USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=16 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 569 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 573 GLN : amide:sc= 0.695 K(o=0.69,f=0) USER MOD Single : A 522 MET CE :methyl -170:sc=-0.00627 (180deg=-0.0502) USER MOD Single : A 524 LYS NZ :NH3+ -137:sc= 0.314 (180deg=-0.00147) USER MOD Single : A 526 GLN : amide:sc= 0.458 K(o=0.46,f=-0.047) USER MOD Single : A 528 GLN : amide:sc= 0.696 K(o=0.7,f=0) USER MOD Single : A 529 HIS : no HD1:sc=-0.00407 X(o=-0.0041,f=-0.0041) USER MOD Single : A 531 TYR OH : rot 33:sc= 1.3 USER MOD Single : A 532 THR OG1 : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot -44:sc= 0.24 USER MOD Single : A 536 THR OG1 : rot -22:sc= 0.0296 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= -2.79! C(o=-2.8!,f=-7!) USER MOD Single : A 554 ASN : amide:sc= 0.774 K(o=0.77,f=-0.94) USER MOD Single : A 558 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 564 MET CE :methyl 135:sc= -0.431 (180deg=-1.01) USER MOD Single : A 567 LYS NZ :NH3+ -109:sc= 1.05 (180deg=-0.0133) USER MOD Single : A 572 ASN : amide:sc= 0.165 K(o=0.17,f=-7.1!) USER MOD Single : A 574 HIS : no HD1:sc= -0.47 X(o=-0.47,f=-0.019) USER MOD Single : A 575 LYS NZ :NH3+ -157:sc= 1.25 (180deg=0.655) USER MOD Single : A 579 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0195) USER MOD Single : A 580 CYS SG : rot -23:sc= 0.0299 USER MOD Single : A 587 ASN : amide:sc= 0.546 K(o=0.55,f=-3.1!) USER MOD Single : A 589 THR OG1 : rot -23:sc= 0.806 USER MOD Single : B1728 SER OG : rot -25:sc= 0.0509 USER MOD Single : B1729 THR OG1 : rot 180:sc= 0 USER MOD Single : B1742 ASN : amide:sc= -0.223 K(o=-0.22,f=-2.9!) USER MOD Single : B1744 THR OG1 : rot 180:sc= 0.0164 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 513 36.948 10.873 32.492 1.00 0.00 N ATOM 2 CA GLY A 513 35.562 10.609 32.909 1.00 0.00 C ATOM 3 C GLY A 513 34.669 10.427 31.699 1.00 0.00 C ATOM 4 O GLY A 513 35.141 9.999 30.644 1.00 0.00 O ATOM 0 HA2 GLY A 513 35.527 9.715 33.532 1.00 0.00 H new ATOM 0 HA3 GLY A 513 35.195 11.436 33.518 1.00 0.00 H new ATOM 10 N ARG A 514 33.370 10.722 31.840 1.00 0.00 N ATOM 11 CA ARG A 514 32.369 10.488 30.784 1.00 0.00 C ATOM 12 C ARG A 514 32.375 11.569 29.700 1.00 0.00 C ATOM 13 O ARG A 514 32.594 12.750 29.981 1.00 0.00 O ATOM 14 CB ARG A 514 30.978 10.272 31.397 1.00 0.00 C ATOM 15 CG ARG A 514 30.231 11.544 31.840 1.00 0.00 C ATOM 16 CD ARG A 514 29.032 11.130 32.699 1.00 0.00 C ATOM 17 NE ARG A 514 28.040 12.205 32.885 1.00 0.00 N ATOM 18 CZ ARG A 514 26.814 12.241 32.395 1.00 0.00 C ATOM 19 NH1 ARG A 514 26.412 11.448 31.447 1.00 0.00 N ATOM 20 NH2 ARG A 514 25.959 13.087 32.887 1.00 0.00 N ATOM 0 H ARG A 514 32.980 11.130 32.690 1.00 0.00 H new ATOM 0 