USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 774 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 573 GLN : amide:sc= 1.09 K(o=2.3,f=-6) USER MOD Set 1.2: A 575 LYS NZ :NH3+ 167:sc= 1.22 (180deg=0) USER MOD Single : A 522 MET CE :methyl -175:sc= -0.123 (180deg=-0.153) USER MOD Single : A 524 LYS NZ :NH3+ 172:sc= 2.38 (180deg=2.34) USER MOD Single : A 526 GLN : amide:sc= 0.912 K(o=0.91,f=-0.5) USER MOD Single : A 528 GLN : amide:sc= 0.644 K(o=0.64,f=-0.059) USER MOD Single : A 529 HIS : no HD1:sc= -0.268 X(o=-0.27,f=-0.023) USER MOD Single : A 531 TYR OH : rot 180:sc= 0 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot -40:sc= 0.0248 USER MOD Single : A 540 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 553 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 554 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.6!) USER MOD Single : A 558 GLN : amide:sc=-0.00145 K(o=-0.0015,f=-0.66) USER MOD Single : A 564 MET CE :methyl 164:sc= -0.638 (180deg=-1.05) USER MOD Single : A 567 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 569 SER OG : rot 180:sc= 0 USER MOD Single : A 572 ASN : amide:sc= -0.0968 X(o=-0.097,f=-0.085) USER MOD Single : A 574 HIS : no HE2:sc= 0.0645 K(o=0.064,f=-1.8) USER MOD Single : A 579 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 580 CYS SG : rot -140:sc=-0.00487 USER MOD Single : A 587 ASN : amide:sc= 1.06 K(o=1.1,f=-5.5!) USER MOD Single : A 589 THR OG1 : rot -17:sc= 0.757 USER MOD Single : B1728 SER OG : rot -24:sc= 0.359 USER MOD Single : B1729 THR OG1 : rot 180:sc= 0 USER MOD Single : B1742 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B1744 THR OG1 : rot 180:sc= 0.01 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 513 37.792 14.925 32.285 1.00 0.00 N ATOM 2 CA GLY A 513 36.558 15.603 31.861 1.00 0.00 C ATOM 3 C GLY A 513 35.769 14.759 30.877 1.00 0.00 C ATOM 4 O GLY A 513 36.287 13.787 30.329 1.00 0.00 O ATOM 0 HA2 GLY A 513 35.941 15.818 32.734 1.00 0.00 H new ATOM 0 HA3 GLY A 513 36.807 16.560 31.403 1.00 0.00 H new ATOM 10 N ARG A 514 34.496 15.104 30.659 1.00 0.00 N ATOM 11 CA ARG A 514 33.527 14.355 29.837 1.00 0.00 C ATOM 12 C ARG A 514 33.293 14.961 28.454 1.00 0.00 C ATOM 13 O ARG A 514 33.377 16.175 28.275 1.00 0.00 O ATOM 14 CB ARG A 514 32.196 14.202 30.603 1.00 0.00 C ATOM 15 CG ARG A 514 32.172 12.986 31.539 1.00 0.00 C ATOM 16 CD ARG A 514 32.088 11.675 30.756 1.00 0.00 C ATOM 17 NE ARG A 514 31.918 10.506 31.632 1.00 0.00 N ATOM 18 CZ ARG A 514 31.073 9.503 31.480 1.00 0.00 C ATOM 19 NH1 ARG A 514 30.212 9.421 30.507 1.00 0.00 N ATOM 20 NH2 ARG A 514 31.104 8.522 32.329 1.00 0.00 N ATOM 0 H ARG A 514 34.091 15.947 31.065 1.00 0.00 H new ATOM 0 HA ARG A 514 33.964 13.373 29.656 1.00 0.00 H new ATOM 0 HB2 ARG A 514 32.014 15.105 31.186 1.00 0.00 H new ATOM 0 HB3 ARG A 514 31.380 14.116 29.886 1.00 0.00 H new ATOM 0 HG2 ARG A 514 33.070 12.984 32.157 1.00 0.00 H new ATOM 0 HG3 ARG A 514 31.320 13.063 32.214 1.00 0.00 H new ATOM 0 HD2 ARG A 514 31.253 11.726 30.057 1.00 0.00 H new ATOM 0 HD3 ARG A 514 32.994 11.551 30.162 1.00 0.00 H new ATOM 0 HE ARG A 514 32.523 10.465 32.452 1.00 0.00 H new ATOM 0 HH11 ARG A 514 30.164 10.160 29.805 1.00 0.00 H new ATOM 0 HH12 ARG A 514 29.586 8.618 30.446 1.00 0.00 H new ATOM 0 HH21 ARG A 514 31.774 8.534 33.098 1.00 0.00 H new ATOM 0 HH22 ARG A 514 30.459 7.739 32.227 1.00 0.00 H new ATOM 34 N LEU A 515 32.940 14.103 27.497 1.00 0.00 N ATOM 35 CA LEU A 515 32.600 14.485 26.119 1.00 0.00 C ATOM 36 C LEU A 515 31.133 14.172 25.750 1.00 0.00 C ATOM 37 O LEU A 515 30.592 14.800 24.835 1.00 0.00 O ATOM 38 CB LEU A 515 33.654 13.869 25.177 1.00 0.00 C ATOM 39 CG LEU A 515 33.573 14.286 23.696 1.00 0.00 C ATOM 40 CD1 LEU A 515 33.812 15.784 23.496 1.00 0.00 C ATOM 41 CD2 LEU A 515 34.634 13.529 22.896 1.00 0.00 C ATOM 0 H LEU A 515 32.880 13.098 27.659 1.00 0.00 H new ATOM 0 HA LEU A 515 32.644 15.569 26.009 1.00 0.00 H new ATOM 0 HB2 LEU A 515 34.643 14.131 25.553 1.00 0.00 H new ATOM 0 HB3 LEU A 515 33.569 12.784 25.232 1.00 0.00 H new ATOM 0 HG LEU A 515 32.566 14.048 23.353 1.00 0.00 H new ATOM 0 HD11 LEU A 515 33.744 16.025 22.435 1.00 0.00 H new ATOM 0 HD12 LEU A 515 33.059 16.349 24.045 1.00 0.00 H new ATOM 0 HD13 LEU A 515 34.804 16.047 23.865 1.00 0.00 H new ATOM 0 HD21 LEU A 515 34.578 13.823 21.848 1.00 0.00 H new ATOM 0 HD22 LEU A 515 35.623 13.767 23.287 1.00 0.00 H new ATOM 0 HD23 LEU A 515 34.458 12.457 22.982 1.00 0.00 H new ATOM 53 N ASP A 516 30.453 13.296 26.501 1.00 0.00 N ATOM 54 CA ASP A 516 28.994 13.320 26.668 1.00 0.00 C ATOM 55 C ASP A 516 28.514 14.361 27.700 1.00 0.00 C ATOM 56 O ASP A 516 28.885 14.320 28.878 1.00 0.00 O ATOM 57 CB ASP A 516 28.331 11.936 26.835 1.00 0.00 C ATOM 58 CG ASP A 516 28.983 10.920 27.785 1.00 0.00 C ATOM 59 OD1 ASP A 516 28.257 9.987 28.211 1.00 0.00 O ATOM 60 OD2 ASP A 516 30.194 11.002 28.099 1.00 0.00 O ATOM 0 H ASP A 516 30.906 12.541 27.016 1.00 0.00 H new ATOM 0 HA ASP A 516 28.626 13.666 25.702 1.00 0.00 H new ATOM 0 HB2 ASP A 516 27.308 12.098 27.174 1.00 0.00 H new ATOM 0 HB3 ASP A 516 28.271 11.476 25.849 1.00 0.00 H new ATOM 65 N LEU A 517 27.716 15.325 27.241 1.00 0.00 N ATOM 66 CA LEU A 517 27.580 16.667 27.830 1.00 0.00 C ATOM 67 C LEU A 517 26.105 17.053 28.069 1.00 0.00 C ATOM 68 O LEU A 517 25.208 16.385 27.548 1.00 0.00 O ATOM 69 CB LEU A 517 28.300 17.638 26.875 1.00 0.00 C ATOM 70 CG LEU A 517 29.833 17.613 27.026 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.410 18.778 26.248 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.350 17.809 28.450 1.00 0.00 C ATOM 0 H LEU A 517 27.124 15.194 26.421 1.00 0.00 H new ATOM 0 HA LEU A 517 28.033 16.703 28.821 1.00 0.00 H new ATOM 0 HB2 LEU A 517 28.039 17.387 25.847 1.00 0.00 H new ATOM 0 HB3 LEU A 517 27.940 18.651 27.057 1.00 0.00 H new ATOM 0 HG LEU A 517 30.132 16.624 26.679 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.496 18.777 26.343 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.138 18.684 25.197 1.00 0.00 H new ATOM 0 HD13 LEU A 517 30.012 19.712 26.644 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.439 17.775 28.449 1.00 0.00 H new ATOM 0 HD22 LEU A 517 30.017 18.776 28.828 1.00 0.00 H new ATOM 0 HD23 LEU A 517 29.963 17.016 29.090 1.00 0.00 H new ATOM 84 N PRO A 518 25.825 18.095 28.875 1.00 0.00 N ATOM 85 CA PRO A 518 24.464 18.472 29.262 1.00 0.00 C ATOM 86 C PRO A 518 23.614 18.980 28.087 1.00 0.00 C ATOM 87 O PRO A 518 24.157 19.388 27.051 1.00 0.00 O ATOM 88 CB PRO A 518 24.616 19.518 30.372 1.00 0.00 C ATOM 89 CG PRO A 518 25.992 20.112 30.115 1.00 0.00 C ATOM 90 CD PRO A 518 26.788 18.948 29.549 1.00 0.00 C ATOM 0 HA PRO A 518 23.915 17.599 29.614 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.835 20.277 30.318 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.553 19.065 31.361 1.00 0.00 H new ATOM 0 HG2 PRO A 518 25.944 20.944 29.412 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.440 20.495 31.032 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.552 19.298 28.855 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.303 18.405 30.342 1.00 0.00 H new ATOM 98 N PRO A 519 22.276 18.973 28.226 1.00 0.00 N ATOM 99 CA PRO A 519 21.362 19.388 27.168 1.00 0.00 C ATOM 100 C PRO A 519 21.635 20.838 26.756 1.00 0.00 C ATOM 101 O PRO A 519 21.821 21.715 27.603 1.00 0.00 O ATOM 102 CB PRO A 519 19.952 19.188 27.734 1.00 0.00 C ATOM 103 CG PRO A 519 20.147 19.266 29.245 1.00 0.00 C ATOM 104 CD PRO A 519 21.532 18.658 29.438 1.00 0.00 C ATOM 0 HA PRO A 519 21.489 18.802 26.258 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.267 19.958 27.380 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.534 18.227 27.434 1.00 0.00 H new ATOM 0 HG2 PRO A 519 20.102 20.293 29.606 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.381 18.706 29.781 1.00 0.00 H new ATOM 0 HD2 PRO A 519 22.023 19.075 30.318 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.468 17.580 29.589 1.00 0.00 H new ATOM 112 N GLY A 520 21.709 21.091 25.450 1.00 0.00 N ATOM 113 CA GLY A 520 21.989 22.421 24.905 1.00 0.00 C ATOM 114 C GLY A 520 23.419 22.951 25.098 1.00 0.00 C ATOM 115 O GLY A 520 23.663 24.087 24.689 1.00 0.00 O ATOM 0 H GLY A 520 21.576 20.376 24.735 1.00 0.00 H new ATOM 0 HA2 GLY A 520 21.772 22.405 23.837 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.297 23.130 25.361 1.00 0.00 H new ATOM 119 N PHE A 521 24.354 22.189 25.694 1.00 0.00 N ATOM 120 CA PHE A 521 25.745 22.590 25.924 1.00 0.00 C ATOM 121 C PHE A 521 26.420 23.485 24.863 1.00 0.00 C ATOM 122 O PHE A 521 26.368 23.178 23.669 1.00 0.00 O ATOM 123 CB PHE A 521 26.579 21.346 26.251 1.00 0.00 C ATOM 124 CG PHE A 521 28.069 21.587 26.238 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.788 21.535 25.028 1.00 0.00 C ATOM 126 CD2 PHE A 521 28.720 21.921 27.438 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.163 21.805 25.021 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.098 22.196 27.427 1.00 0.00 C ATOM 129 CZ PHE A 521 30.818 22.106 26.224 1.00 0.00 C ATOM 0 H PHE A 521 24.152 21.250 26.037 1.00 0.00 H new ATOM 0 HA PHE A 521 25.701 23.271 26.774 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.290 20.975 27.234 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.341 20.562 25.532 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.281 21.288 24.107 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.164 21.966 28.363 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.716 21.781 24.093 1.00 0.00 H new ATOM 0 HE2 PHE A 521 30.602 22.476 28.340 1.00 0.00 H new ATOM 0 HZ PHE A 521 31.885 22.270 26.226 1.00 0.00 H new ATOM 139 N MET A 522 27.078 24.573 25.280 1.00 0.00 N ATOM 140 CA MET A 522 27.696 25.545 24.365 1.00 0.00 C ATOM 141 C MET A 522 29.213 25.362 24.210 1.00 0.00 C ATOM 142 O MET A 522 29.712 25.226 23.091 1.00 0.00 O ATOM 143 CB MET A 522 27.361 26.979 24.808 1.00 0.00 C ATOM 144 CG MET A 522 25.852 27.234 24.821 1.00 0.00 C ATOM 145 SD MET A 522 25.344 28.975 24.706 1.00 0.00 S ATOM 146 CE MET A 522 25.948 29.610 26.290 1.00 0.00 C ATOM 0 H MET A 522 27.198 24.807 26.266 1.00 0.00 H new ATOM 0 HA MET A 522 27.270 25.359 23.379 1.00 0.00 H new ATOM 0 HB2 MET A 522 27.768 27.156 25.804 1.00 0.00 H new ATOM 0 HB3 MET A 522 27.843 27.689 24.136 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.403 26.688 23.991 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.439 26.814 25.739 1.00 0.00 H new ATOM 0 HE1 MET A 522 25.634 30.647 26.410 1.00 0.00 H new ATOM 0 HE2 MET A 522 25.537 29.011 27.103 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.036 29.555 26.313 1.00 0.00 H new ATOM 156 N PHE A 523 29.934 25.414 25.330 1.00 0.00 N ATOM 157 CA PHE A 523 31.397 25.351 25.468 1.00 0.00 C ATOM 158 C PHE A 523 31.796 25.138 26.924 1.00 0.00 C ATOM 159 O PHE A 523 30.947 25.156 27.808 1.00 0.00 O ATOM 160 CB PHE A 523 32.079 26.605 24.891 1.00 0.00 C ATOM 161 CG PHE A 523 31.606 27.939 25.442 1.00 0.00 C ATOM 162 CD1 PHE A 523 32.331 28.576 26.464 1.00 0.00 C ATOM 163 CD2 PHE A 523 30.460 28.562 24.921 1.00 0.00 C ATOM 164 CE1 PHE A 523 31.877 29.790 27.004 1.00 0.00 C ATOM 165 CE2 PHE A 523 29.992 29.766 25.473 1.00 0.00 C ATOM 166 CZ PHE A 523 30.704 30.385 26.514 1.00 0.00 C ATOM 0 H PHE A 523 29.479 25.509 26.238 1.00 0.00 H new ATOM 0 HA PHE A 523 31.743 24.495 24.888 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.152 26.523 25.066 1.00 0.00 H new ATOM 0 HB3 PHE A 523 31.932 26.609 23.811 1.00 0.00 H new ATOM 0 HD1 PHE A 523 33.241 28.130 26.836 1.00 0.00 H new ATOM 0 HD2 PHE A 523 29.935 28.113 24.091 1.00 0.00 H new ATOM 0 HE1 PHE A 523 32.432 30.267 27.798 1.00 0.00 H new ATOM 0 HE2 PHE A 523 29.085 30.216 25.097 1.00 0.00 H new ATOM 0 HZ PHE A 523 30.350 31.314 26.935 1.00 0.00 H new ATOM 176 N LYS A 524 33.079 24.931 27.205 1.00 0.00 N ATOM 177 CA LYS A 524 33.586 24.879 28.584 1.00 0.00 C ATOM 178 C LYS A 524 34.375 26.148 28.934 1.00 0.00 C ATOM 179 O LYS A 524 34.907 26.841 28.064 1.00 0.00 O ATOM 180 CB LYS A 524 34.437 23.622 28.772 1.00 0.00 C ATOM 181 CG LYS A 524 33.688 22.309 28.588 1.00 0.00 C ATOM 182 CD LYS A 524 34.534 21.088 28.978 1.00 0.00 C ATOM 183 CE LYS A 524 33.848 19.849 28.415 1.00 0.00 C ATOM 184 NZ LYS A 524 34.647 18.619 28.584 1.00 0.00 N ATOM 0 H LYS A 524 33.797 24.795 26.493 1.00 0.00 H new ATOM 0 HA LYS A 524 32.739 24.832 29.269 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.266 23.653 28.065 1.00 0.00 H new ATOM 0 HB3 LYS A 524 34.870 23.640 29.772 1.00 0.00 H new ATOM 0 HG2 LYS A 524 32.780 22.325 29.191 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.378 22.214 27.547 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.544 21.180 28.579 1.00 0.00 H new ATOM 0 HD3 LYS A 524 34.624 21.016 30.062 1.00 0.00 H new ATOM 0 HE2 LYS A 524 32.884 19.720 28.907 1.00 0.00 H new ATOM 0 HE3 LYS A 524 33.647 20.002 27.