARG A 104 -35.579 22.950 -20.994 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -34.657 23.557 -17.635 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -34.636 21.841 -17.213 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -35.542 20.753 -20.439 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -35.134 20.263 -18.792 1.00 0.00 H new ATOM 1581 N GLY A 105 -38.934 25.953 -16.972 1.00 0.00 N ATOM 1582 CA GLY A 105 -39.194 25.472 -15.627 1.00 0.00 C ATOM 1583 C GLY A 105 -38.077 24.605 -15.077 1.00 0.00 C ATOM 1584 O GLY A 105 -38.156 23.378 -15.126 1.00 0.00 O ATOM 0 H GLY A 105 -38.577 26.907 -17.024 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -39.343 26.325 -14.965 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -40.123 24.902 -15.625 1.00 0.00 H new ATOM 1588 N ILE A 106 -37.038 25.242 -14.546 1.00 0.00 N ATOM 1589 CA ILE A 106 -35.906 24.514 -13.979 1.00 0.00 C ATOM 1590 C ILE A 106 -35.613 24.966 -12.549 1.00 0.00 C ATOM 1591 O ILE A 106 -35.312 24.147 -11.680 1.00 0.00 O ATOM 1592 CB ILE A 106 -34.635 24.690 -14.833 1.00 0.00 C ATOM 1593 CG1 ILE A 106 -33.526 23.762 -14.334 1.00 0.00 C ATOM 1594 CG2 ILE A 106 -34.172 26.139 -14.808 1.00 0.00 C ATOM 1595 CD1 ILE A 106 -33.927 22.302 -14.303 1.00 0.00 C ATOM 0 H ILE A 106 -36.956 26.257 -14.496 1.00 0.00 H new ATOM 0 HA ILE A 106 -36.186 23.461 -13.971 1.00 0.00 H new ATOM 0 HB ILE A 106 -34.870 24.424 -15.863 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -32.652 23.877 -14.975 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -33.229 24.070 -13.332 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -33.274 26.244 -15.416 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -34.958 26.779 -15.208 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -33.952 26.433 -13.782 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -33.092 21.703 -13.939 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -34.782 22.174 -13.639 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -34.196 21.977 -15.308 1.00 0.00 H new ATOM 1607 N THR A 107 -35.696 26.274 -12.312 1.00 0.00 N ATOM 1608 CA THR A 107 -35.432 26.836 -10.990 1.00 0.00 C ATOM 1609 C THR A 107 -33.938 26.817 -10.687 1.00 0.00 C ATOM 1610 O THR A 107 -33.416 25.842 -10.148 1.00 0.00 O ATOM 1611 CB THR A 107 -36.198 26.064 -9.911 1.00 0.00 C ATOM 1612 OG1 THR A 107 -37.331 25.419 -10.466 1.00 0.00 O ATOM 1613 CG2 THR A 107 -36.680 26.941 -8.775 1.00 0.00 C ATOM 0 H THR A 107 -35.944 26.965 -13.020 1.00 0.00 H new ATOM 0 HA THR A 107 -35.775 27.870 -10.988 1.00 0.00 H new ATOM 0 HB THR A 107 -35.486 25.341 -9.513 1.00 0.00 H new ATOM 0 HG1 THR A 107 -37.806 24.930 -9.762 1.00 0.00 H new ATOM 0 HG21 THR A 107 -37.214 26.331 -8.046 1.00 0.00 H new ATOM 0 HG22 THR A 107 -35.825 27.416 -8.294 1.00 0.00 H new ATOM 0 HG23 THR A 107 -37.348 27.708 -9.166 1.00 0.00 H new ATOM 1621 N PHE A 108 -33.254 27.903 -11.039 1.00 0.00 N ATOM 1622 CA PHE A 108 -31.819 28.012 -10.809 1.00 0.00 C ATOM 1623 C PHE A 108 -31.505 29.124 -9.813 1.00 0.00 C ATOM 1624 O PHE A 108 -32.104 30.199 -9.857 1.00 0.00 O ATOM 1625 CB PHE A 108 -31.084 28.266 -12.129 1.00 0.00 C ATOM 1626 CG PHE A 108 -31.371 29.611 -12.738 1.00 0.00 C ATOM 1627 CD1 PHE A 108 -32.605 29.883 -13.304 1.00 0.00 C ATOM 1628 CD2 PHE A 108 -30.402 30.603 -12.742 1.00 0.00 C ATOM 1629 CE1 PHE A 108 -32.870 31.119 -13.862 1.00 0.00 C ATOM 1630 CE2 PHE A 108 -30.661 31.841 -13.299 1.00 0.00 C ATOM 1631 CZ PHE A 108 -31.896 32.099 -13.860 