HA ARG A 514 32.651 9.571 30.268 1.00 0.00 H new ATOM 0 HB2 ARG A 514 30.360 9.746 30.669 1.00 0.00 H new ATOM 0 HB3 ARG A 514 31.081 9.616 32.261 1.00 0.00 H new ATOM 0 HG2 ARG A 514 30.896 12.196 32.407 1.00 0.00 H new ATOM 0 HG3 ARG A 514 29.896 12.109 30.970 1.00 0.00 H new ATOM 0 HD2 ARG A 514 28.543 10.272 32.237 1.00 0.00 H new ATOM 0 HD3 ARG A 514 29.390 10.805 33.676 1.00 0.00 H new ATOM 0 HE ARG A 514 28.330 13.003 33.450 1.00 0.00 H new ATOM 0 HH11 ARG A 514 27.053 10.761 31.050 1.00 0.00 H new ATOM 0 HH12 ARG A 514 25.455 11.512 31.100 1.00 0.00 H new ATOM 0 HH21 ARG A 514 26.238 13.713 33.642 1.00 0.00 H new ATOM 0 HH22 ARG A 514 25.009 13.125 32.518 1.00 0.00 H new ATOM 34 N LEU A 515 32.105 11.173 28.461 1.00 0.00 N ATOM 35 CA LEU A 515 32.093 12.035 27.278 1.00 0.00 C ATOM 36 C LEU A 515 30.815 12.885 27.142 1.00 0.00 C ATOM 37 O LEU A 515 30.902 14.024 26.679 1.00 0.00 O ATOM 38 CB LEU A 515 32.326 11.127 26.055 1.00 0.00 C ATOM 39 CG LEU A 515 32.455 11.840 24.695 1.00 0.00 C ATOM 40 CD1 LEU A 515 33.659 12.784 24.651 1.00 0.00 C ATOM 41 CD2 LEU A 515 32.646 10.782 23.609 1.00 0.00 C ATOM 0 H LEU A 515 31.879 10.203 28.241 1.00 0.00 H new ATOM 0 HA LEU A 515 32.887 12.777 27.365 1.00 0.00 H new ATOM 0 HB2 LEU A 515 33.233 10.548 26.226 1.00 0.00 H new ATOM 0 HB3 LEU A 515 31.501 10.417 25.993 1.00 0.00 H new ATOM 0 HG LEU A 515 31.551 12.428 24.539 1.00 0.00 H new ATOM 0 HD11 LEU A 515 33.710 13.264 23.674 1.00 0.00 H new ATOM 0 HD12 LEU A 515 33.553 13.545 25.424 1.00 0.00 H new ATOM 0 HD13 LEU A 515 34.573 12.216 24.824 1.00 0.00 H new ATOM 0 HD21 LEU A 515 32.739 11.269 22.639 1.00 0.00 H new ATOM 0 HD22 LEU A 515 33.549 10.208 23.815 1.00 0.00 H new ATOM 0 HD23 LEU A 515 31.786 10.113 23.598 1.00 0.00 H new ATOM 53 N ASP A 516 29.647 12.367 27.540 1.00 0.00 N ATOM 54 CA ASP A 516 28.342 13.014 27.311 1.00 0.00 C ATOM 55 C ASP A 516 28.221 14.358 28.069 1.00 0.00 C ATOM 56 O ASP A 516 28.775 14.541 29.159 1.00 0.00 O ATOM 57 CB ASP A 516 27.200 12.059 27.714 1.00 0.00 C ATOM 58 CG ASP A 516 25.817 12.522 27.228 1.00 0.00 C ATOM 59 OD1 ASP A 516 25.742 13.161 26.149 1.00 0.00 O ATOM 60 OD2 ASP A 516 24.794 12.206 27.886 1.00 0.00 O ATOM 0 H ASP A 516 29.577 11.478 28.035 1.00 0.00 H new ATOM 0 HA ASP A 516 28.264 13.237 26.247 1.00 0.00 H new ATOM 0 HB2 ASP A 516 27.406 11.068 27.310 1.00 0.00 H new ATOM 0 HB3 ASP A 516 27.182 11.964 28.800 1.00 0.00 H new ATOM 65 N LEU A 517 27.473 15.302 27.495 1.00 0.00 N ATOM 66 CA LEU A 517 27.379 16.711 27.896 1.00 0.00 C ATOM 67 C LEU A 517 25.911 17.180 28.006 1.00 0.00 C ATOM 68 O LEU A 517 25.010 16.536 27.459 1.00 0.00 O ATOM 69 CB LEU A 517 28.184 17.561 26.892 1.00 0.00 C ATOM 70 CG LEU A 517 29.709 17.515 27.108 1.00 0.00 C ATOM 71 CD1 LEU A 517 30.361 18.589 