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.077 17.794 28.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 35.495 18.671 27.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 34.933 18.525 29.580 1.00 0.00 H new ATOM 198 N VAL A 525 34.524 26.394 30.228 1.00 0.00 N ATOM 199 CA VAL A 525 35.472 27.351 30.829 1.00 0.00 C ATOM 200 C VAL A 525 36.252 26.658 31.950 1.00 0.00 C ATOM 201 O VAL A 525 35.780 25.645 32.461 1.00 0.00 O ATOM 202 CB VAL A 525 34.767 28.622 31.340 1.00 0.00 C ATOM 203 CG1 VAL A 525 33.924 29.289 30.250 1.00 0.00 C ATOM 204 CG2 VAL A 525 33.866 28.262 32.520 1.00 0.00 C ATOM 0 H VAL A 525 33.964 25.913 30.931 1.00 0.00 H new ATOM 0 HA VAL A 525 36.168 27.677 30.056 1.00 0.00 H new ATOM 0 HB VAL A 525 35.539 29.328 31.647 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.445 30.181 30.655 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.565 29.569 29.414 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.160 28.593 29.904 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.366 29.160 32.883 1.00 0.00 H new ATOM 0 HG22 VAL A 525 33.119 27.536 32.199 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.469 27.833 33.321 1.00 0.00 H new ATOM 214 N GLN A 526 37.400 27.188 32.378 1.00 0.00 N ATOM 215 CA GLN A 526 38.120 26.685 33.558 1.00 0.00 C ATOM 216 C GLN A 526 38.435 27.809 34.556 1.00 0.00 C ATOM 217 O GLN A 526 38.989 28.840 34.171 1.00 0.00 O ATOM 218 CB GLN A 526 39.372 25.905 33.124 1.00 0.00 C ATOM 219 CG GLN A 526 39.985 25.087 34.278 1.00 0.00 C ATOM 220 CD GLN A 526 40.755 23.846 33.813 1.00 0.00 C ATOM 221 OE1 GLN A 526 41.088 23.662 32.648 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.029 22.922 34.704 1.00 0.00 N ATOM 0 H GLN A 526 37.859 27.976 31.920 1.00 0.00 H new ATOM 0 HA GLN A 526 37.470 25.990 34.091 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.113 25.234 32.305 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.117 26.603 32.741 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.657 25.728 34.849 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.189 24.777 34.955 1.00 0.00 H new ATOM 0 HE21 GLN A 526 40.760 23.057 35.678 1.00 0.00 H new ATOM 0 HE22 GLN A 526 41.511 22.069 34.422 1.00 0.00 H new ATOM 231 N ALA A 527 38.098 27.642 35.838 1.00 0.00 N ATOM 232 CA ALA A 527 38.352 28.634 36.888 1.00 0.00 C ATOM 233 C ALA A 527 39.857 28.909 37.044 1.00 0.00 C ATOM 234 O ALA A 527 40.669 27.993 37.172 1.00 0.00 O ATOM 235 CB ALA A 527 37.661 28.191 38.187 1.00 0.00 C ATOM 0 H ALA A 527 37.634 26.801 36.181 1.00 0.00 H new ATOM 0 HA ALA A 527 37.918 29.593 36.606 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.849 28.927 38.968 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.587 28.107 38.018 1.00 0.00 H new ATOM 0 HB3 ALA A 527 38.056 27.224 38.498 1.00 0.00 H new ATOM 241 N GLN A 528 40.223 30.188 37.001 1.00 0.00 N ATOM 242 CA GLN A 528 41.574 30.697 37.265 1.00 0.00 C ATOM 243 C GLN A 528 41.729 31.134 38.737 1.00 0.00 C ATOM 244 O GLN A 528 42.830 31.101 39.284 1.00 0.00 O ATOM 245 CB GLN A 528 41.843 31.896 36.339 1.00 0.00 C ATOM 246 CG GLN A 528 41.601 31.690 34.832 1.00 0.00 C ATOM 247 CD GLN A 528 42.380 30.532 34.215 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.523 30.661 33.795 1.00 0.00 O ATOM 249 NE2 GLN A 528 41.814 29.346 34.183 1.00 0.00 N ATOM 0 H GLN A 528 39.563 30.931 36.772 1.00 0.00 H new ATOM 0 HA GLN A 528 42.293 29.900 37.073 1.00 0.00 H new ATOM 0 HB2 GLN A 528 41.219 32.726 36.671 1.00 0.00 H new ATOM 0 HB3 GLN A 528 42.880 32.202 36.476 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.536 31.522 34.668 1.00 0.00 H new ATOM 0 HG3 GLN A 528 41.864 32.608 34.307 1.00 0.00 H new ATOM 0 HE21 GLN A 528 40.862 29.226 34.530 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.326 28.546 33.811 1.00 0.00 H new ATOM 258 N HIS A 529 40.614 31.502 39.379 1.00 0.00 N ATOM 259 CA HIS A 529 40.497 31.981 40.762 1.00 0.00 C ATOM 260 C HIS A 529 39.293 31.290 41.444 1.00 0.00 C ATOM 261 O HIS A 529 38.447 30.721 40.752 1.00 0.00 O ATOM 262 CB HIS A 529 40.336 33.512 40.746 1.00 0.00 C ATOM 263 CG HIS A 529 41.400 34.254 39.962 1.00 0.00 C ATOM 264 ND1 HIS A 529 42.638 34.654 40.414 1.00 0.00 N ATOM 265 CD2 HIS A 529 41.307 34.662 38.657 1.00 0.00 C ATOM 266 CE1 HIS A 529 43.270 35.285 39.410 1.00 0.00 C ATOM 267 NE2 HIS A 529 42.495 35.319 38.308 1.00 0.00 N ATOM 0 H HIS A 529 39.707 31.471 38.914 1.00 0.00 H new ATOM 0 HA HIS A 529 41.393 31.734 41.332 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.360 33.756 40.328 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.342 33.875 41.774 1.00 0.00 H new ATOM 0 HD2 HIS A 529 40.460 34.504 38.006 1.00 0.00 H new ATOM 0 HE1 HIS A 529 44.262 35.707 39.477 1.00 0.00 H new ATOM 0 HE2 HIS A 529 42.725 35.737 37.406 1.00 0.00 H new ATOM 275 N ASP A 530 39.199 31.304 42.779 1.00 0.00 N ATOM 276 CA ASP A 530 38.063 30.708 43.504 1.00 0.00 C ATOM 277 C ASP A 530 36.913 31.699 43.753 1.00 0.00 C ATOM 278 O ASP A 530 37.158 32.869 44.046 1.00 0.00 O ATOM 279 CB ASP A 530 38.486 29.989 44.799 1.00 0.00 C ATOM 280 CG ASP A 530 39.206 30.863 45.831 1.00 0.00 C ATOM 281 OD1 ASP A 530 38.536 31.435 46.723 1.00 0.00 O ATOM 282 OD2 ASP A 530 40.458 30.933 45.817 1.00 0.00 O ATOM 0 H ASP A 530 39.902 31.725 43.387 1.00 0.00 H new ATOM 0 HA ASP A 530 37.671 29.943 42.833 1.00 0.00 H new ATOM 0 HB2 ASP A 530 37.597 29.564 45.265 1.00 0.00 H new ATOM 0 HB3 ASP A 530 39.138 29.156 44.536 1.00 0.00 H new ATOM 287 N TYR A 531 35.666 31.228 43.680 1.00 0.00 N ATOM 288 CA TYR A 531 34.453 32.033 43.846 1.00 0.00 C ATOM 289 C TYR A 531 33.376 31.371 44.724 1.00 0.00 C ATOM 290 O TYR A 531 32.942 30.254 44.427 1.00 0.00 O ATOM 291 CB TYR A 531 33.890 32.430 42.471 1.00 0.00 C ATOM 292 CG TYR A 531 32.572 33.188 42.567 1.00 0.00 C ATOM 293 CD1 TYR A 531 31.352 32.526 42.333 1.00 0.00 C ATOM 294 CD2 TYR A 531 32.562 34.531 42.997 1.00 0.00 C ATOM 295 CE1 TYR A 531 30.129 33.188 42.560 1.00 0.00 C ATOM 296 CE2 TYR A 531 31.340 35.196 43.230 1.00 0.00 C ATOM 297 CZ TYR A 531 30.117 34.519 43.032 1.00 0.00 C ATOM 298 OH TYR A 531 28.929 35.130 43.308 1.00 0.00 O ATOM 0 H TYR A 531 35.466 30.245 43.498 1.00 0.00 H new ATOM 0 HA TYR A 531 34.749 32.930 44.389 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.621 33.047 41.949 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.744 31.532 41.871 1.00 0.00 H new ATOM 0 HD1 TYR A 531 31.353 31.506 41.978 1.00 0.00 H new ATOM 0 HD2 TYR A 531 33.495 35.053 43.149 1.00 0.00 H new ATOM 0 HE1 TYR A 531 29.197 32.675 42.372 1.00 0.00 H new ATOM 0 HE2 TYR A 531 31.340 36.224 43.560 1.00 0.00 H new ATOM 0 HH TYR A 531 29.096 36.043 43.624 1.00 0.00 H new ATOM 308 N THR A 532 32.916 32.059 45.773 1.00 0.00 N ATOM 309 CA THR A 532 31.801 31.613 46.630 1.00 0.00 C ATOM 310 C THR A 532 30.453 32.225 46.255 1.00 0.00 C ATOM 311 O THR A 532 30.287 33.443 46.312 1.00 0.00 O ATOM 312 CB THR A 532 32.092 31.760 48.131 1.00 0.00 C ATOM 313 OG1 THR A 532 33.416 31.378 48.427 1.00 0.00 O ATOM 314 CG2 THR A 532 31.181 30.901 49.006 1.00 0.00 C ATOM 0 H THR A 532 33.310 32.955 46.059 1.00 0.00 H new ATOM 0 HA THR A 532 31.717 30.545 46.428 1.00 0.00 H new ATOM 0 HB THR A 532 31.918 32.813 48.351 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.579 31.481 49.388 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.438 31.050 50.055 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.142 31.188 48.842 1.00 0.00 H new ATOM 0 HG23 THR A 532 31.312 29.851 48.746 1.00 0.00 H new ATOM 322 N ALA A 533 29.470 31.386 45.918 1.00 0.00 N ATOM 323 CA ALA A 533 28.149 31.836 45.475 1.00 0.00 C ATOM 324 C ALA A 533 27.388 32.566 46.592 1.00 0.00 C ATOM 325 O ALA A 533 27.047 31.985 47.629 1.00 0.00 O ATOM 326 CB ALA A 533 27.367 30.636 44.935 1.00 0.00 C ATOM 0 H ALA A 533 29.569 30.371 45.945 1.00 0.00 H new ATOM 0 HA ALA A 533 28.272 32.565 44.674 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.382 30.963 44.603 1.00 0.00 H new ATOM 0 HB2 ALA A 533 27.906 30.199 44.095 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.255 29.890 45.722 1.00 0.00 H new ATOM 332 N THR A 534 27.101 33.848 46.364 1.00 0.00 N ATOM 333 CA THR A 534 26.496 34.745 47.364 1.00 0.00 C ATOM 334 C THR A 534 24.973 34.594 47.471 1.00 0.00 C ATOM 335 O THR A 534 24.403 34.783 48.545 1.00 0.00 O ATOM 336 CB THR A 534 26.927 36.199 47.079 1.00 0.00 C ATOM 337 OG1 THR A 534 26.482 37.072 48.096 1.00 0.00 O ATOM 338 CG2 THR A 534 26.378 36.766 45.768 1.00 0.00 C ATOM 0 H THR A 534 27.282 34.304 45.470 1.00 0.00 H new ATOM 0 HA THR A 534 26.870 34.454 48.346 1.00 0.00 H new ATOM 0 HB THR A 534 28.014 36.146 47.024 1.00 0.00 H new ATOM 0 HG1 THR A 534 26.770 37.986 47.891 1.00 0.00 H new ATOM 0 HG21 THR A 534 26.726 37.791 45.641 1.00 0.00 H new ATOM 0 HG22 THR A 534 26.728 36.158 44.934 1.00 0.00 H new ATOM 0 HG23 THR A 534 25.288 36.753 45.794 1.00 0.00 H new ATOM 346 N ASP A 535 24.315 34.198 46.382 1.00 0.00 N ATOM 347 CA ASP A 535 22.864 34.279 46.174 1.00 0.00 C ATOM 348 C ASP A 535 22.211 33.083 45.464 1.00 0.00 C ATOM 349 O ASP A 535 22.866 32.083 45.151 1.00 0.00 O ATOM 350 CB ASP A 535 22.510 35.654 45.581 1.00 0.00 C ATOM 351 CG ASP A 535 22.319 36.790 46.608 1.00 0.00 C ATOM 352 OD1 ASP A 535 21.954 36.540 47.777 1.00 0.00 O ATOM 353 OD2 ASP A 535 22.428 37.983 46.239 1.00 0.00 O ATOM 0 H ASP A 535 24.799 33.792 45.581 1.00 0.00 H new ATOM 0 HA ASP A 535 22.400 34.195 47.157 1.00 0.00 H new ATOM 0 HB2 ASP A 535 23.298 35.944 44.886 1.00 0.00 H new ATOM 0 HB3 ASP A 535 21.593 35.555 45.000 1.00 0.00 H new ATOM 358 N THR A 536 20.883 33.127 45.336 1.00 0.00 N ATOM 359 CA THR A 536 20.031 31.970 45.040 1.00 0.00 C ATOM 360 C THR A 536 19.997 31.423 43.608 1.00 0.00 C ATOM 361 O THR A 536 19.416 30.356 43.392 1.00 0.00 O ATOM 362 CB THR A 536 18.652 32.150 45.692 1.00 0.00 C ATOM 363 OG1 THR A 536 18.113 30.913 46.098 1.00 0.00 O ATOM 364 CG2 THR A 536 17.674 32.861 44.763 1.00 0.00 C ATOM 0 H THR A 536 20.354 33.993 45.438 1.00 0.00 H new ATOM 0 HA THR A 536 20.548 31.133 45.509 1.00 0.00 H new ATOM 0 HB THR A 536 18.801 32.775 46.573 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.300 30.235 45.416 1.00 0.00 H new ATOM 0 HG21 THR A 536 16.711 32.968 45.262 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.064 33.847 44.510 1.00 0.00 H new ATOM 0 HG23 THR A 536 17.547 32.276 43.852 1.00 0.00 H new ATOM 372 N ASP A 537 20.655 32.080 42.645 1.00 0.00 N ATOM 373 CA ASP A 537 20.955 31.519 41.313 1.00 0.00 C ATOM 