1.00 0.00 C ATOM 0 H PHE A 108 -33.672 28.720 -11.485 1.00 0.00 H new ATOM 0 HA PHE A 108 -31.475 27.068 -10.387 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -30.011 28.177 -11.959 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -31.359 27.489 -12.842 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -33.369 29.120 -13.309 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -29.434 30.406 -12.305 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -33.837 31.319 -14.299 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -29.898 32.606 -13.295 1.00 0.00 H new ATOM 0 HZ PHE A 108 -32.100 33.065 -14.297 1.00 0.00 H new ATOM 1641 N LYS A 109 -30.561 28.857 -8.917 1.00 0.00 N ATOM 1642 CA LYS A 109 -30.163 29.831 -7.908 1.00 0.00 C ATOM 1643 C LYS A 109 -28.856 29.416 -7.241 1.00 0.00 C ATOM 1644 O LYS A 109 -27.965 30.239 -7.030 1.00 0.00 O ATOM 1645 CB LYS A 109 -31.264 29.989 -6.855 1.00 0.00 C ATOM 1646 CG LYS A 109 -31.882 31.377 -6.825 1.00 0.00 C ATOM 1647 CD LYS A 109 -32.289 31.774 -5.415 1.00 0.00 C ATOM 1648 CE LYS A 109 -31.140 32.427 -4.665 1.00 0.00 C ATOM 1649 NZ LYS A 109 -31.126 32.043 -3.227 1.00 0.00 N ATOM 0 H LYS A 109 -30.056 27.972 -8.869 1.00 0.00 H new ATOM 0 HA LYS A 109 -30.009 30.790 -8.404 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -32.047 29.256 -7.047 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -30.850 29.763 -5.872 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -31.169 32.103 -7.217 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -32.755 31.402 -7.478 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -33.133 32.462 -5.459 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -32.625 30.892 -4.870 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -30.195 32.140 -5.127 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -31.220 33.511 -4.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -30.327 32.509 -2.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -32.017 32.340 -2.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -31.024 31.011 -3.144 1.00 0.00 H new ATOM 1663 N GLN A 110 -28.747 28.132 -6.912 1.00 0.00 N ATOM 1664 CA GLN A 110 -27.549 27.605 -6.270 1.00 0.00 C ATOM 1665 C GLN A 110 -27.022 26.384 -7.019 1.00 0.00 C ATOM 1666 O GLN A 110 -26.377 25.515 -6.432 1.00 0.00 O ATOM 1667 CB GLN A 110 -27.846 27.237 -4.815 1.00 0.00 C ATOM 1668 CG GLN A 110 -26.615 26.814 -4.030 1.00 0.00 C ATOM 1669 CD GLN A 110 -26.607 25.331 -3.709 1.00 0.00 C ATOM 1670 OE1 GLN A 110 -27.534 24.815 -3.085 1.00 0.00 O ATOM 1671 NE2 GLN A 110 -25.557 24.639 -4.136 1.00 0.00 N ATOM 0 H GLN A 110 -29.475 27.438 -7.080 1.00 0.00 H new ATOM 0 HA GLN A 110 -26.783 28.380 -6.293 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -28.306 28.092 -4.320 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -28.575 26.427 -4.796 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -25.721 27.063 -4.602 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -26.568 27.383 -3.101 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -24.811 25.109 -4.650 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -25.496 23.638 -3.950 1.00 0.00 H new ATOM 1680 N SER A 111 -27.298 26.324 -8.318 1.00 0.00 N ATOM 1681 CA SER A 111 -26.847 25.208 -9.143 1.00 0.00 C ATOM 1682 C SER A 111 -26.908 25.565 -10.625 1.00 0.00 C ATOM 1683 O SER A 111 -27.115 24.698 -11.475 1.00 0.00 O ATOM 1684 CB SER A 111 -27.697 23.967 -8.869 1.00 0.00 C ATOM 1685 OG SER A 111 -29.013 24.325 -8.484 1.00 0.00 O ATOM 0 H SER A 111 -27.831 27.033 -8.821 1.00 0.00 H new ATOM 0 HA SER A 111 -25.810 24.994 -8.883 1.00 0.00 H new ATOM 0 HB2 SER A 111 -27.733 23.343 -9.762 1.00 0.00 H new ATOM 0 HB3 SER A 111 -27.234 23.372 -8.082 1.00 0.00 H new ATOM 0 HG SER A 111 -29.537 23.514 -8.316 1.00 0.00 H new ATOM 1691 N ALA A 112 -26.725 26.845 -10.929 1.00 0.00 N ATOM 1692 CA ALA A 112 -26.757 27.319 -12.308 1.00 0.00 C ATOM 1693 C ALA A 112 -26.481 28.818 -12.374 1.00 0.00 C ATOM 1694 O ALA A 112 -27.309 29.595 -12.849 1.00 0.00 O ATOM 1695 CB ALA A 112 -28.095 26.985 -12.952 1.00 0.00 C ATOM 0 H ALA A 112 -26.553 27.575 -10.237 1.00 0.00 H new ATOM 0 HA ALA A 112 -25.971 26.810 -12.865 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -28.104 27.345 -13.981 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -28.243 25.905 -12.944 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -28.898 27.465 -12.393 1.00 0.00 H new ATOM 1701 N THR A 113 -25.311 29.219 -11.888 1.00 0.00 N ATOM 1702 CA THR A 113 -24.924 30.623 -11.884 1.00 0.00 C ATOM 1703 C THR A 113 -24.892 31.192 -13.300 1.00 0.00 C ATOM 1704 O THR A 113 -25.854 31.818 -13.744 1.00 0.00 O ATOM 1705 CB THR A 113 -23.562 30.798 -11.209 1.00 0.00 C ATOM 1706 OG1 THR A 113 -22.867 29.564 -11.150 1.00 0.00 O ATOM 1707 CG2 THR A 113 -23.669 31.334 -9.802 1.00 0.00 C ATOM 0 H THR A 113 -24.614 28.589 -11.491 1.00 0.00 H new ATOM 0 HA THR A 113 -25.672 31.176 -11.317 1.00 0.00 H new ATOM 0 HB THR A 113 -23.022 31.521 -11.820 1.00 0.00 H new ATOM 0 HG1 THR A 113 -21.998 29.698 -10.717 1.00 0.00 H new ATOM 0 HG21 THR A 113 -22.671 31.437 -9.375 1.00 0.00 H new ATOM 0 HG22 THR A 113 -24.158 32.308 -9.820 1.00 0.00 H new ATOM 0 HG23 THR A 113 -24.255 30.645 -9.194 1.00 0.00 H new ATOM 1715 N LYS A 114 -23.784 30.981 -14.006 1.00 0.00 N ATOM 1716 CA LYS A 114 -23.654 31.490 -15.367 1.00 0.00 C ATOM 1717 C LYS A 114 -22.973 30.487 -16.282 1.00 0.00 C ATOM 1718 O LYS A 114 -23.410 30.271 -17.411 1.00 0.00 O ATOM 1719 CB LYS A 114 -22.888 32.815 -15.372 1.00 0.00 C ATOM 1720 CG LYS A 114 -21.663 32.814 -14.472 1.00 0.00 C ATOM 1721 CD LYS A 114 -21.020 34.191 -14.404 1.00 0.00 C ATOM 1722 CE LYS A 114 -21.850 35.155 -13.572 1.00 0.00 C ATOM 1723 NZ LYS A 114 -21.664 36.568 -14.008 1.00 0.00 N ATOM 0 H LYS A 114 -22.972 30.467 -13.663 1.00 0.00 H new ATOM 0 HA LYS A 114 -24.661 31.658 -15.750 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -22.579 33.042 -16.392 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -23.559 33.614 -15.057 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -21.947 32.494 -13.469 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -20.938 32.090 -14.844 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -20.021 34.106 -13.975 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -20.902 34.588 -15.412 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -22.904 34.887 -13.649 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -21.573 35.060 -12.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -22.247 37.194 -13.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -20.663 36.833 -13.