26.256 1.00 0.00 C ATOM 72 CD2 LEU A 517 30.159 17.845 28.532 1.00 0.00 C ATOM 0 H LEU A 517 26.881 15.094 26.691 1.00 0.00 H new ATOM 0 HA LEU A 517 27.804 16.834 28.892 1.00 0.00 H new ATOM 0 HB2 LEU A 517 27.961 17.219 25.882 1.00 0.00 H new ATOM 0 HB3 LEU A 517 27.850 18.596 26.959 1.00 0.00 H new ATOM 0 HG LEU A 517 29.994 16.492 26.862 1.00 0.00 H new ATOM 0 HD11 LEU A 517 31.441 18.564 26.402 1.00 0.00 H new ATOM 0 HD12 LEU A 517 30.133 18.408 25.206 1.00 0.00 H new ATOM 0 HD13 LEU A 517 29.978 19.567 26.547 1.00 0.00 H new ATOM 0 HD21 LEU A 517 31.246 17.789 28.592 1.00 0.00 H new ATOM 0 HD22 LEU A 517 29.833 18.852 28.792 1.00 0.00 H new ATOM 0 HD23 LEU A 517 29.719 17.130 29.227 1.00 0.00 H new ATOM 84 N PRO A 518 25.651 18.278 28.742 1.00 0.00 N ATOM 85 CA PRO A 518 24.303 18.748 29.060 1.00 0.00 C ATOM 86 C PRO A 518 23.536 19.278 27.835 1.00 0.00 C ATOM 87 O PRO A 518 24.149 19.648 26.824 1.00 0.00 O ATOM 88 CB PRO A 518 24.482 19.809 30.154 1.00 0.00 C ATOM 89 CG PRO A 518 25.900 20.321 29.925 1.00 0.00 C ATOM 90 CD PRO A 518 26.640 19.096 29.422 1.00 0.00 C ATOM 0 HA PRO A 518 23.680 17.924 29.406 1.00 0.00 H new ATOM 0 HB2 PRO A 518 23.747 20.608 30.062 1.00 0.00 H new ATOM 0 HB3 PRO A 518 24.365 19.382 31.150 1.00 0.00 H new ATOM 0 HG2 PRO A 518 25.922 21.131 29.196 1.00 0.00 H new ATOM 0 HG3 PRO A 518 26.341 20.707 30.844 1.00 0.00 H new ATOM 0 HD2 PRO A 518 27.445 19.378 28.744 1.00 0.00 H new ATOM 0 HD3 PRO A 518 27.096 18.550 30.248 1.00 0.00 H new ATOM 98 N PRO A 519 22.193 19.332 27.909 1.00 0.00 N ATOM 99 CA PRO A 519 21.345 19.708 26.783 1.00 0.00 C ATOM 100 C PRO A 519 21.635 21.139 26.321 1.00 0.00 C ATOM 101 O PRO A 519 21.658 22.080 27.119 1.00 0.00 O ATOM 102 CB PRO A 519 19.902 19.532 27.268 1.00 0.00 C ATOM 103 CG PRO A 519 20.015 19.709 28.781 1.00 0.00 C ATOM 104 CD PRO A 519 21.373 19.081 29.088 1.00 0.00 C ATOM 0 HA PRO A 519 21.535 19.084 25.910 1.00 0.00 H new ATOM 0 HB2 PRO A 519 19.236 20.272 26.825 1.00 0.00 H new ATOM 0 HB3 PRO A 519 19.507 18.550 27.006 1.00 0.00 H new ATOM 0 HG2 PRO A 519 19.979 20.759 29.070 1.00 0.00 H new ATOM 0 HG3 PRO A 519 19.206 19.205 29.310 1.00 0.00 H new ATOM 0 HD2 PRO A 519 21.819 19.525 29.978 1.00 0.00 H new ATOM 0 HD3 PRO A 519 21.277 18.012 29.279 1.00 0.00 H new ATOM 112 N GLY A 520 21.876 21.310 25.023 1.00 0.00 N ATOM 113 CA GLY A 520 22.228 22.605 24.438 1.00 0.00 C ATOM 114 C GLY A 520 23.651 23.107 24.731 1.00 0.00 C ATOM 115 O GLY A 520 23.936 24.239 24.332 1.00 0.00 O ATOM 0 H GLY A 520 21.833 20.551 24.343 1.00 0.00 H new ATOM 0 HA2 GLY A 520 22.101 22.541 23.357 1.00 0.00 H new ATOM 0 HA3 GLY A 520 21.519 23.350 24.799 1.00 0.00 H new ATOM 119 N PHE A 521 24.530 22.326 25.390 1.00 0.00 N ATOM 120 CA PHE A 521 25.929 22.684 25.671 1.00 0.00 