374 C ASP A 537 22.438 31.208 41.034 1.00 0.00 C ATOM 375 O ASP A 537 22.768 30.556 40.041 1.00 0.00 O ATOM 376 CB ASP A 537 20.200 32.186 40.135 1.00 0.00 C ATOM 377 CG ASP A 537 20.078 33.716 40.139 1.00 0.00 C ATOM 378 OD1 ASP A 537 20.608 34.380 39.216 1.00 0.00 O ATOM 379 OD2 ASP A 537 19.354 34.275 41.000 1.00 0.00 O ATOM 0 H ASP A 537 21.001 33.032 42.767 1.00 0.00 H new ATOM 0 HA ASP A 537 20.511 30.526 41.376 1.00 0.00 H new ATOM 0 HB2 ASP A 537 20.696 31.892 39.210 1.00 0.00 H new ATOM 0 HB3 ASP A 537 19.193 31.770 40.104 1.00 0.00 H new ATOM 384 N GLU A 538 23.340 31.654 41.910 1.00 0.00 N ATOM 385 CA GLU A 538 24.782 31.676 41.682 1.00 0.00 C ATOM 386 C GLU A 538 25.500 30.313 41.909 1.00 0.00 C ATOM 387 O GLU A 538 25.103 29.522 42.772 1.00 0.00 O ATOM 388 CB GLU A 538 25.343 32.863 42.490 1.00 0.00 C ATOM 389 CG GLU A 538 24.989 34.249 41.886 1.00 0.00 C ATOM 390 CD GLU A 538 23.502 34.683 41.846 1.00 0.00 C ATOM 391 OE1 GLU A 538 23.138 35.568 41.030 1.00 0.00 O ATOM 392 OE2 GLU A 538 22.686 34.224 42.679 1.00 0.00 O ATOM 0 H GLU A 538 23.077 32.021 42.825 1.00 0.00 H new ATOM 0 HA GLU A 538 24.990 31.830 40.623 1.00 0.00 H new ATOM 0 HB2 GLU A 538 24.960 32.812 43.509 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.427 32.769 42.552 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.539 35.005 42.447 1.00 0.00 H new ATOM 0 HG3 GLU A 538 25.368 34.271 40.864 1.00 0.00 H new ATOM 399 N LEU A 539 26.541 30.023 41.111 1.00 0.00 N ATOM 400 CA LEU A 539 27.372 28.800 41.062 1.00 0.00 C ATOM 401 C LEU A 539 28.679 28.996 41.860 1.00 0.00 C ATOM 402 O LEU A 539 29.316 30.040 41.740 1.00 0.00 O ATOM 403 CB LEU A 539 27.736 28.491 39.581 1.00 0.00 C ATOM 404 CG LEU A 539 27.737 27.018 39.112 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.391 26.879 37.745 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.475 26.072 40.050 1.00 0.00 C ATOM 0 H LEU A 539 26.855 30.701 40.416 1.00 0.00 H new ATOM 0 HA LEU A 539 26.807 27.977 41.500 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.039 29.040 38.947 1.00 0.00 H new ATOM 0 HB3 LEU A 539 28.729 28.899 39.392 1.00 0.00 H new ATOM 0 HG LEU A 539 26.683 26.741 39.088 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.378 25.833 37.440 1.00 0.00 H new ATOM 0 HD12 LEU A 539 27.842 27.476 37.017 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.422 27.229 37.798 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.431 25.058 39.653 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.516 26.384 40.136 1.00 0.00 H new ATOM 0 HD23 LEU A 539 28.007 26.096 41.034 1.00 0.00 H new ATOM 418 N GLN A 540 29.118 27.999 42.632 1.00 0.00 N ATOM 419 CA GLN A 540 30.400 28.023 43.357 1.00 0.00 C ATOM 420 C GLN A 540 31.557 27.434 42.523 1.00 0.00 C ATOM 421 O GLN A 540 31.417 26.347 41.961 1.00 0.00 O ATOM 422 CB GLN A 540 30.223 27.244 44.666 1.00 0.00 C ATOM 423 CG GLN A 540 31.423 27.405 45.615 1.00 0.00 C ATOM 424 CD GLN A 540 31.388 26.425 46.778 1.00 0.00 C ATOM 425 OE1 GLN A 540 32.109 25.432 46.827 1.00 0.00 O ATOM 426 NE2 GLN A 540 30.422 26.539 47.648 1.00 0.00 N ATOM 0 H GLN A 540 28.589 27.139 42.776 1.00 0.00 H new ATOM 0 HA GLN A 540 30.670 29.059 43.562 1.00 0.00 H new ATOM 0 HB2 GLN A 540 29.318 27.586 45.169 1.00 0.00 H new ATOM 0 HB3 GLN A 540 30.082 26.187 44.440 1.00 0.00 H new ATOM 0 HG2 GLN A 540 32.346 27.263 45.054 1.00 0.00 H new ATOM 0 HG3 GLN A 540 31.439 28.423 46.004 1.00 0.00 H new ATOM 0 HE21 GLN A 540 29.810 27.355 47.627 1.00 0.00 H new ATOM 0 HE22 GLN A 540 30.279 25.812 48.349 1.00 0.00 H new ATOM 435 N LEU A 541 32.722 28.095 42.499 1.00 0.00 N ATOM 436 CA LEU A 541 33.922 27.675 41.750 1.00 0.00 C ATOM 437 C LEU A 541 35.171 27.597 42.639 1.00 0.00 C ATOM 438 O LEU A 541 35.365 28.421 43.534 1.00 0.00 O ATOM 439 CB LEU A 541 34.174 28.642 40.568 1.00 0.00 C ATOM 440 CG LEU A 541 33.035 28.752 39.535 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.455 29.701 38.414 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.690 27.402 38.915 1.00 0.00 C ATOM 0 H LEU A 541 32.863 28.964 43.015 1.00 0.00 H new ATOM 0 HA LEU A 541 33.731 26.671 41.372 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.370 29.635 40.972 1.00 0.00 H new ATOM 0 HB3 LEU A 541 35.079 28.324 40.050 1.00 0.00 H new ATOM 0 HG LEU A 541 32.156 29.126 40.060 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.650 29.779 37.683 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.664 30.686 38.831 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.351 29.315 37.927 1.00 0.00 H new ATOM 0 HD21 LEU A 541 31.883 27.529 38.194 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.568 26.998 38.410 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.373 26.713 39.697 1.00 0.00 H new ATOM 454 N LYS A 542 36.066 26.647 42.360 1.00 0.00 N ATOM 455 CA LYS A 542 37.430 26.572 42.913 1.00 0.00 C ATOM 456 C LYS A 542 38.430 26.817 41.789 1.00 0.00 C ATOM 457 O LYS A 542 38.213 26.332 40.684 1.00 0.00 O ATOM 458 CB LYS A 542 37.590 25.183 43.565 1.00 0.00 C ATOM 459 CG LYS A 542 38.674 25.020 44.643 1.00 0.00 C ATOM 460 CD LYS A 542 40.125 24.997 44.147 1.00 0.00 C ATOM 461 CE LYS A 542 41.053 24.521 45.269 1.00 0.00 C ATOM 462 NZ LYS A 542 42.474 24.720 44.911 1.00 0.00 N ATOM 0 H LYS A 542 35.859 25.879 41.721 1.00 0.00 H new ATOM 0 HA LYS A 542 37.613 27.331 43.674 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.633 24.908 44.008 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.794 24.462 42.773 1.00 0.00 H new ATOM 0 HG2 LYS A 542 38.570 25.835 45.359 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.482 24.093 45.184 1.00 0.00 H new ATOM 0 HD2 LYS A 542 40.213 24.335 43.285 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.421 25.993 43.816 1.00 0.00 H new ATOM 0 HE2 LYS A 542 40.827 25.065 46.186 1.00 0.00 H new ATOM 0 HE3 LYS A 542 40.871 23.466 45.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 43.078 24.388 45.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 42.694 24.181 44.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 42.651 25.731 44.742 1.00 0.00 H new ATOM 476 N ALA A 543 39.522 27.540 42.044 1.00 0.00 N ATOM 477 CA ALA A 543 40.601 27.728 41.070 1.00 0.00 C ATOM 478 C ALA A 543 41.085 26.369 40.521 1.00 0.00 C ATOM 479 O ALA A 543 41.671 25.565 41.247 1.00 0.00 O ATOM 480 CB ALA A 543 41.739 28.511 41.737 1.00 0.00 C ATOM 0 H ALA A 543 39.684 28.013 42.933 1.00 0.00 H new ATOM 0 HA ALA A 543 40.235 28.299 40.217 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.548 28.657 41.022 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.368 29.481 42.068 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.111 27.952 42.596 1.00 0.00 H new ATOM 486 N GLY A 544 40.780 26.110 39.249 1.00 0.00 N ATOM 487 CA GLY A 544 41.034 24.849 38.546 1.00 0.00 C ATOM 488 C GLY A 544 39.774 24.102 38.088 1.00 0.00 C ATOM 489 O GLY A 544 39.907 23.150 37.319 1.00 0.00 O ATOM 0 H GLY A 544 40.329 26.804 38.653 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.655 25.054 37.674 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.610 24.194 39.200 1.00 0.00 H new ATOM 493 N ASP A 545 38.566 24.518 38.491 1.00 0.00 N ATOM 494 CA ASP A 545 37.309 23.863 38.115 1.00 0.00 C ATOM 495 C ASP A 545 36.897 24.082 36.659 1.00 0.00 C ATOM 496 O ASP A 545 36.683 25.228 36.257 1.00 0.00 O ATOM 497 CB ASP A 545 36.163 24.253 39.076 1.00 0.00 C ATOM 498 CG ASP A 545 36.105 23.485 40.399 1.00 0.00 C ATOM 499 OD1 ASP A 545 35.474 23.998 41.351 1.00 0.00 O ATOM 500 OD2 ASP A 545 36.582 22.326 40.477 1.00 0.00 O ATOM 0 H ASP A 545 38.434 25.329 39.095 1.00 0.00 H new ATOM 0 HA ASP A 545 37.504 22.795 38.209 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.249 25.316 39.300 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.216 24.113 38.556 1.00 0.00 H new ATOM 505 N VAL A 546 36.737 23.015 35.870 1.00 0.00 N ATOM 506 CA VAL A 546 36.038 23.110 34.580 1.00 0.00 C ATOM 507 C VAL A 546 34.537 23.309 34.800 1.00 0.00 C ATOM 508 O VAL A 546 33.935 22.622 35.631 1.00 0.00 O ATOM 509 CB VAL A 546 36.346 21.950 33.605 1.00 0.00 C ATOM 510 CG1 VAL A 546 35.869 22.273 32.189 1.00 0.00 C ATOM 511 CG2 VAL A 546 37.847 21.640 33.524 1.00 0.00 C ATOM 0 H VAL A 546 37.078 22.081 36.098 1.00 0.00 H new ATOM 0 HA VAL A 546 36.433 23.992 34.077 1.00 0.00 H new ATOM 0 HB VAL A 546 35.814 21.085 34.002 1.00 0.00 H new ATOM 0 HG11 VAL A 546 36.100 21.438 31.528 1.00 0.00 H new ATOM 0 HG12 VAL A 546 34.792 22.442 32.197 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.374 23.170 31.831 1.00 0.00 H new ATOM 0 HG21 VAL A 546 38.012 20.818 32.827 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.383 22.524 33.177 1.00 0.00 H new ATOM 0 HG23 VAL A 546 38.214 21.358 34.511 1.00 0.00 H new ATOM 521 N VAL A 547 33.924 24.228 34.054 1.00 0.00 N ATOM 522 CA VAL A 547 32.480 24.496 34.035 1.00 0.00 C ATOM 523 C VAL A 547 31.926 24.364 32.631 1.00 0.00 C ATOM 524 O VAL A 547 32.423 24.990 31.695 1.00 0.00 O ATOM 525 CB VAL A 547 32.039 25.811 34.730 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.665 25.658 35.379 1.00 0.00 C ATOM 527 CG2 VAL A 547 33.023 26.319 35.779 1.00 0.00 C ATOM 0 H VAL A 547 34.440 24.835 33.417 1.00 0.00 H new ATOM 0 HA VAL A 547 32.034 23.722 34.659 1.00 0.00 H new ATOM 0 HB VAL A 547 32.003 26.551 33.930 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.383 26.595 35.858 1.00 0.00 H new ATOM 0 HG12 VAL A 547 29.929 25.404 34.616 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.702 24.865 36.126 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.643 27.241 36.218 1.00 0.00 H new ATOM 0 HG22 VAL A 547 33.143 25.568 36.560 1.00 0.00 H new ATOM 0 HG23 VAL A 547 33.988 26.512 35.310 1.00 0.00 H new ATOM 537 N LEU A 548 30.929 23.506 32.473 1.00 0.00 N ATOM 538 CA LEU A 548 30.261 23.259 31.209 1.00 0.00 C ATOM 539 C LEU A 548 29.226 24.377 30.988 1.00 0.00 C ATOM 540 O LEU A 548 28.160 24.350 31.605 1.00 0.00 O ATOM 541 CB LEU A 548 29.604 21.865 31.261 1.00 0.00 C ATOM 542 CG LEU A 548 30.439 20.664 31.750 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.559 19.441 31.978 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.491 20.253 30.736 1.00 0.00 C ATOM 0 H LEU A 548 30.555 22.949 33.241 1.00 0.00 H new ATOM 0 HA LEU A 548 30.961 23.267 30.374 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.726 21.939 31.903 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.247 21.631 30.258 1.00 0.00 H new ATOM 0 HG LEU A 548 30.911 20.991 32.676 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.174 18.609 32.322 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.805 19.671 32.731 1.00 0.00 H new ATOM 0 HD13 LEU A 548 29.068 19.167 31.044 1.00 0.00 H new ATOM 0 HD21 LEU A 548 32.056 19.404 31.121 1.00 0.00 H new ATOM 0 HD22 LEU A 548 31.005 19.972 29.802 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.169 21.088 30.556 1.00 0.00 H new ATOM 556 N VAL A 549 29.543 25.377 30.163 1.00 0.00 N ATOM 557 CA VAL A 549 28.582 26.439 29.781 1.00 0.00 C ATOM 558 C VAL A 549 27.327 25.912 29.060 1.00 0.00 C ATOM 559 O VAL A 549 27.427 25.183 28.069 1.00 0.00 O ATOM 560 CB VAL A 549 29.251 27.563 28.970 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.365 28.804 28.876 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.577 27.970 29.623 1.00 0.00 C ATOM 0 H VAL A 549 30.464 25.482 29.738 1.00 0.00 H new ATOM 0 HA VAL A 549 28.238 26.860 30.726 1.00 0.00 H new ATOM 0 HB VAL A 549 29.420 27.172 27.967 1.00 0.00 H new ATOM 0 HG11 VAL A 549 28.875 29.572 28.295 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.426 28.544 28.388 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.161 29.182 29.878 