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -21.952 36.665 -15.003 1.00 0.00 H new ATOM 1737 N ALA A 115 -21.910 29.871 -15.800 1.00 0.00 N ATOM 1738 CA ALA A 115 -21.198 28.885 -16.593 1.00 0.00 C ATOM 1739 C ALA A 115 -21.925 27.549 -16.549 1.00 0.00 C ATOM 1740 O ALA A 115 -21.790 26.724 -17.452 1.00 0.00 O ATOM 1741 CB ALA A 115 -19.767 28.734 -16.100 1.00 0.00 C ATOM 0 H ALA A 115 -21.522 30.034 -14.871 1.00 0.00 H new ATOM 0 HA ALA A 115 -21.167 29.228 -17.627 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -19.250 27.991 -16.707 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -19.251 29.691 -16.181 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -19.773 28.412 -15.059 1.00 0.00 H new ATOM 1747 N GLU A 116 -22.698 27.346 -15.488 1.00 0.00 N ATOM 1748 CA GLU A 116 -23.453 26.114 -15.317 1.00 0.00 C ATOM 1749 C GLU A 116 -24.808 26.176 -16.019 1.00 0.00 C ATOM 1750 O GLU A 116 -25.278 25.173 -16.553 1.00 0.00 O ATOM 1751 CB GLU A 116 -23.648 25.813 -13.831 1.00 0.00 C ATOM 1752 CG GLU A 116 -22.349 25.721 -13.051 1.00 0.00 C ATOM 1753 CD GLU A 116 -21.813 24.305 -12.973 1.00 0.00 C ATOM 1754 OE1 GLU A 116 -22.616 23.358 -13.107 1.00 0.00 O ATOM 1755 OE2 GLU A 116 -20.589 24.143 -12.778 1.00 0.00 O ATOM 0 H GLU A 116 -22.817 28.021 -14.733 1.00 0.00 H new ATOM 0 HA GLU A 116 -22.876 25.311 -15.776 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -24.271 26.591 -13.391 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -24.191 24.873 -13.728 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -21.602 26.363 -13.519 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -22.508 26.101 -12.042 1.00 0.00 H new ATOM 1762 N LEU A 117 -25.444 27.349 -16.005 1.00 0.00 N ATOM 1763 CA LEU A 117 -26.754 27.498 -16.635 1.00 0.00 C ATOM 1764 C LEU A 117 -26.632 27.617 -18.146 1.00 0.00 C ATOM 1765 O LEU A 117 -27.577 27.316 -18.873 1.00 0.00 O ATOM 1766 CB LEU A 117 -27.550 28.664 -16.004 1.00 0.00 C ATOM 1767 CG LEU A 117 -27.485 30.039 -16.679 1.00 0.00 C ATOM 1768 CD1 LEU A 117 -27.948 31.102 -15.696 1.00 0.00 C ATOM 1769 CD2 LEU A 117 -26.085 30.350 -17.172 1.00 0.00 C ATOM 0 H LEU A 117 -25.079 28.197 -15.571 1.00 0.00 H new ATOM 0 HA LEU A 117 -27.328 26.591 -16.443 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -28.597 28.365 -15.959 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -27.208 28.782 -14.976 1.00 0.00 H new ATOM 0 HG LEU A 117 -28.142 30.030 -17.548 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -27.903 32.082 -16.172 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -28.973 30.893 -15.391 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -27.300 31.094 -14.820 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -26.076 31.332 -17.645 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -25.393 30.346 -16.330 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -25.778 29.595 -17.896 1.00 0.00 H new ATOM 1781 N ILE A 118 -25.457 28.010 -18.626 1.00 0.00 N ATOM 1782 CA ILE A 118 -25.238 28.102 -20.061 1.00 0.00 C ATOM 1783 C ILE A 118 -24.851 26.735 -20.623 1.00 0.00 C ATOM 1784 O ILE A 118 -25.112 26.434 -21.788 1.00 0.00 O ATOM 1785 CB ILE A 118 -24.166 29.156 -20.434 1.00 0.00 C ATOM 1786 CG1 ILE A 118 -24.066 29.294 -21.959 1.00 0.00 C ATOM 1787 CG2 ILE A 118 -22.806 28.826 -19.826 1.00 0.00 C ATOM 1788 CD1 ILE A 118 -23.206 28.239 -22.627 1.00 0.00 C ATOM 0 H ILE A 118 -24.654 28.266 -18.051 1.00 0.00 H new ATOM 0 HA ILE A 118 -26.177 28.430 -20.507 1.00 0.00 H new ATOM 0 HB ILE A 118 -24.479 30.112 -20.014 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -25.069 29.249 -22.382 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -23.663 30.278 -22.197 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -22.084 29.591 -20.113 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -22.891 