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.041 28.766 29.040 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.390 28.325 30.637 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.245 27.109 29.657 1.00 0.00 H new ATOM 572 N ILE A 550 26.139 26.323 29.517 1.00 0.00 N ATOM 573 CA ILE A 550 24.816 25.997 28.954 1.00 0.00 C ATOM 574 C ILE A 550 24.003 27.290 28.694 1.00 0.00 C ATOM 575 O ILE A 550 24.268 28.327 29.311 1.00 0.00 O ATOM 576 CB ILE A 550 24.036 25.034 29.889 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.675 25.720 31.229 1.00 0.00 C ATOM 578 CG2 ILE A 550 24.793 23.703 30.066 1.00 0.00 C ATOM 579 CD1 ILE A 550 23.089 24.812 32.316 1.00 0.00 C ATOM 0 H ILE A 550 26.067 26.927 30.336 1.00 0.00 H new ATOM 0 HA ILE A 550 24.967 25.489 28.002 1.00 0.00 H new ATOM 0 HB ILE A 550 23.086 24.784 29.417 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.574 26.193 31.625 1.00 0.00 H new ATOM 0 HG13 ILE A 550 22.959 26.516 31.025 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.225 23.046 30.725 1.00 0.00 H new ATOM 0 HG22 ILE A 550 24.917 23.223 29.095 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.773 23.897 30.503 1.00 0.00 H new ATOM 0 HD11 ILE A 550 22.876 25.402 33.207 1.00 0.00 H new ATOM 0 HD12 ILE A 550 22.167 24.358 31.953 1.00 0.00 H new ATOM 0 HD13 ILE A 550 23.807 24.029 32.562 1.00 0.00 H new ATOM 591 N PRO A 551 23.006 27.254 27.792 1.00 0.00 N ATOM 592 CA PRO A 551 22.068 28.352 27.573 1.00 0.00 C ATOM 593 C PRO A 551 21.034 28.454 28.710 1.00 0.00 C ATOM 594 O PRO A 551 20.677 27.453 29.346 1.00 0.00 O ATOM 595 CB PRO A 551 21.421 28.060 26.215 1.00 0.00 C ATOM 596 CG PRO A 551 21.432 26.534 26.132 1.00 0.00 C ATOM 597 CD PRO A 551 22.695 26.146 26.903 1.00 0.00 C ATOM 0 HA PRO A 551 22.567 29.321 27.571 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.407 28.457 26.160 1.00 0.00 H new ATOM 0 HB3 PRO A 551 21.984 28.510 25.398 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.538 26.101 26.581 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.470 26.188 25.099 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.534 25.229 27.470 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.522 25.956 26.219 1.00 0.00 H new ATOM 605 N PHE A 552 20.545 29.671 28.951 1.00 0.00 N ATOM 606 CA PHE A 552 19.594 30.017 30.016 1.00 0.00 C ATOM 607 C PHE A 552 18.153 29.491 29.897 1.00 0.00 C ATOM 608 O PHE A 552 17.657 29.273 28.793 1.00 0.00 O ATOM 609 CB PHE A 552 19.614 31.532 30.275 1.00 0.00 C ATOM 610 CG PHE A 552 20.781 32.048 31.095 1.00 0.00 C ATOM 611 CD1 PHE A 552 22.051 32.212 30.510 1.00 0.00 C ATOM 612 CD2 PHE A 552 20.581 32.427 32.434 1.00 0.00 C ATOM 613 CE1 PHE A 552 23.110 32.763 31.256 1.00 0.00 C ATOM 614 CE2 PHE A 552 21.638 32.974 33.179 1.00 0.00 C ATOM 615 CZ PHE A 552 22.904 33.148 32.591 1.00 0.00 C ATOM 0 H PHE A 552 20.810 30.479 28.387 1.00 0.00 H new ATOM 0 HA PHE A 552 19.969 29.463 30.876 1.00 0.00 H new ATOM 0 HB2 PHE A 552 19.615 32.046 29.314 1.00 0.00 H new ATOM 0 HB3 PHE A 552 18.689 31.807 30.782 1.00 0.00 H new ATOM 0 HD1 PHE A 552 22.213 31.914 29.485 1.00 0.00 H new ATOM 0 HD2 PHE A 552 19.611 32.297 32.891 1.00 0.00 H new ATOM 0 HE1 PHE A 552 24.081 32.890 30.802 1.00 0.00 H new ATOM 0 HE2 PHE A 552 21.478 33.262 34.208 1.00 0.00 H new ATOM 0 HZ PHE A 552 23.714 33.576 33.163 1.00 0.00 H new ATOM 625 N GLN A 553 17.440 29.359 31.025 1.00 0.00 N ATOM 626 CA GLN A 553 15.999 29.044 31.044 1.00 0.00 C ATOM 627 C GLN A 553 15.080 30.226 30.677 1.00 0.00 C ATOM 628 O GLN A 553 13.896 30.019 30.405 1.00 0.00 O ATOM 629 CB GLN A 553 15.597 28.468 32.408 1.00 0.00 C ATOM 630 CG GLN A 553 15.758 29.415 33.612 1.00 0.00 C ATOM 631 CD GLN A 553 15.306 28.745 34.907 1.00 0.00 C ATOM 632 OE1 GLN A 553 14.150 28.815 35.302 1.00 0.00 O ATOM 633 NE2 GLN A 553 16.110 27.905 35.510 1.00 0.00 N ATOM 0 H GLN A 553 17.846 29.468 31.955 1.00 0.00 H new ATOM 0 HA GLN A 553 15.853 28.301 30.260 1.00 0.00 H new ATOM 0 HB2 GLN A 553 14.555 28.153 32.355 1.00 0.00 H new ATOM 0 HB3 GLN A 553 16.191 27.573 32.592 1.00 0.00 H new ATOM 0 HG2 GLN A 553 16.801 29.719 33.702 1.00 0.00 H new ATOM 0 HG3 GLN A 553 15.175 30.321 33.446 1.00 0.00 H new ATOM 0 HE21 GLN A 553 17.080 27.821 35.207 1.00 0.00 H new ATOM 0 HE22 GLN A 553 15.766 27.335 36.283 1.00 0.00 H new ATOM 642 N ASN A 554 15.606 31.454 30.686 1.00 0.00 N ATOM 643 CA ASN A 554 14.964 32.666 30.173 1.00 0.00 C ATOM 644 C ASN A 554 16.031 33.748 29.883 1.00 0.00 C ATOM 645 O ASN A 554 17.043 33.803 30.585 1.00 0.00 O ATOM 646 CB ASN A 554 13.927 33.204 31.190 1.00 0.00 C ATOM 647 CG ASN A 554 12.467 33.099 30.765 1.00 0.00 C ATOM 648 OD1 ASN A 554 12.111 32.862 29.617 1.00 0.00 O ATOM 649 ND2 ASN A 554 11.554 33.331 31.673 1.00 0.00 N ATOM 0 H ASN A 554 16.533 31.638 31.069 1.00 0.00 H new ATOM 0 HA ASN A 554 14.446 32.418 29.247 1.00 0.00 H new ATOM 0 HB2 ASN A 554 14.053 32.664 32.129 1.00 0.00 H new ATOM 0 HB3 ASN A 554 14.153 34.251 31.392 1.00 0.00 H new ATOM 0 HD21 ASN A 554 10.566 33.313 31.419 1.00 0.00 H new ATOM 0 HD22 ASN A 554 11.830 33.530 32.635 1.00 0.00 H new ATOM 656 N PRO A 555 15.796 34.669 28.934 1.00 0.00 N ATOM 657 CA PRO A 555 16.742 35.733 28.579 1.00 0.00 C ATOM 658 C PRO A 555 16.866 36.810 29.673 1.00 0.00 C ATOM 659 O PRO A 555 17.932 37.394 29.860 1.00 0.00 O ATOM 660 CB PRO A 555 16.192 36.307 27.271 1.00 0.00 C ATOM 661 CG PRO A 555 14.681 36.095 27.395 1.00 0.00 C ATOM 662 CD PRO A 555 14.566 34.787 28.173 1.00 0.00 C ATOM 0 HA PRO A 555 17.757 35.349 28.472 1.00 0.00 H new ATOM 0 HB2 PRO A 555 16.441 37.362 27.160 1.00 0.00 H new ATOM 0 HB3 PRO A 555 16.600 35.790 26.403 1.00 0.00 H new ATOM 0 HG2 PRO A 555 14.202 36.919 27.923 1.00 0.00 H new ATOM 0 HG3 PRO A 555 14.204 36.023 26.417 1.00 0.00 H new ATOM 0 HD2 PRO A 555 13.698 34.799 28.832 1.00 0.00 H new ATOM 0 HD3 PRO A 555 14.441 33.940 27.498 1.00 0.00 H new ATOM 670 N GLU A 556 15.805 37.048 30.450 1.00 0.00 N ATOM 671 CA GLU A 556 15.822 37.979 31.590 1.00 0.00 C ATOM 672 C GLU A 556 16.646 37.454 32.783 1.00 0.00 C ATOM 673 O GLU A 556 17.099 38.228 33.627 1.00 0.00 O ATOM 674 CB GLU A 556 14.373 38.288 32.003 1.00 0.00 C ATOM 675 CG GLU A 556 13.617 37.114 32.655 1.00 0.00 C ATOM 676 CD GLU A 556 12.176 37.456 33.059 1.00 0.00 C ATOM 677 OE1 GLU A 556 11.655 38.527 32.658 1.00 0.00 O ATOM 678 OE2 GLU A 556 11.538 36.641 33.767 1.00 0.00 O ATOM 0 H GLU A 556 14.901 36.598 30.307 1.00 0.00 H new ATOM 0 HA GLU A 556 16.320 38.895 31.272 1.00 0.00 H new ATOM 0 HB2 GLU A 556 14.381 39.127 32.699 1.00 0.00 H new ATOM 0 HB3 GLU A 556 13.821 38.611 31.121 1.00 0.00 H new ATOM 0 HG2 GLU A 556 13.601 36.274 31.961 1.00 0.00 H new ATOM 0 HG3 GLU A 556 14.165 36.787 33.539 1.00 0.00 H new ATOM 685 N GLU A 557 16.859 36.137 32.853 1.00 0.00 N ATOM 686 CA GLU A 557 17.636 35.490 33.914 1.00 0.00 C ATOM 687 C GLU A 557 19.154 35.598 33.701 1.00 0.00 C ATOM 688 O GLU A 557 19.925 35.509 34.663 1.00 0.00 O ATOM 689 CB GLU A 557 17.213 34.020 34.027 1.00 0.00 C ATOM 690 CG GLU A 557 15.749 33.806 34.441 1.00 0.00 C ATOM 691 CD GLU A 557 15.377 34.309 35.847 1.00 0.00 C ATOM 692 OE1 GLU A 557 14.217 34.084 36.257 1.00 0.00 O ATOM 693 OE2 GLU A 557 16.204 34.878 36.595 1.00 0.00 O ATOM 0 H GLU A 557 16.491 35.481 32.164 1.00 0.00 H new ATOM 0 HA GLU A 557 17.422 36.017 34.844 1.00 0.00 H new ATOM 0 HB2 GLU A 557 17.380 33.533 33.067 1.00 0.00 H new ATOM 0 HB3 GLU A 557 17.858 33.525 34.753 1.00 0.00 H new ATOM 0 HG2 GLU A 557 15.108 34.305 33.714 1.00 0.00 H new ATOM 0 HG3 GLU A 557 15.526 32.741 34.385 1.00 0.00 H new ATOM 700 N GLN A 558 19.576 35.819 32.450 1.00 0.00 N ATOM 701 CA GLN A 558 20.958 36.121 32.079 1.00 0.00 C ATOM 702 C GLN A 558 21.381 37.509 32.555 1.00 0.00 C ATOM 703 O GLN A 558 21.053 38.545 31.968 1.00 0.00 O ATOM 704 CB GLN A 558 21.184 35.903 30.575 1.00 0.00 C ATOM 705 CG GLN A 558 22.645 36.217 30.197 1.00 0.00 C ATOM 706 CD GLN A 558 23.171 35.517 28.946 1.00 0.00 C ATOM 707 OE1 GLN A 558 22.556 34.654 28.332 1.00 0.00 O ATOM 708 NE2 GLN A 558 24.376 35.846 28.545 1.00 0.00 N ATOM 0 H GLN A 558 18.946 35.791 31.648 1.00 0.00 H new ATOM 0 HA GLN A 558 21.611 35.419 32.597 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.948 34.872 30.312 1.00 0.00 H new ATOM 0 HB3 GLN A 558 20.509 36.541 30.004 1.00 0.00 H new ATOM 0 HG2 GLN A 558 22.741 37.294 30.056 1.00 0.00 H new ATOM 0 HG3 GLN A 558 23.284 35.947 31.038 1.00 0.00 H new ATOM 0 HE21 GLN A 558 24.902 36.563 29.045 1.00 0.00 H new ATOM 0 HE22 GLN A 558 24.787 35.385 27.733 1.00 0.00 H new ATOM 717 N ASP A 559 22.165 37.495 33.628 1.00 0.00 N ATOM 718 CA ASP A 559 22.805 38.655 34.222 1.00 0.00 C ATOM 719 C ASP A 559 23.968 39.231 33.398 1.00 0.00 C ATOM 720 O ASP A 559 24.743 38.491 32.786 1.00 0.00 O ATOM 721 CB ASP A 559 23.088 38.396 35.715 1.00 0.00 C ATOM 722 CG ASP A 559 21.813 38.480 36.561 1.00 0.00 C ATOM 723 OD1 ASP A 559 21.046 39.447 36.350 1.00 0.00 O ATOM 724 OD2 ASP A 559 21.583 37.629 37.460 1.00 0.00 O ATOM 0 H ASP A 559 22.379 36.632 34.128 1.00 0.00 H new ATOM 0 HA ASP A 559 22.103 39.488 34.189 1.00 0.00 H new ATOM 0 HB2 ASP A 559 23.538 37.410 35.834 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.814 39.124 36.079 1.00 0.00 H new ATOM 729 N GLU A 560 24.077 40.555 33.308 1.00 0.00 N ATOM 730 CA GLU A 560 25.072 41.200 32.444 1.00 0.00 C ATOM 731 C GLU A 560 26.496 41.000 32.999 1.00 0.00 C ATOM 732 O GLU A 560 26.765 41.318 34.158 1.00 0.00 O ATOM 733 CB GLU A 560 24.705 42.681 32.264 1.00 0.00 C ATOM 734 CG GLU A 560 25.524 43.364 31.163 1.00 0.00 C ATOM 735 CD GLU A 560 25.177 42.816 29.773 1.00 0.00 C ATOM 736 OE1 GLU A 560 25.875 41.880 29.303 1.00 0.00 O ATOM 737 OE2 GLU A 560 24.209 43.318 29.148 1.00 0.00 O ATOM 0 H GLU A 560 23.487 41.207 33.824 1.00 0.00 H new ATOM 0 HA GLU A 560 25.064 40.733 31.459 1.00 0.00 H new ATOM 0 HB2 GLU A 560 23.645 42.762 32.025 1.00 0.00 H new ATOM 0 HB3 GLU A 560 24.861 43.207 33.206 1.00 0.00 H new ATOM 0 HG2 GLU A 560 25.340 44.438 31.187 1.00 0.00 H new ATOM 0 HG3 GLU A 560 26.587 43.218 31.357 1.00 0.00 H new ATOM 744 N GLY A 561 27.410 40.448 32.197 1.00 0.00 N ATOM 745 CA GLY A 561 28.748 40.036 32.649 1.00 0.00 C ATOM 746 C GLY A 561 28.822 38.631 33.274 1.00 0.00 C ATOM 747 O GLY A 561 29.896 38.213 33.703 1.00 0.00 O ATOM 0 H GLY A 561 27.244 40.271 31.206 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.430 40.075 31.799 1.00 0.00 H new ATOM 0 HA3 GLY A 561 29.107 40.761 33.379 1.00 0.00 H new ATOM 751 N TRP A 562 27.702 37.898 33.339 1.00 0.00 N ATOM 752 CA TRP A 562 27.609 36.542 33.895 1.00 0.00 C ATOM 753 C TRP A 562 27.549 35.440 32.822 1.00 0.00 C ATOM 754 O TRP A 562 27.246 35.714 31.654 1.00 0.00 O ATOM 755 CB TRP A 562 26.419 36.487 34.868 1.00 0.00 C ATOM 756 CG TRP A 562 26.608 37.269 36.125 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.635 38.617 36.216 1.00 0.00 C ATOM 758 CD2 TRP A 562 27.041 36.785 37.426 1.00 0.00 C ATOM 759 NE1 TRP A 562 27.049 38.987 37.477 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.329 37.899 38.259 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.197 35.512 37.993 1.00 0.00 C ATOM 762 CZ2 TRP A 562 27.788 37.761 39.571 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.653 35.357 39.314 1.00 0.00 C ATOM 764 CH2 TRP A 562 27.952 36.476 40.105 1.00 0.00 C ATOM 0 H TRP A 562 26.807 38.245 32.995 1.00 0.00 H new ATOM 0 HA TRP A 562 28.529 36.331 34.439 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.530 36.856 34.356 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.227 35.446 35.128 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.372 39.300 35.422 1.00 0.00 H new ATOM 0 HE1 TRP A 562 27.136 39.954 37.790 1.00 0.00 H new ATOM 0 HE3 TRP A 562 26.963 34.636 37.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 28.014 38.634 40.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.774 34.365 39.724 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.306 36.348 41.117 1.00 0.00 H new ATOM 775 N LEU A 563 27.798 34.190 33.222 1.00 0.00 N ATOM 776 CA LEU A 563 27.596 32.973 32.417 1.00 0.00 C ATOM 777 C LEU A 563 26.859 31.915 33.248 1.00 0.00 C ATOM 778 O LEU A 563 27.029 31.890 34.465 1.00 0.00 O ATOM 779 CB LEU A 563 28.959 32.410 31.960 1.00 0.00 C ATOM 780 CG LEU A 563 29.531 33.000 30.660 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.888 32.354 30.369 1.00 0.00 C ATOM 782 CD2 LEU A 563 28.635 32.749 29.442 1.00 0.00 C ATOM 0 H LEU A 563 28.161 33.985 34.153 1.00 0.00 H new ATOM 0 HA LEU A 563 26.999 33.225 31.541 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.683 32.572 32.759 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.860 31.332 31.834 1.00 0.00 H new ATOM 0 HG LEU A 563 29.609 34.076 30.815 1.00 0.00 H new ATOM 0 HD11 LEU A 563 31.298 32.769 29.448 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.571 32.556 31.194 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.762 31.277 30.257 1.00 0.00 H new ATOM 0 HD21 LEU A 563 29.093 33.189 28.556 1.00 0.00 H new ATOM 0 HD22 LEU A 563 28.516 31.676 29.293 1.00 0.00 H new ATOM 0 HD23 LEU A 563 27.658 33.203 29.609 1.00 0.00 H new ATOM 794 N MET A 564 26.074 31.036 32.615 1.00 0.00 N ATOM 795 CA MET A 564 25.482 29.853 33.249 1.00 0.00 C ATOM 796 C MET A 564 26.176 28.560 32.813 1.00 0.00 C ATOM 797 O MET A 564 26.491 28.353 31.642 1.00 0.00 O ATOM 798 CB MET A 564 23.973 29.791 32.975 1.00 0.00 C ATOM 799 CG MET A 564 23.296 28.588 33.647 1.00 0.00 C ATOM 800 SD MET A 564 21.486 28.584 33.589 1.00 0.00 S ATOM 801 CE MET A 564 21.136 29.829 34.858 1.00 0.00 C ATOM 0 H MET A 564 25.828 31.129 31.629 1.00 0.00 H new ATOM 0 HA MET A 564 25.634 29.947 34.324 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.506 30.710 33.329 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.805 29.742 31.899 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.660 27.676 33.173 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.609 28.552 34.690 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.103 30.163 34.765 1.00 0.00 H new ATOM 0 HE2 MET A 564 21.289 29.395 35.846 1.00 0.00 H new ATOM 0 HE3 MET A 564 21.806 30.679 34.728 1.00 0.00 H new ATOM 811 N GLY A 565 26.359 27.643 33.756 1.00 0.00 N ATOM 812 CA GLY A 565 26.878 26.307 33.512 1.00 0.00 C ATOM 813 C GLY A 565 26.671 25.369 34.693 1.00 0.00 C ATOM 814 O GLY A 565 26.025 25.709 35.685 1.00 0.00 O ATOM 0 H GLY A 565 26.144 27.816 34.738 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.391 25.888 32.631 1.00 0.00 H new ATOM 0 HA3 GLY A 565 27.943 26.371 33.287 1.00 0.00 H new ATOM 818 N VAL A 566 27.261 24.185 34.584 1.00 0.00 N ATOM 819 CA VAL A 566 27.396 23.198 35.665 1.00 0.00 C ATOM 820 C VAL A 566 28.849 22.741 35.738 1.00 0.00 C ATOM 821 O VAL A 566 29.506 22.603 34.703 1.00 0.00 O ATOM 822 CB VAL A 566 26.402 22.032 35.473 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.672 21.238 34.188 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.426 21.045 36.646 1.00 0.00 C ATOM 0 H VAL A 566 27.677 23.867 33.709 1.00 0.00 H new ATOM 0 HA VAL A 566 27.140 23.650 36.623 1.00 0.00 H new ATOM 0 HB VAL A 566 25.423 22.508 35.412 1.00 0.00 H new ATOM 0 HG11 VAL A 566 25.946 20.430 34.100 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.584 21.900 33.326 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.678 20.820 34.223 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.710 20.244 36.462 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.426 20.622 36.745 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.160 21.566 37.566 1.00 0.00 H new ATOM 834 N LYS A 567 29.391 22.541 36.940 1.00 0.00 N ATOM 835 CA LYS A 567 30.752 22.031 37.100 1.00 0.00 C ATOM 836 C LYS A 567 30.920 20.676 36.431 1.00 0.00 C ATOM 837 O LYS A 567 30.076 19.792 36.558 1.00 0.00 O ATOM 838 CB LYS A 567 31.150 22.010 38.581 1.00 0.00 C ATOM 839 CG LYS A 567 31.768 23.371 38.944 1.00 0.00 C ATOM 840 CD LYS A 567 32.423 23.365 40.320 1.00 0.00 C ATOM 841 CE LYS A 567 31.407 23.257 41.459 1.00 0.00 C ATOM 842 NZ LYS A 567 32.106 23.170 42.759 1.00 0.00 N ATOM 0 H LYS A 567 28.906 22.725 37.818 1.00 0.00 H new ATOM 0 HA LYS A 567 31.437 22.710 36.592 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.278 21.813 39.204 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.864 21.208 38.769 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.510 23.642 38.193 1.00 0.00 H new ATOM 0 HG3 LYS A 567 30.993 24.137 38.917 1.00 0.00 H new ATOM 0 HD2 LYS A 567 33.121 22.530 40.382 1.00 0.00 H new ATOM 0 HD3 LYS A 567 33.006 24.278 40.444 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.746 24.124 41.450 1.00 0.00 H new ATOM 0 HE3 LYS A 567 30.780 22.377 41.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 31.406 23.097 43.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 32.719 22.330 42.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 32.685 24.022 42.899 1.00 0.00 H new ATOM 856 N GLU A 568 32.027 20.502 35.723 1.00 0.00 N ATOM 857 CA GLU A 568 32.288 19.260 35.015 1.00 0.00 C ATOM 858 C GLU A 568 32.354 18.067 35.968 1.00 0.00 C ATOM 859 O GLU A 568 31.751 17.049 35.648 1.00 0.00 O ATOM 860 CB GLU A 568 33.557 19.380 34.170 1.00 0.00 C ATOM 861 CG GLU A 568 33.840 18.074 33.421 1.00 0.00 C ATOM 862 CD GLU A 568 34.821 18.272 32.271 1.00 0.00 C ATOM 863 OE1 GLU A 568 35.944 18.781 32.475 1.00 0.00 O ATOM 864 OE2 GLU A 568 34.496 17.837 31.150 1.00 0.00 O ATOM 0 H GLU A 568 32.758 21.206 35.625 1.00 0.00 H new ATOM 0 HA GLU A 568 31.451 19.076 34.341 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.448 20.197 33.457 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.403 19.627 34.811 1.00 0.00 H new ATOM 0 HG2 GLU A 568 34.242 17.338 34.117 1.00 0.00 H new ATOM 0 HG3 GLU A 568 32.905 17.669 33.033 1.00 0.00 H new ATOM 871 N SER A 569 32.973 18.175 37.152 1.00 0.00 N ATOM 872 CA SER A 569 32.972 17.047 38.100 1.00 0.00 C ATOM 873 C SER A 569 31.577 16.789 38.679 1.00 0.00 C ATOM 874 O SER A 569 31.179 15.634 38.809 1.00 0.00 O ATOM 875 CB SER A 569 33.986 17.249 39.226 1.00 0.00 C ATOM 876 OG SER A 569 35.297 17.355 38.697 1.00 0.00 O ATOM 0 H SER A 569 33.469 19.007 37.472 1.00 0.00 H new ATOM 0 HA SER A 569 33.270 16.166 37.531 1.00 0.00 H new ATOM 0 HB2 SER A 569 33.740 18.150 39.788 1.00 0.00 H new ATOM 0 HB3 SER A 569 33.935 16.413 39.924 1.00 0.00 H new ATOM 0 HG SER A 569 35.935 17.486 39.429 1.00 0.00 H new ATOM 882 N ASP A 570 30.783 17.841 38.915 1.00 0.00 N ATOM 883 CA ASP A 570 29.369 17.733 39.302 1.00 0.00 C ATOM 884 C ASP A 570 28.493 16.973 38.281 1.00 0.00 C ATOM 885 O ASP A 570 27.554 16.250 38.633 1.00 0.00 O ATOM 886 CB ASP A 570 28.789 19.134 39.595 1.00 0.00 C ATOM 887 CG ASP A 570 29.178 19.781 40.927 1.00 0.00 C ATOM 888 OD1 ASP A 570 30.256 19.490 41.499 1.00 0.00 O ATOM 889 OD2 ASP A 570 28.391 20.636 41.404 1.00 0.00 O ATOM 0 H ASP A 570 31.108 18.805 38.842 1.00 0.00 H new ATOM 0 HA ASP A 570 29.345 17.129 40.209 1.00 0.00 H new ATOM 0 HB2 ASP A 570 29.096 19.803 38.791 1.00 0.00 H new ATOM 0 HB3 ASP A 570 27.702 19.066 39.556 1.00 0.00 H new ATOM 894 N TRP A 571 28.842 17.112 36.999 1.00 0.00 N ATOM 895 CA TRP A 571 28.239 16.410 35.868 1.00 0.00 C ATOM 896 C TRP A 571 28.839 15.014 35.608 1.00 0.00 C ATOM 897 O TRP A 571 28.097 14.090 35.293 1.00 0.00 O ATOM 898 CB TRP A 571 28.297 17.347 34.657 1.00 0.00 C ATOM 899 CG TRP A 571 27.770 16.798 33.368 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.491 16.192 32.396 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.375 16.585 33.008 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.646 15.712 31.413 1.00 0.00 N ATOM 903 CE2 TRP A 571 26.324 15.923 31.746 1.00 0.00 C ATOM 904 CE3 TRP A 571 25.147 16.905 33.625 1.00 0.00 C ATOM 905 CZ2 TRP A 571 25.110 15.615 31.118 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.924 16.596 33.001 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.901 15.946 31.756 1.00 0.00 C ATOM 0 H TRP A 571 29.587 17.746 36.711 1.00 0.00 H new ATOM 0 HA TRP A 571 27.199 16.179 36.097 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.739 18.252 34.897 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.334 17.644 34.504 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.567 16.097 32.389 1.00 0.00 H new ATOM 0 HE1 TRP A 571 27.959 15.261 30.554 1.00 0.00 H new ATOM 0 HE3 TRP A 571 25.146 17.393 34.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 25.103 15.128 30.154 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 22.995 16.861 33.484 1.00 0.00 H new ATOM 0 HH2 TRP A 571 22.958 15.701 31.290 1.00 0.00 H new ATOM 918 N ASN A 572 30.143 14.808 35.835 1.00 0.00 N ATOM 919 CA ASN A 572 30.863 13.520 35.741 1.00 0.00 C ATOM 920 C ASN A 572 30.488 12.559 36.900 1.00 0.00 C ATOM 921 O ASN A 572 30.655 11.343 36.792 1.00 0.00 O ATOM 922 CB ASN A 572 32.378 13.836 35.750 1.00 0.00 C ATOM 923 CG ASN A 572 33.252 12.899 34.933 1.00 0.00 C ATOM 924 OD1 ASN A 572 32.958 11.734 34.703 1.00 0.00 O ATOM 925 ND2 ASN A 572 34.372 13.404 34.469 1.00 0.00 N ATOM 0 H ASN A 572 30.762 15.573 36.104 1.00 0.00 H new ATOM 0 HA ASN A 572 30.581 13.007 34.822 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.521 14.851 35.380 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.727 13.821 36.782 1.00 0.00 H new ATOM 0 HD21 ASN A 572 35.001 12.824 33.914 1.00 0.00 H new ATOM 0 HD22 ASN A 572 34.612 14.376 34.664 1.00 0.00 H new ATOM 932 N GLN A 573 29.985 13.100 38.013 1.00 0.00 N ATOM 933 CA GLN A 573 29.323 12.375 39.113 1.00 0.00 C ATOM 934 C GLN A 573 27.813 12.146 38.865 1.00 0.00 C ATOM 935 O GLN A 573 27.136 11.474 39.645 1.00 0.00 O ATOM 936 CB GLN A 573 29.550 13.160 40.417 1.00 0.00 C ATOM 937 CG GLN A 573 31.029 13.232 40.854 1.00 0.00 C ATOM 938 CD GLN A 573 31.348 14.482 41.675 1.00 0.00 C ATOM 939 OE1 GLN A 573 30.484 15.130 42.243 1.00 0.00 O ATOM 940 NE2 GLN A 573 32.597 14.874 41.786 1.00 0.00 N ATOM 0 H GLN A 573 30.028 14.105 38.185 1.00 0.00 H new ATOM 0 HA GLN A 573 29.765 11.381 39.182 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.169 14.173 40.291 1.00 0.00 H new ATOM 0 HB3 GLN A 573 28.968 12.698 41.214 1.00 0.00 H new ATOM 0 HG2 GLN A 573 31.272 12.346 41.441 1.00 0.00 H new ATOM 0 HG3 GLN A 573 31.665 13.213 39.969 1.00 0.00 H new ATOM 0 HE21 GLN A 573 33.339 14.351 41.321 1.00 0.00 H new ATOM 0 HE22 GLN A 573 32.825 15.702 42.337 1.00 0.00 H new ATOM 949 N HIS A 574 27.283 12.720 37.778 1.00 0.00 N ATOM 950 CA HIS A 574 25.924 12.539 37.245 1.00 0.00 C ATOM 951 C HIS A 574 24.820 12.917 38.252 1.00 0.00 C ATOM 952 O HIS A 574 23.782 12.255 38.369 1.00 0.00 O ATOM 953 CB HIS A 574 25.764 11.151 36.596 1.00 0.00 C ATOM 954 CG HIS A 574 26.903 10.738 35.685 1.00 0.00 C ATOM 955 ND1 HIS A 574 27.470 11.478 34.673 1.00 0.00 N ATOM 956 CD2 HIS A 574 27.500 9.510 35.653 1.00 0.00 C ATOM 957 CE1 HIS A 574 28.427 10.743 34.087 1.00 0.00 C ATOM 958 NE2 HIS A 574 28.464 9.514 34.633 1.00 0.00 N ATOM 0 H HIS A 574 27.828 13.367 37.208 1.00 0.00 H new ATOM 0 HA HIS A 574 25.783 13.260 36.440 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.661 10.406 37.385 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.837 11.138 36.023 1.00 0.00 H new ATOM 0 HD1 HIS A 574 27.206 12.428 34.412 1.00 0.00 H new ATOM 0 HD2 HIS A 574 27.270 8.678 36.302 1.00 0.00 H new ATOM 0 HE1 HIS A 574 29.073 11.087 33.293 1.00 0.00 H new ATOM 966 N LYS A 575 25.071 13.989 39.013 1.00 0.00 N ATOM 967 CA LYS A 575 24.169 14.577 40.014 1.00 0.00 C ATOM 968 C LYS A 575 23.019 15.368 39.375 1.00 0.00 C ATOM 969 O LYS A 575 23.078 15.697 38.190 1.00 0.00 O ATOM 970 CB LYS A 575 25.006 15.460 40.954 1.00 0.00 C ATOM 971 CG LYS A 575 26.011 14.636 41.777 1.00 0.00 C ATOM 972 CD LYS A 575 27.069 15.535 42.426 1.00 0.00 C ATOM 973 CE LYS A 575 27.672 14.831 43.648 1.00 0.00 C ATOM 974 NZ LYS A 575 28.741 15.634 44.283 1.00 0.00 N ATOM 0 H LYS A 575 25.953 14.496 38.945 1.00 0.00 H new ATOM 0 HA LYS A 575 23.694 13.775 40.579 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.543 16.206 40.368 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.343 16.001 41.629 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.481 14.078 42.549 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.498 13.904 41.133 1.00 0.00 H new ATOM 0 HD2 LYS A 575 27.853 15.768 41.705 1.00 0.00 H new ATOM 0 HD3 LYS A 575 26.620 16.482 42.725 1.00 0.00 H new ATOM 0 HE2 LYS A 575 26.886 14.634 44.377 1.00 0.00 H new ATOM 0 HE3 LYS A 575 28.076 13.865 43.