28.796 -18.740 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -22.470 27.855 -20.191 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -23.190 28.411 -23.703 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -22.190 28.296 -22.235 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -23.619 27.251 -22.423 1.00 0.00 H new ATOM 1800 N ALA A 119 -24.240 25.905 -19.778 1.00 0.00 N ATOM 1801 CA ALA A 119 -23.830 24.564 -20.171 1.00 0.00 C ATOM 1802 C ALA A 119 -24.962 23.561 -19.969 1.00 0.00 C ATOM 1803 O ALA A 119 -25.098 22.598 -20.725 1.00 0.00 O ATOM 1804 CB ALA A 119 -22.598 24.136 -19.386 1.00 0.00 C ATOM 0 H ALA A 119 -24.018 26.143 -18.811 1.00 0.00 H new ATOM 0 HA ALA A 119 -23.582 24.584 -21.232 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.303 23.132 -19.690 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -21.781 24.830 -19.584 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.826 24.140 -18.320 1.00 0.00 H new ATOM 1810 N LEU A 120 -25.760 23.788 -18.929 1.00 0.00 N ATOM 1811 CA LEU A 120 -26.873 22.903 -18.596 1.00 0.00 C ATOM 1812 C LEU A 120 -27.743 22.604 -19.810 1.00 0.00 C ATOM 1813 O LEU A 120 -28.107 21.452 -20.049 1.00 0.00 O ATOM 1814 CB LEU A 120 -27.727 23.515 -17.483 1.00 0.00 C ATOM 1815 CG LEU A 120 -27.980 22.600 -16.285 1.00 0.00 C ATOM 1816 CD1 LEU A 120 -26.745 22.523 -15.401 1.00 0.00 C ATOM 1817 CD2 LEU A 120 -29.179 23.087 -15.486 1.00 0.00 C ATOM 0 H LEU A 120 -25.655 24.583 -18.298 1.00 0.00 H new ATOM 0 HA LEU A 120 -26.446 21.962 -18.250 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -27.240 24.424 -17.130 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.688 23.811 -17.904 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.198 21.599 -16.657 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.944 21.867 -14.554 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -25.909 22.127 -15.978 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.495 23.520 -15.037 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -29.344 22.424 -14.637 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -28.989 24.098 -15.125 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -30.064 23.089 -16.122 1.00 0.00 H new ATOM 1829 N PHE A 121 -28.086 23.641 -20.569 1.00 0.00 N ATOM 1830 CA PHE A 121 -28.927 23.470 -21.751 1.00 0.00 C ATOM 1831 C PHE A 121 -28.340 22.435 -22.705 1.00 0.00 C ATOM 1832 O PHE A 121 -27.602 22.774 -23.631 1.00 0.00 O ATOM 1833 CB PHE A 121 -29.108 24.797 -22.479 1.00 0.00 C ATOM 1834 CG PHE A 121 -30.105 25.692 -21.816 1.00 0.00 C ATOM 1835 CD1 PHE A 121 -31.458 25.584 -22.098 1.00 0.00 C ATOM 1836 CD2 PHE A 121 -29.690 26.637 -20.899 1.00 0.00 C ATOM 1837 CE1 PHE A 121 -32.373 26.407 -21.479 1.00 0.00 C ATOM 1838 CE2 PHE A 121 -30.599 27.459 -20.277 1.00 0.00 C ATOM 1839 CZ PHE A 121 -31.941 27.347 -20.567 1.00 0.00 C ATOM 0 H PHE A 121 -27.797 24.603 -20.389 1.00 0.00 H new ATOM 0 HA PHE A 121 -29.899 23.113 -21.412 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -28.148 25.309 -22.534 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -29.426 24.603 -23.504 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -31.798 24.847 -22.810 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -28.639 26.731 -20.668 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -33.425 26.316 -21.707 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -30.261 28.193 -19.561 1.00 0.00 H new ATOM 0 HZ PHE A 121 -32.655 27.995 -20.080 1.00 0.00 H new