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 28.967 15.235 45.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 29.591 15.616 43.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 28.417 16.616 44.395 1.00 0.00 H new ATOM 988 N GLU A 576 21.998 15.695 40.168 1.00 0.00 N ATOM 989 CA GLU A 576 20.815 16.491 39.779 1.00 0.00 C ATOM 990 C GLU A 576 21.142 17.838 39.085 1.00 0.00 C ATOM 991 O GLU A 576 21.387 18.852 39.741 1.00 0.00 O ATOM 992 CB GLU A 576 19.877 16.683 40.991 1.00 0.00 C ATOM 993 CG GLU A 576 20.569 17.092 42.307 1.00 0.00 C ATOM 994 CD GLU A 576 21.085 15.936 43.188 1.00 0.00 C ATOM 995 OE1 GLU A 576 21.801 16.217 44.178 1.00 0.00 O ATOM 996 OE2 GLU A 576 20.793 14.745 42.912 1.00 0.00 O ATOM 0 H GLU A 576 21.964 15.403 41.145 1.00 0.00 H new ATOM 0 HA GLU A 576 20.300 15.911 39.013 1.00 0.00 H new ATOM 0 HB2 GLU A 576 19.137 17.442 40.739 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.335 15.753 41.160 1.00 0.00 H new ATOM 0 HG2 GLU A 576 21.410 17.741 42.065 1.00 0.00 H new ATOM 0 HG3 GLU A 576 19.867 17.685 42.894 1.00 0.00 H new ATOM 1003 N LEU A 577 21.119 17.860 37.747 1.00 0.00 N ATOM 1004 CA LEU A 577 21.591 18.959 36.891 1.00 0.00 C ATOM 1005 C LEU A 577 20.914 20.295 37.226 1.00 0.00 C ATOM 1006 O LEU A 577 21.591 21.299 37.441 1.00 0.00 O ATOM 1007 CB LEU A 577 21.331 18.552 35.425 1.00 0.00 C ATOM 1008 CG LEU A 577 21.542 19.654 34.367 1.00 0.00 C ATOM 1009 CD1 LEU A 577 22.997 20.112 34.265 1.00 0.00 C ATOM 1010 CD2 LEU A 577 21.060 19.187 32.994 1.00 0.00 C ATOM 0 H LEU A 577 20.754 17.077 37.205 1.00 0.00 H new ATOM 0 HA LEU A 577 22.655 19.120 37.062 1.00 0.00 H new ATOM 0 HB2 LEU A 577 21.983 17.713 35.181 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.305 18.192 35.346 1.00 0.00 H new ATOM 0 HG LEU A 577 20.950 20.508 34.698 1.00 0.00 H new ATOM 0 HD11 LEU A 577 23.082 20.888 33.504 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.322 20.510 35.227 1.00 0.00 H new ATOM 0 HD13 LEU A 577 23.627 19.265 33.991 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.219 19.980 32.264 1.00 0.00 H new ATOM 0 HD22 LEU A 577 21.619 18.301 32.694 1.00 0.00 H new ATOM 0 HD23 LEU A 577 19.998 18.947 33.044 1.00 0.00 H new ATOM 1022 N GLU A 578 19.581 20.305 37.325 1.00 0.00 N ATOM 1023 CA GLU A 578 18.796 21.529 37.559 1.00 0.00 C ATOM 1024 C GLU A 578 18.997 22.162 38.951 1.00 0.00 C ATOM 1025 O GLU A 578 18.596 23.309 39.177 1.00 0.00 O ATOM 1026 CB GLU A 578 17.307 21.246 37.332 1.00 0.00 C ATOM 1027 CG GLU A 578 16.968 20.828 35.892 1.00 0.00 C ATOM 1028 CD GLU A 578 15.471 20.975 35.584 1.00 0.00 C ATOM 1029 OE1 GLU A 578 14.645 21.060 36.526 1.00 0.00 O ATOM 1030 OE2 GLU A 578 15.108 21.076 34.386 1.00 0.00 O ATOM 0 H GLU A 578 19.011 19.463 37.245 1.00 0.00 H new ATOM 0 HA GLU A 578 19.168 22.259 36.840 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.988 20.458 38.014 1.00 0.00 H new ATOM 0 HB3 GLU A 578 16.734 22.138 37.586 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.543 21.437 35.194 1.00 0.00 H new ATOM 0 HG3 GLU A 578 17.270 19.792 35.735 1.00 0.00 H new ATOM 1037 N LYS A 579 19.622 21.425 39.878 1.00 0.00 N ATOM 1038 CA LYS A 579 20.047 21.899 41.205 1.00 0.00 C ATOM 1039 C LYS A 579 21.561 22.126 41.301 1.00 0.00 C ATOM 1040 O LYS A 579 22.009 22.925 42.119 1.00 0.00 O ATOM 1041 CB LYS A 579 19.590 20.900 42.280 1.00 0.00 C ATOM 1042 CG LYS A 579 18.070 20.645 42.360 1.00 0.00 C ATOM 1043 CD LYS A 579 17.209 21.917 42.468 1.00 0.00 C ATOM 1044 CE LYS A 579 15.746 21.637 42.856 1.00 0.00 C ATOM 1045 NZ LYS A 579 15.044 20.754 41.893 1.00 0.00 N ATOM 0 H LYS A 579 19.855 20.445 39.720 1.00 0.00 H new ATOM 0 HA LYS A 579 19.576 22.868 41.369 1.00 0.00 H new ATOM 0 HB2 LYS A 579 20.090 19.948 42.100 1.00 0.00 H new ATOM 0 HB3 LYS A 579 19.930 21.260 43.251 1.00 0.00 H new ATOM 0 HG2 LYS A 579 17.762 20.088 41.475 1.00 0.00 H new ATOM 0 HG3 LYS A 579 17.867 20.011 43.223 1.00 0.00 H new ATOM 0 HD2 LYS A 579 17.652 22.584 43.208 1.00 0.00 H new ATOM 0 HD3 LYS A 579 17.229 22.442 41.513 1.00 0.00 H new ATOM 0 HE2 LYS A 579 15.721 21.178 43.844 1.00 0.00 H new ATOM 0 HE3 LYS A 579 15.209 22.583 42.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 14.065 20.604 42.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 15.039 21.199 40.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 15.535 19.839 41.840 1.00 0.00 H new ATOM 1059 N CYS A 580 22.354 21.443 40.478 1.00 0.00 N ATOM 1060 CA CYS A 580 23.810 21.583 40.426 1.00 0.00 C ATOM 1061 C CYS A 580 24.298 22.771 39.576 1.00 0.00 C ATOM 1062 O CYS A 580 25.379 23.296 39.841 1.00 0.00 O ATOM 1063 CB CYS A 580 24.398 20.257 39.927 1.00 0.00 C ATOM 1064 SG CYS A 580 24.206 18.982 41.203 1.00 0.00 S ATOM 0 H CYS A 580 21.994 20.760 39.812 1.00 0.00 H new ATOM 0 HA CYS A 580 24.162 21.809 41.433 1.00 0.00 H new ATOM 0 HB2 CYS A 580 23.895 19.947 39.011 1.00 0.00 H new ATOM 0 HB3 CYS A 580 25.453 20.385 39.683 1.00 0.00 H new ATOM 0 HG CYS A 580 25.278 18.247 41.247 1.00 0.00 H new ATOM 1070 N ARG A 581 23.533 23.188 38.557 1.00 0.00 N ATOM 1071 CA ARG A 581 23.843 24.350 37.701 1.00 0.00 C ATOM 1072 C ARG A 581 23.694 25.688 38.434 1.00 0.00 C ATOM 1073 O ARG A 581 22.996 25.780 39.444 1.00 0.00 O ATOM 1074 CB ARG A 581 22.972 24.307 36.429 1.00 0.00 C ATOM 1075 CG ARG A 581 21.489 24.614 36.700 1.00 0.00 C ATOM 1076 CD ARG A 581 20.644 24.416 35.440 1.00 0.00 C ATOM 1077 NE ARG A 581 19.233 24.714 35.729 1.00 0.00 N ATOM 1078 CZ ARG A 581 18.162 24.422 35.019 1.00 0.00 C ATOM 1079 NH1 ARG A 581 18.188 23.792 33.886 1.00 0.00 N ATOM 1080 NH2 ARG A 581 16.993 24.749 35.468 1.00 0.00 N ATOM 0 H ARG A 581 22.664 22.721 38.297 1.00 0.00 H new ATOM 0 HA ARG A 581 24.894 24.280 37.420 1.00 0.00 H new ATOM 0 HB2 ARG A 581 23.359 25.026 35.707 1.00 0.00 H new ATOM 0 HB3 ARG A 581 23.055 23.321 35.973 1.00 0.00 H new ATOM 0 HG2 ARG A 581 21.120 23.965 37.494 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.386 25.640 37.053 1.00 0.00 H new ATOM 0 HD2 ARG A 581 21.006 25.066 34.644 1.00 0.00 H new ATOM 0 HD3 ARG A 581 20.742 23.391 35.084 1.00 0.00 H new ATOM 0 HE ARG A 581 19.059 25.216 36.600 1.00 0.00 H new ATOM 0 HH11 ARG A 581 19.078 23.489 33.491 1.00 0.00 H new ATOM 0 HH12 ARG A 581 17.318 23.599 33.390 1.00 0.00 H new ATOM 0 HH21 ARG A 581 16.907 25.228 36.364 1.00 0.00 H new ATOM 0 HH22 ARG A 581 16.158 24.527 34.926 1.00 0.00 H new ATOM 1094 N GLY A 582 24.304 26.730 37.874 1.00 0.00 N ATOM 1095 CA GLY A 582 24.227 28.109 38.372 1.00 0.00 C ATOM 1096 C GLY A 582 24.895 29.145 37.472 1.00 0.00 C ATOM 1097 O GLY A 582 25.552 28.802 36.486 1.00 0.00 O ATOM 0 H GLY A 582 24.882 26.640 37.038 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.178 28.378 38.498 1.00 0.00 H new ATOM 0 HA3 GLY A 582 24.688 28.152 39.359 1.00 0.00 H new ATOM 1101 N VAL A 583 24.748 30.420 37.843 1.00 0.00 N ATOM 1102 CA VAL A 583 25.437 31.563 37.228 1.00 0.00 C ATOM 1103 C VAL A 583 26.735 31.927 37.949 1.00 0.00 C ATOM 1104 O VAL A 583 26.788 31.978 39.172 1.00 0.00 O ATOM 1105 CB VAL A 583 24.515 32.780 37.020 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.244 32.425 36.252 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.080 33.437 38.327 1.00 0.00 C ATOM 0 H VAL A 583 24.127 30.696 38.604 1.00 0.00 H new ATOM 0 HA VAL A 583 25.725 31.233 36.230 1.00 0.00 H new ATOM 0 HB VAL A 583 25.126 33.476 36.445 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.630 33.317 36.133 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.510 32.033 35.270 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.684 31.670 36.804 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.433 34.287 38.109 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.537 32.713 38.935 1.00 0.00 H new ATOM 0 HG23 VAL A 583 24.959 33.781 38.872 1.00 0.00 H new ATOM 1117 N PHE A 584 27.788 32.217 37.193 1.00 0.00 N ATOM 1118 CA PHE A 584 29.102 32.628 37.699 1.00 0.00 C ATOM 1119 C PHE A 584 29.686 33.865 36.993 1.00 0.00 C ATOM 1120 O PHE A 584 29.337 34.126 35.834 1.00 0.00 O ATOM 1121 CB PHE A 584 30.091 31.458 37.689 1.00 0.00 C ATOM 1122 CG PHE A 584 30.242 30.784 36.343 1.00 0.00 C ATOM 1123 CD1 PHE A 584 31.267 31.191 35.469 1.00 0.00 C ATOM 1124 CD2 PHE A 584 29.352 29.768 35.958 1.00 0.00 C ATOM 1125 CE1 PHE A 584 31.409 30.570 34.218 1.00 0.00 C ATOM 1126 CE2 PHE A 584 29.508 29.132 34.716 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.541 29.526 33.853 1.00 0.00 C ATOM 0 H PHE A 584 27.754 32.172 36.175 1.00 0.00 H new ATOM 0 HA PHE A 584 28.937 32.934 38.732 1.00 0.00 H new ATOM 0 HB2 PHE A 584 31.067 31.819 38.013 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.767 30.717 38.419 1.00 0.00 H new ATOM 0 HD1 PHE A 584 31.944 31.980 35.760 1.00 0.00 H new ATOM 0 HD2 PHE A 584 28.548 29.476 36.617 1.00 0.00 H new ATOM 0 HE1 PHE A 584 32.183 30.893 33.538 1.00 0.00 H new ATOM 0 HE2 PHE A 584 28.833 28.340 34.426 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.670 29.026 32.905 1.00 0.00 H new ATOM 1137 N PRO A 585 30.590 34.621 37.647 1.00 0.00 N ATOM 1138 CA PRO A 585 31.368 35.660 36.984 1.00 0.00 C ATOM 1139 C PRO A 585 32.330 35.026 35.975 1.00 0.00 C ATOM 1140 O PRO A 585 33.333 34.411 36.340 1.00 0.00 O ATOM 1141 CB PRO A 585 32.096 36.395 38.109 1.00 0.00 C ATOM 1142 CG PRO A 585 32.245 35.341 39.206 1.00 0.00 C ATOM 1143 CD PRO A 585 30.980 34.506 39.050 1.00 0.00 C ATOM 0 HA PRO A 585 30.754 36.355 36.411 1.00 0.00 H new ATOM 0 HB2 PRO A 585 33.066 36.768 37.780 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.525 37.256 38.458 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.145 34.741 39.070 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.311 35.794 40.195 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.164 33.466 39.320 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.189 34.870 39.706 1.00 0.00 H new ATOM 1151 N GLU A 586 32.039 35.187 34.684 1.00 0.00 N ATOM 1152 CA GLU A 586 32.856 34.671 33.573 1.00 0.00 C ATOM 1153 C GLU A 586 34.343 35.069 33.679 1.00 0.00 C ATOM 1154 O GLU A 586 35.226 34.306 33.271 1.00 0.00 O ATOM 1155 CB GLU A 586 32.239 35.179 32.257 1.00 0.00 C ATOM 1156 CG GLU A 586 32.408 36.695 32.056 1.00 0.00 C ATOM 1157 CD GLU A 586 31.527 37.284 30.945 1.00 0.00 C ATOM 1158 OE1 GLU A 586 31.035 36.536 30.069 1.00 0.00 O ATOM 1159 OE2 GLU A 586 31.337 38.525 30.904 1.00 0.00 O ATOM 0 H GLU A 586 31.210 35.691 34.369 1.00 0.00 H new ATOM 0 HA GLU A 586 32.847 33.582 33.610 1.00 0.00 H new ATOM 0 HB2 GLU A 586 32.700 34.654 31.420 1.00 0.00 H new ATOM 0 HB3 GLU A 586 31.177 34.933 32.242 1.00 0.00 H new ATOM 0 HG2 GLU A 586 32.179 37.202 32.993 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.452 36.906 31.826 1.00 0.00 H new ATOM 1166 N ASN A 587 34.616 36.230 34.286 1.00 0.00 N ATOM 1167 CA ASN A 587 35.937 36.809 34.515 1.00 0.00 C ATOM 1168 C ASN A 587 36.781 36.068 35.572 1.00 0.00 C ATOM 1169 O ASN A 587 37.999 36.255 35.615 1.00 0.00 O ATOM 1170 CB ASN A 587 35.783 38.312 34.827 1.00 0.00 C ATOM 1171 CG ASN A 587 34.799 38.658 35.934 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.627 38.316 35.883 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.218 39.385 36.939 1.00 0.00 N ATOM 0 H ASN A 587 33.872 36.824 34.651 1.00 0.00 H new ATOM 0 HA ASN A 587 36.511 36.687 33.597 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.761 38.710 35.098 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.472 38.823 33.916 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.567 39.663 37.674 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.195 39.674 36.987 1.00 0.00 H new ATOM 1180 N PHE A 588 36.183 35.181 36.376 1.00 0.00 N ATOM 1181 CA PHE A 588 36.911 34.206 37.200 1.00 0.00 C ATOM 1182 C PHE A 588 37.484 32.985 36.466 1.00 0.00 C ATOM 1183 O PHE A 588 38.316 32.257 37.009 1.00 0.00 O ATOM 1184 CB PHE A 588 36.107 33.798 38.444 1.00 0.00 C ATOM 1185 CG PHE A 588 36.077 34.808 39.580 1.00 0.00 C ATOM 1186 CD1 PHE A 588 36.594 34.459 40.842 1.00 0.00 C ATOM 1187 CD2 PHE A 588 35.485 36.074 39.403 1.00 0.00 C ATOM 1188 CE1 PHE A 588 36.504 35.361 41.918 1.00 0.00 C ATOM 1189 CE2 PHE A 588 35.391 36.973 40.479 1.00 0.00 C ATOM 1190 CZ PHE A 588 35.896 36.614 41.739 1.00 0.00 C ATOM 0 H PHE A 588 35.170 35.118 36.475 1.00 0.00 H new ATOM 0 HA PHE A 588 37.800 34.753 37.515 1.00 0.00 H new ATOM 0 HB2 PHE A 588 35.081 33.595 38.138 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.517 32.863 38.826 1.00 0.00 H new ATOM 0 HD1 PHE A 588 37.061 33.496 40.985 1.00 0.00 H new ATOM 0 HD2 PHE A 588 35.101 36.356 38.434 1.00 0.00 H new ATOM 0 HE1 PHE A 588 36.903 35.089 42.884 1.00 0.00 H new ATOM 0 HE2 PHE A 588 34.931 37.940 40.337 1.00 0.00 H new ATOM 0 HZ PHE A 588 35.817 37.300 42.569 1.00 0.00 H new ATOM 1200 N THR A 589 37.034 32.747 35.230 1.00 0.00 N ATOM 1201 CA THR A 589 37.364 31.576 34.412 1.00 0.00 C ATOM 1202 C THR A 589 38.027 31.972 33.091 1.00 0.00 C ATOM 1203 O THR A 589 38.130 33.157 32.768 1.00 0.00 O ATOM 1204 CB THR A 589 36.102 30.734 34.160 1.00 0.00 C ATOM 1205 OG1 THR A 589 35.143 31.446 33.404 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.415 30.204 35.426 1.00 0.00 C ATOM 0 H THR A 589 36.404 33.392 34.753 1.00 0.00 H new ATOM 0 HA THR A 589 38.086 30.975 34.965 1.00 0.00 H new ATOM 0 HB THR A 589 36.475 29.872 33.606 1.00 0.00 H new ATOM 0 HG1 THR A 589 35.349 32.404 33.433 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.536 29.623 35.147 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.109 29.570 35.978 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.112 31.042 36.053 1.00 0.00 H new ATOM 1214 N GLU A 590 38.496 30.987 32.329 1.00 0.00 N ATOM 1215 CA GLU A 590 38.994 31.169 30.961 1.00 0.00 C ATOM 1216 C GLU A 590 38.255 30.234 30.001 1.00 0.00 C ATOM 1217 O GLU A 590 38.001 29.077 30.337 1.00 0.00 O ATOM 1218 CB GLU A 590 40.519 30.964 30.896 1.00 0.00 C ATOM 1219 CG GLU A 590 40.984 29.496 30.935 1.00 0.00 C ATOM 1220 CD GLU A 590 42.504 29.358 31.064 1.00 0.00 C ATOM 1221 OE1 GLU A 590 43.264 30.300 30.737 1.00 0.00 O ATOM 1222 OE2 GLU A 590 42.988 28.314 31.571 1.00 0.00 O ATOM 0 H GLU A 590 38.543 30.019 32.648 1.00 0.00 H new ATOM 0 HA GLU A 590 38.796 32.195 30.650 1.00 0.00 H new ATOM 0 HB2 GLU A 590 40.893 31.423 29.981 1.00 0.00 H new ATOM 0 HB3 GLU A 590 40.977 31.496 31.730 1.00 0.00 H new ATOM 0 HG2 GLU A 590 40.505 28.990 31.774 1.00 0.00 H new ATOM 0 HG3 GLU A 590 40.654 28.991 30.027 1.00 0.00 H new ATOM 1229 N ARG A 591 37.931 30.719 28.801 1.00 0.00 N ATOM 1230 CA ARG A 591 37.392 29.918 27.693 1.00 0.00 C ATOM 1231 C ARG A 591 38.420 28.866 27.257 1.00 0.00 C ATOM 1232 O ARG A 591 39.494 29.197 26.751 1.00 0.00 O ATOM 1233 CB ARG A 591 36.996 30.877 26.553 1.00 0.00 C ATOM 1234 CG ARG A 591 36.424 30.195 25.300 1.00 0.00 C ATOM 1235 CD ARG A 591 35.040 29.613 25.470 1.00 0.00 C ATOM 1236 NE ARG A 591 34.573 29.054 24.186 1.00 0.00 N ATOM 1237 CZ ARG A 591 33.770 29.618 23.303 1.00 0.00 C ATOM 1238 NH1 ARG A 591 33.278 30.813 23.428 1.00 0.00 N ATOM 1239 NH2 ARG A 591 33.438 28.994 22.215 1.00 0.00 N ATOM 0 H ARG A 591 38.038 31.705 28.564 1.00 0.00 H new ATOM 0 HA ARG A 591 36.502 29.369 28.001 1.00 0.00 H new ATOM 0 HB2 ARG A 591 36.258 31.584 26.933 1.00 0.00 H new ATOM 0 HB3 ARG A 591 37.873 31.456 26.265 1.00 0.00 H new ATOM 0 HG2 ARG A 591 36.400 30.921 24.487 1.00 0.00 H new ATOM 0 HG3 ARG A 591 37.103 29.398 24.996 1.00 0.00 H new ATOM 0 HD2 ARG A 591 35.054 28.835 26.233 1.00 0.00 H new ATOM 0 HD3 ARG A 591 34.351 30.384 25.814 1.00 0.00 H new ATOM 0 HE ARG A 591 34.911 28.120 23.953 1.00 0.00 H new ATOM 0 HH11 ARG A 591 33.507 31.376 24.247 1.00 0.00 H new ATOM 0 HH12 ARG A 591 32.662 31.189 22.707 1.00 0.00 H new ATOM 0 HH21 ARG A 591 33.798 28.057 22.034 1.00 0.00 H new ATOM 0 HH22 ARG A 591 32.817 29.440 21.540 1.00 0.00 H new ATOM 1253 N VAL A 592 38.080 27.593 27.452 1.00 0.00 N ATOM 1254 CA VAL A 592 38.904 26.436 27.050 1.00 0.00 C ATOM 1255 C VAL A 592 38.413 25.926 25.681 1.00 0.00 C ATOM 1256 O VAL A 592 37.243 26.129 25.332 1.00 0.00 O ATOM 1257 CB VAL A 592 38.825 25.307 28.101 1.00 0.00 C ATOM 1258 CG1 VAL A 592 39.774 25.597 29.267 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.426 25.071 28.662 1.00 0.00 C ATOM 0 H VAL A 592 37.206 27.323 27.903 1.00 0.00 H new ATOM 0 HA VAL A 592 39.946 26.748 26.978 1.00 0.00 H new ATOM 0 HB VAL A 592 39.116 24.401 27.570 1.00 0.00 H new ATOM 0 HG11 VAL A 592 39.707 24.793 29.999 1.00 0.00 H new ATOM 0 HG12 VAL A 592 40.796 25.665 28.896 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.495 26.540 29.737 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.459 24.263 29.392 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.069 25.981 29.144 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.750 24.800 27.851 1.00 0.00 H new ATOM 1269 N PRO A 593 39.273 25.262 24.884 1.00 0.00 N ATOM 1270 CA PRO A 593 38.946 24.776 23.536 1.00 0.00 C ATOM 1271 C PRO A 593 37.923 23.632 23.539 1.00 0.00 C ATOM 1272 O PRO A 593 37.820 22.902 24.551 1.00 0.00 O ATOM 1273 CB PRO A 593 40.286 24.370 22.911 1.00 0.00 C ATOM 1274 CG PRO A 593 41.153 24.004 24.114 1.00 0.00 C ATOM 1275 CD PRO A 593 40.656 24.944 25.211 1.00 0.00 C ATOM 1276 OXT PRO A 593 37.203 23.476 22.529 1.00 0.00 O ATOM 0 HA PRO A 593 38.454 25.553 22.951 1.00 0.00 H new ATOM 0 HB2 PRO A 593 40.171 23.527 22.230 1.00 0.00 H new ATOM 0 HB3 PRO A 593 40.723 25.187 22.336 1.00 0.00 H new ATOM 0 HG2 PRO A 593 41.029 22.958 24.395 1.00 0.00 H new ATOM 0 HG3 PRO A 593 42.212 24.155 23.906 1.00 0.00 H new ATOM 0 HD2 PRO A 593 40.724 24.469 26.190 1.00 0.00 H new ATOM 0 HD3 PRO A 593 41.263 25.848 25.252 1.00 0.00 H new TER 1284 PRO A 593 ATOM 1285 N SER B1728 46.408 39.404 46.471 1.00 0.00 N ATOM 1286 CA SER B1728 46.733 40.328 45.365 1.00 0.00 C ATOM 1287 C SER B1728 46.042 39.952 44.056 1.00 0.00 C ATOM 1288 O SER B1728 45.834 38.774 43.776 1.00 0.00 O ATOM 1289 CB SER B1728 48.248 40.363 45.142 1.00 0.00 C ATOM 1290 OG SER B1728 48.732 39.037 45.144 1.00 0.00 O ATOM 0 HA SER B1728 46.366 41.311 45.659 1.00 0.00 H new ATOM 0 HB2 SER B1728 48.480 40.849 44.195 1.00 0.00 H new ATOM 0 HB3 SER B1728 48.733 40.944 45.926 1.00 0.00 H new ATOM 0 HG SER B1728 48.116 38.465 45.647 1.00 0.00 H new ATOM 1298 N THR B1729 45.709 40.958 43.233 1.00 0.00 N ATOM 1299 CA THR B1729 45.350 40.849 41.797 1.00 0.00 C ATOM 1300 C THR B1729 44.179 39.916 41.483 1.00 0.00 C ATOM 1301 O THR B1729 44.115 39.306 40.415 1.00 0.00 O ATOM 1302 CB THR B1729 46.582 40.644 40.889 1.00 0.00 C ATOM 1303 OG1 THR B1729 47.164 39.370 41.063 1.00 0.00 O ATOM 1304 CG2 THR B1729 47.683 41.666 41.159 1.00 0.00 C ATOM 0 H THR B1729 45.679 41.923 43.561 1.00 0.00 H new ATOM 0 HA THR B1729 44.948 41.830 41.542 1.00 0.00 H new ATOM 0 HB THR B1729 46.199 40.758 39.875 1.00 0.00 H new ATOM 0 HG1 THR B1729 47.939 39.280 40.470 1.00 0.00 H new ATOM 0 HG21 THR B1729 48.526 41.477 40.494 1.00 0.00 H new ATOM 0 HG22 THR B1729 47.299 42.670 40.981 1.00 0.00 H new ATOM 0 HG23 THR B1729 48.012 41.581 42.195 1.00 0.00 H new ATOM 1312 N VAL B1730 43.216 39.839 42.400 1.00 0.00 N ATOM 1313 CA VAL B1730 41.978 39.045 42.233 1.00 0.00 C ATOM 1314 C VAL B1730 40.892 39.733 41.379 1.00 0.00 C ATOM 1315 O VAL B1730 40.758 40.957 41.453 1.00 0.00 O ATOM 1316 CB VAL B1730 41.431 38.481 43.565 1.00 0.00 C ATOM 1317 CG1 VAL B1730 42.542 37.979 44.496 1.00 0.00 C ATOM 1318 CG2 VAL B1730 40.572 39.480 44.346 1.00 0.00 C ATOM 0 H VAL B1730 43.264 40.328 43.294 1.00 0.00 H new ATOM 0 HA VAL B1730 42.287 38.181 41.644 1.00 0.00 H new ATOM 0 HB VAL B1730 40.804 37.645 43.255 1.00 0.00 H new ATOM 0 HG11 VAL B1730 42.100 37.594 45.415 1.00 0.00 H new ATOM 0 HG12 VAL B1730 43.100 37.184 44.001 1.00 0.00 H new ATOM 0 HG13 VAL B1730 43.217 38.801 44.734 1.00 0.00 H new ATOM 0 HG21 VAL B1730 40.223 39.016 45.269 1.00 0.00 H new ATOM 0 HG22 VAL B1730 41.166 40.362 44.586 1.00 0.00 H new ATOM 0 HG23 VAL B1730 39.715 39.774 43.741 1.00 0.00 H new ATOM 1328 N PRO B1731 40.096 38.995 40.580 1.00 0.00 N ATOM 1329 CA PRO B1731 38.946 39.548 39.852 1.00 0.00 C ATOM 1330 C PRO B1731 37.763 39.912 40.772 1.00 0.00 C ATOM 1331 O PRO B1731 37.733 39.544 41.951 1.00 0.00 O ATOM 1332 CB PRO B1731 38.564 38.466 38.835 1.00 0.00 C ATOM 1333 CG PRO B1731 38.978 37.175 39.531 1.00 0.00 C ATOM 1334 CD PRO B1731 40.243 37.577 40.283 1.00 0.00 C ATOM 0 HA PRO B1731 39.206 40.492 39.374 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.497 38.480 38.613 1.00 0.00 H new ATOM 0 HB3 PRO B1731 39.088 38.600 37.889 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.203 36.816 40.209 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.171 36.376 38.816 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.355 36.996 41.198 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.132 37.394 39.679 1.00 0.00 H new ATOM 1342 N VAL B1732 36.764 40.617 40.224 1.00 0.00 N ATOM 1343 CA VAL B1732 35.545 41.058 40.941 1.00 0.00 C ATOM 1344 C VAL B1732 34.260 40.754 40.165 1.00 0.00 C ATOM 1345 O VAL B1732 34.143 41.104 38.988 1.00 0.00 O ATOM 1346 CB VAL B1732 35.607 42.545 41.359 1.00 0.00 C ATOM 1347 CG1 VAL B1732 34.481 42.899 42.340 1.00 0.00 C ATOM 1348 CG2 VAL B1732 36.942 42.927 42.016 1.00 0.00 C ATOM 0 H VAL B1732 36.775 40.907 39.246 1.00 0.00 H new ATOM 0 HA VAL B1732 35.515 40.466 41.856 1.00 0.00 H new ATOM 0 HB VAL B1732 35.496 43.107 40.432 1.00 0.00 H new ATOM 0 HG11 VAL B1732 34.554 43.952 42.613 1.00 0.00 H new ATOM 0 HG12 VAL B1732 33.516 42.713 41.869 1.00 0.00 H new ATOM 0 HG13 VAL B1732 34.572 42.284 43.236 1.00 0.00 H new ATOM 0 HG21 VAL B1732 36.925 43.983 42.287 1.00 0.00 H new ATOM 0 HG22 VAL B1732 37.092 42.324 42.912 1.00 0.00 H new ATOM 0 HG23 VAL B1732 37.757 42.745 41.316 1.00 0.00 H new ATOM 1358 N ALA B1733 33.283 40.101 40.796 1.00 0.00 N ATOM 1359 CA ALA B1733 32.038 39.698 40.137 1.00 0.00 C ATOM 1360 C ALA B1733 31.159 40.908 39.732 1.00 0.00 C ATOM 1361 O ALA B1733 31.008 41.838 40.536 1.00 0.00 O ATOM 1362 CB ALA B1733 31.275 38.733 41.047 1.00 0.00 C ATOM 0 H ALA B1733 33.332 39.836 41.780 1.00 0.00 H new ATOM 0 HA ALA B1733 32.295 39.192 39.206 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.348 38.430 40.561 1.00 0.00 H new ATOM 0 HB2 ALA B1733 31.888 37.852 41.239 1.00 0.00 H new ATOM 0 HB3 ALA B1733 31.045 39.228 41.991 1.00 0.00 H new ATOM 1368 N PRO B1734 30.566 40.927 38.520 1.00 0.00 N ATOM 1369 CA PRO B1734 29.798 42.073 38.024 1.00 0.00 C ATOM 1370 C PRO B1734 28.379 42.177 38.633 1.00 0.00 C ATOM 1371 O PRO B1734 27.870 41.194 39.184 1.00 0.00 O ATOM 1372 CB PRO B1734 29.790 41.927 36.499 1.00 0.00 C ATOM 1373 CG PRO B1734 30.007 40.439 36.236 1.00 0.00 C ATOM 1374 CD PRO B1734 30.695 39.901 37.489 1.00 0.00 C ATOM 0 HA PRO B1734 30.260 43.012 38.330 1.00 0.00 H new ATOM 0 HB2 PRO B1734 28.845 42.267 36.076 1.00 0.00 H new ATOM 0 HB3 PRO B1734 30.578 42.526 36.042 1.00 0.00 H new ATOM 0 HG2 PRO B1734 29.060 39.929 36.058 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.624 40.282 35.351 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.233 38.969 37.813 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.744 39.684 37.290 1.00 0.00 H new ATOM 1382 N PRO B1735 27.715 43.349 38.550 1.00 0.00 N ATOM 1383 CA PRO B1735 26.381 43.563 39.116 1.00 0.00 C ATOM 1384 C PRO B1735 25.274 42.831 38.335 1.00 0.00 C ATOM 1385 O PRO B1735 25.101 43.019 37.127 1.00 0.00 O ATOM 1386 CB PRO B1735 26.176 45.081 39.119 1.00 0.00 C ATOM 1387 CG PRO B1735 27.050 45.566 37.965 1.00 0.00 C ATOM 1388 CD PRO B1735 28.223 44.586 37.972 1.00 0.00 C ATOM 0 HA PRO B1735 26.316 43.146 40.121 1.00 0.00 H new ATOM 0 HB2 PRO B1735 25.129 45.344 38.967 1.00 0.00 H new ATOM 0 HB3 PRO B1735 26.481 45.525 40.067 1.00 0.00 H new ATOM 0 HG2 PRO B1735 26.513 45.543 37.017 1.00 0.00 H new ATOM 0 HG3 PRO B1735 27.383 46.593 38.117 1.00 0.00 H new ATOM 0 HD2 PRO B1735 28.597 44.419 36.962 1.00 0.00 H new ATOM 0 HD3 PRO B1735 29.054 44.977 38.559 1.00 0.00 H new ATOM 1396 N ARG B1736 24.483 42.023 39.051 1.00 0.00 N ATOM 1397 CA ARG B1736 23.274 41.345 38.542 1.00 0.00 C ATOM 1398 C ARG B1736 22.089 42.315 38.461 1.00 0.00 C ATOM 1399 O ARG B1736 22.078 43.334 39.154 1.00 0.00 O ATOM 1400 CB ARG B1736 22.952 40.122 39.416 1.00 0.00 C ATOM 1401 CG ARG B1736 24.081 39.068 39.415 1.00 0.00 C ATOM 1402 CD ARG B1736 24.667 38.794 40.804 1.00 0.00 C ATOM 1403 NE ARG B1736 23.659 38.219 41.705 1.00 0.00 N ATOM 1404 CZ ARG B1736 23.223 38.691 42.855 1.00 0.00 C ATOM 1405 NH1 ARG B1736 23.693 39.766 43.422 1.00 0.00 N ATOM 1406 NH2 ARG B1736 22.275 38.059 43.472 1.00 0.00 N ATOM 0 H ARG B1736 24.668 41.813 40.032 1.00 0.00 H new ATOM 0 HA ARG B1736 23.467 40.996 37.528 1.00 0.00 H new ATOM 0 HB2 ARG B1736 22.770 40.451 40.439 1.00 0.00 H new ATOM 0 HB3 ARG B1736 22.031 39.660 39.061 1.00 0.00 H new ATOM 0 HG2 ARG B1736 23.696 38.136 39.002 1.00 0.00 H new ATOM 0 HG3 ARG B1736 24.879 39.404 38.753 1.00 0.00 H new ATOM 0 HD2 ARG B1736 25.512 38.111 40.716 1.00 0.00 H new ATOM 0 HD3 ARG B1736 25.050 39.722 41.229 1.00 0.00 H new ATOM 0 HE ARG B1736 23.242 37.339 41.400 1.00 0.00 H new ATOM 0 HH11 ARG B1736 24.442 40.293 42.973 1.00 0.00 H new ATOM 0 HH12 ARG B1736 23.312 40.080 44.315 1.00 0.00 H new ATOM 0 HH21 ARG B1736 21.879 37.211 43.066 1.00 0.00 H new ATOM 0 HH22 ARG B1736 21.925 38.409 44.364 1.00 0.00 H new ATOM 1420 N ARG B1737 21.107 42.043 37.596 1.00 0.00 N ATOM 1421 CA ARG B1737 20.085 43.031 37.187 1.00 0.00 C ATOM 1422 C ARG B1737 18.654 42.587 37.527 1.00 0.00 C ATOM 1423 O ARG B1737 18.401 41.400 37.739 1.00 0.00 O ATOM 1424 CB ARG B1737 20.247 43.356 35.687 1.00 0.00 C ATOM 1425 CG ARG B1737 21.682 43.679 35.215 1.00 0.00 C ATOM 1426 CD ARG B1737 22.337 44.872 35.928 1.00 0.00 C ATOM 1427 NE ARG B1737 23.744 45.035 35.503 1.00 0.00 N ATOM 1428 CZ ARG B1737 24.259 46.030 34.800 1.00 0.00 C ATOM 1429 NH1 ARG B1737 23.560 47.033 34.365 1.00 0.00 N ATOM 1430 NH2 ARG B1737 25.515 46.058 34.481 1.00 0.00 N ATOM 0 H ARG B1737 20.992 41.131 37.154 1.00 0.00 H new ATOM 0 HA ARG B1737 20.250 43.940 37.765 1.00 0.00 H new ATOM 0 HB2 ARG B1737 19.878 42.508 35.110 1.00 0.00 H new ATOM 0 HB3 ARG B1737 19.607 44.206 35.449 1.00 0.00 H new ATOM 0 HG2 ARG B1737 22.306 42.797 35.362 1.00 0.00 H new ATOM 0 HG3 ARG B1737 21.661 43.879 34.144 1.00 0.00 H new ATOM 0 HD2 ARG B1737 21.779 45.782 35.709 1.00 0.00 H new ATOM 0 HD3 ARG B1737 22.294 44.724 37.007 1.00 0.00 H new ATOM 0 HE ARG B1737 24.390 44.297 35.784 1.00 0.00 H new ATOM 0 HH11 ARG B1737 22.560 47.081 34.561 1.00 0.00 H new ATOM 0 HH12 ARG B1737 24.010 47.773 33.827 1.00 0.00 H new ATOM 0 HH21 ARG B1737 26.132 45.300 34.773 1.00 0.00 H new ATOM 0 HH22 ARG B1737 25.886 46.838 33.938 1.00 0.00 H new ATOM 1444 N ARG B1738 17.707 43.531 37.577 1.00 0.00 N ATOM 1445 CA ARG B1738 16.281 43.253 37.861 1.00 0.00 C ATOM 1446 C ARG B1738 15.670 42.251 36.867 1.00 0.00 C ATOM 1447 O ARG B1738 15.977 42.318 35.675 1.00 0.00 O ATOM 1448 CB ARG B1738 15.473 44.570 37.909 1.00 0.00 C ATOM 1449 CG ARG B1738 14.979 45.163 36.569 1.00 0.00 C ATOM 1450 CD ARG B1738 16.068 45.550 35.559 1.00 0.00 C ATOM 1451 NE ARG B1738 16.879 46.691 36.017 1.00 0.00 N ATOM 1452 CZ ARG B1738 17.998 47.117 35.453 1.00 0.00 C ATOM 1453 NH1 ARG B1738 18.529 46.527 34.418 1.00 0.00 N ATOM 1454 NH2 ARG B1738 18.622 48.158 35.911 1.00 0.00 N ATOM 0 H ARG B1738 17.903 44.520 37.421 1.00 0.00 H new ATOM 0 HA ARG B1738 16.228 42.781 38.842 1.00 0.00 H new ATOM 0 HB2 ARG B1738 14.602 44.406 38.544 1.00 0.00 H new ATOM 0 HB3 ARG B1738 16.089 45.323 38.401 1.00 0.00 H new ATOM 0 HG2 ARG B1738 14.315 44.438 36.097 1.00 0.00 H new ATOM 0 HG3 ARG B1738 14.382 46.049 36.785 1.00 0.00 H new ATOM 0 HD2 ARG B1738 16.718 44.693 35.384 1.00 0.00 H new ATOM 0 HD3 ARG B1738 15.603 45.798 34.605 1.00 0.00 H new ATOM 0 HE ARG B1738 16.550 47.196 36.840 1.00 0.00 H new ATOM 0 HH11 ARG B1738 18.080 45.705 34.014 1.00 0.00 H new ATOM 0 HH12 ARG B1738 19.393 46.887 34.013 1.00 0.00 H new ATOM 0 HH21 ARG B1738 18.251 48.661 36.717 1.00 0.00 H new ATOM 0 HH22 ARG B1738 19.483 48.473 35.465 1.00 0.00 H new ATOM 1468 N ARG B1739 14.764 41.369 37.311 1.00 0.00 N ATOM 1469 CA ARG B1739 13.869 40.602 36.417 1.00 0.00 C ATOM 1470 C ARG B1739 12.551 40.192 37.085 1.00 0.00 C ATOM 1471 O ARG B1739 12.470 40.073 38.308 1.00 0.00 O ATOM 1472 CB ARG B1739 14.600 39.410 35.757 1.00 0.00 C ATOM 1473 CG ARG B1739 14.713 38.080 36.519 1.00 0.00 C ATOM 1474 CD ARG B1739 15.346 38.143 37.910 1.00 0.00 C ATOM 1475 NE ARG B1739 16.709 38.701 37.914 1.00 0.00 N ATOM 1476 CZ ARG B1739 17.854 38.067 37.745 1.00 0.00 C ATOM 1477 NH1 ARG B1739 17.979 36.832 37.360 1.00 0.00 N ATOM 1478 NH2 ARG B1739 18.945 38.719 37.964 1.00 0.00 N ATOM 0 H ARG B1739 14.627 41.163 38.300 1.00 0.00 H new ATOM 0 HA ARG B1739 13.583 41.282 35.615 1.00 0.00 H new ATOM 0 HB2 ARG B1739 14.101 39.203 34.810 1.00 0.00 H new ATOM 0 HB3 ARG B1739 15.612 39.738 35.519 1.00 0.00 H new ATOM 0 HG2 ARG B1739 13.713 37.657 36.618 1.00 0.00 H new ATOM 0 HG3 ARG B1739 15.294 37.386 35.911 1.00 0.00 H new ATOM 0 HD2 ARG B1739 14.713 38.747 38.561 1.00 0.00 H new ATOM 0 HD3 ARG B1739 15.372 37.139 38.334 1.00 0.00 H new ATOM 0 HE ARG B1739 16.777 39.707 38.067 1.00 0.00 H new ATOM 0 HH11 ARG B1739 17.149 36.273 37.162 1.00 0.00 H new ATOM 0 HH12 ARG B1739 18.907 36.422 37.256 1.00 0.00 H new ATOM 0 HH21 ARG B1739 18.906 39.695 38.258 1.00 0.00 H new ATOM 0 HH22 ARG B1739 19.847 38.259 37.843 1.00 0.00 H new ATOM 1492 N GLY B1740 11.510 39.989 36.275 1.00 0.00 N ATOM 1493 CA GLY B1740 10.173 39.583 36.731 1.00 0.00 C ATOM 1494 C GLY B1740 9.441 40.617 37.602 1.00 0.00 C ATOM 1495 O GLY B1740 8.612 40.234 38.435 1.00 0.00 O ATOM 0 H GLY B1740 11.571 40.104 35.263 1.00 0.00 H new ATOM 0 HA2 GLY B1740 9.558 39.366 35.857 1.00 0.00 H new ATOM 0 HA3 GLY B1740 10.264 38.655 37.295 1.00 0.00 H new ATOM 1499 N ARG B1741 9.772 41.910 37.478 1.00 0.00 N ATOM 1500 CA ARG B1741 9.263 42.998 38.332 1.00 0.00 C ATOM 1501 C ARG B1741 7.804 43.350 38.008 1.00 0.00 C ATOM 1502 O ARG B1741 7.462 43.574 36.844 1.00 0.00 O ATOM 1503 CB ARG B1741 10.230 44.194 38.218 1.00 0.00 C ATOM 1504 CG ARG B1741 9.836 45.403 39.080 1.00 0.00 C ATOM 1505 CD ARG B1741 11.001 46.392 39.230 1.00 0.00 C ATOM 1506 NE ARG B1741 10.583 47.578 40.003 1.00 0.00 N ATOM 1507 CZ ARG B1741 10.182 48.741 39.523 1.00 0.00 C ATOM 1508 NH1 ARG B1741 10.226 49.042 38.259 1.00 0.00 N ATOM 1509 NH2 ARG B1741 9.704 49.643 40.328 1.00 0.00 N ATOM 0 H ARG B1741 10.419 42.239 36.762 1.00 0.00 H new ATOM 0 HA ARG B1741 9.236 42.677 39.373 1.00 0.00 H new ATOM 0 HB2 ARG B1741 11.230 43.868 38.504 1.00 0.00 H new ATOM 0 HB3 ARG B1741 10.283 44.507 37.175 1.00 0.00 H new ATOM 0 HG2 ARG B1741 8.983 45.910 38.629 1.00 0.00 H new ATOM 0 HG3 ARG B1741 9.519 45.061 40.065 1.00 0.00 H new ATOM 0 HD2 ARG B1741 11.838 45.903 39.729 1.00 0.00 H new ATOM 0 HD3 ARG B1741 11.353 46.699 38.245 1.00 0.00 H new ATOM 0 HE ARG B1741 10.606 47.490 41.019 1.00 0.00 H new ATOM 0 HH11 ARG B1741 10.583 48.364 37.586 1.00 0.00 H new ATOM 0 HH12 ARG B1741 9.903 49.956 37.941 1.00 0.00 H new ATOM 0 HH21 ARG B1741 9.639 49.452 41.328 1.00 0.00 H new ATOM 0 HH22 ARG B1741 9.394 50.542 39.960 1.00 0.00 H new ATOM 1523 N ASN B1742 6.949 43.415 39.032 1.00 0.00 N ATOM 1524 CA ASN B1742 5.506 43.678 38.910 1.00 0.00 C ATOM 1525 C ASN B1742 4.917 44.271 40.208 1.00 0.00 C ATOM 1526 O ASN B1742 5.226 43.796 41.299 1.00 0.00 O ATOM 1527 CB ASN B1742 4.788 42.375 38.482 1.00 0.00 C ATOM 1528 CG ASN B1742 3.313 42.346 38.857 1.00 0.00 C ATOM 1529 OD1 ASN B1742 2.471 42.940 38.197 1.00 0.00 O ATOM 1530 ND2 ASN B1742 2.963 41.662 39.918 1.00 0.00 N ATOM 0 H ASN B1742 7.247 43.283 39.999 1.00 0.00 H new ATOM 0 HA ASN B1742 5.346 44.434 38.141 1.00 0.00 H new ATOM 0 HB2 ASN B1742 4.883 42.254 37.403 1.00 0.00 H new ATOM 0 HB3 ASN B1742 5.289 41.524 38.944 1.00 0.00 H new ATOM 0 HD21 ASN B1742 1.983 41.622 40.199 1.00 0.00 H new ATOM 0 HD22 ASN B1742 3.670 41.169 40.463 1.00 0.00 H new ATOM 1537 N LEU B1743 4.039 45.271 40.080 1.00 0.00 N ATOM 1538 CA LEU B1743 3.303 45.930 41.172 1.00 0.00 C ATOM 1539 C LEU B1743 1.852 46.235 40.747 1.00 0.00 C ATOM 1540 O LEU B1743 1.546 46.244 39.549 1.00 0.00 O ATOM 1541 CB LEU B1743 4.029 47.230 41.579 1.00 0.00 C ATOM 1542 CG LEU B1743 5.452 47.062 42.145 1.00 0.00 C ATOM 1543 CD1 LEU B1743 6.085 48.437 42.341 1.00 0.00 C ATOM 1544 CD2 LEU B1743 5.450 46.344 43.495 1.00 0.00 C ATOM 0 H LEU B1743 3.808 45.665 39.168 1.00 0.00 H new ATOM 0 HA LEU B1743 3.270 45.257 42.028 1.00 0.00 H new ATOM 0 HB2 LEU B1743 4.081 47.881 40.707 1.00 0.00 H new ATOM 0 HB3 LEU B1743 3.422 47.743 42.324 1.00 0.00 H new ATOM 0 HG LEU B1743 6.018 46.463 41.431 1.00 0.00 H new ATOM 0 HD11 LEU B1743 7.092 48.320 42.741 1.00 0.00 H new ATOM 0 HD12 LEU B1743 6.133 48.955 41.383 1.00 0.00 H new ATOM 0 HD13 LEU B1743 5.482 49.019 43.038 1.00 0.00 H new ATOM 0 HD21 LEU B1743 6.474 46.247 43.857 1.00 0.00 H new ATOM 0 HD22 LEU B1743 4.864 46.919 44.212 1.00 0.00 H new ATOM 0 HD23 LEU B1743 5.011 45.353 43.379 1.00 0.00 H new ATOM 1556 N THR B1744 0.966 46.509 41.714 1.00 0.00 N ATOM 1557 CA THR B1744 -0.472 46.797 41.479 1.00 0.00 C ATOM 1558 C THR B1744 -0.813 47.918 40.498 1.00 0.00 C ATOM 1559 O THR B1744 -1.631 47.683 39.573 1.00 0.00 O ATOM 1560 CB THR B1744 -1.315 46.902 42.764 1.00 0.00 C ATOM 1561 OG1 THR B1744 -0.784 46.124 43.817 1.00 0.00 O ATOM 1562 CG2 THR B1744 -2.751 46.428 42.561 1.00 0.00 C ATOM 1563 OXT THR B1744 -0.278 49.039 40.668 1.00 0.00 O ATOM 0 H THR B1744 1.224 46.539 42.700 1.00 0.00 H new ATOM 0 HA THR B1744 -0.768 45.888 40.955 1.00 0.00 H new ATOM 0 HB THR B1744 -1.294 47.962 43.017 1.00 0.00 H new ATOM 0 HG1 THR B1744 -1.348 46.221 44.612 1.00 0.00 H new ATOM 0 HG21 THR B1744 -3.301 46.523 43.497 1.00 0.00 H new ATOM 0 HG22 THR B1744 -3.230 47.037 41.795 1.00 0.00 H new ATOM 0 HG23 THR B1744 -2.749 45.385 42.246 1.00 0.00 H new TER 1571 THR B1744