C ATOM 121 C PHE A 521 26.660 23.498 24.590 1.00 0.00 C ATOM 122 O PHE A 521 26.590 23.149 23.405 1.00 0.00 O ATOM 123 CB PHE A 521 26.734 21.443 26.089 1.00 0.00 C ATOM 124 CG PHE A 521 28.237 21.648 26.161 1.00 0.00 C ATOM 125 CD1 PHE A 521 28.836 21.949 27.399 1.00 0.00 C ATOM 126 CD2 PHE A 521 29.034 21.564 25.001 1.00 0.00 C ATOM 127 CE1 PHE A 521 30.226 22.150 27.475 1.00 0.00 C ATOM 128 CE2 PHE A 521 30.422 21.777 25.079 1.00 0.00 C ATOM 129 CZ PHE A 521 31.020 22.043 26.321 1.00 0.00 C ATOM 0 H PHE A 521 24.277 21.406 25.750 1.00 0.00 H new ATOM 0 HA PHE A 521 25.865 23.383 26.505 1.00 0.00 H new ATOM 0 HB2 PHE A 521 26.380 21.111 27.065 1.00 0.00 H new ATOM 0 HB3 PHE A 521 26.525 20.639 25.384 1.00 0.00 H new ATOM 0 HD1 PHE A 521 28.229 22.025 28.289 1.00 0.00 H new ATOM 0 HD2 PHE A 521 28.577 21.335 24.049 1.00 0.00 H new ATOM 0 HE1 PHE A 521 30.684 22.387 28.424 1.00 0.00 H new ATOM 0 HE2 PHE A 521 31.027 21.736 24.185 1.00 0.00 H new ATOM 0 HZ PHE A 521 32.091 22.165 26.389 1.00 0.00 H new ATOM 139 N MET A 522 27.371 24.553 24.995 1.00 0.00 N ATOM 140 CA MET A 522 28.075 25.458 24.077 1.00 0.00 C ATOM 141 C MET A 522 29.592 25.252 24.131 1.00 0.00 C ATOM 142 O MET A 522 30.234 24.964 23.116 1.00 0.00 O ATOM 143 CB MET A 522 27.709 26.918 24.396 1.00 0.00 C ATOM 144 CG MET A 522 26.192 27.136 24.406 1.00 0.00 C ATOM 145 SD MET A 522 25.625 28.859 24.398 1.00 0.00 S ATOM 146 CE MET A 522 26.292 29.441 25.979 1.00 0.00 C ATOM 0 H MET A 522 27.477 24.807 25.977 1.00 0.00 H new ATOM 0 HA MET A 522 27.755 25.226 23.061 1.00 0.00 H new ATOM 0 HB2 MET A 522 28.122 27.192 25.367 1.00 0.00 H new ATOM 0 HB3 MET A 522 28.166 27.577 23.658 1.00 0.00 H new ATOM 0 HG2 MET A 522 25.769 26.633 23.537 1.00 0.00 H new ATOM 0 HG3 MET A 522 25.782 26.645 25.289 1.00 0.00 H new ATOM 0 HE1 MET A 522 25.883 30.425 26.206 1.00 0.00 H new ATOM 0 HE2 MET A 522 26.017 28.742 26.769 1.00 0.00 H new ATOM 0 HE3 MET A 522 27.378 29.506 25.914 1.00 0.00 H new ATOM 156 N PHE A 523 30.162 25.402 25.326 1.00 0.00 N ATOM 157 CA PHE A 523 31.597 25.363 25.583 1.00 0.00 C ATOM 158 C PHE A 523 31.963 25.087 27.038 1.00 0.00 C ATOM 159 O PHE A 523 31.103 25.133 27.905 1.00 0.00 O ATOM 160 CB PHE A 523 32.291 26.629 25.062 1.00 0.00 C ATOM 161 CG PHE A 523 31.691 27.965 25.459 1.00 0.00 C ATOM 162 CD1 PHE A 523 32.173 28.636 26.599 1.00 0.00 C ATOM 163 CD2 PHE A 523 30.693 28.566 24.671 1.00 0.00 C ATOM 164 CE1 PHE A 523 31.645 29.888 26.958 1.00 0.00 C ATOM 165 CE2 PHE A 523 30.147 29.808 25.044 1.00 0.00 C ATOM 166 CZ PHE A 523 30.630 30.475 26.182 1.00 0.00 C ATOM 0 H PHE A 523 29.614 25.560 26.172 1.00 0.00 H new ATOM 0 HA PHE A 523 31.970 24.506 25.023 1.00 0.00 H new ATOM 0 HB2 PHE A 523 33.327 26.610 25.402 1.00 0.00 H new ATOM 0 HB3 PHE A 523 32.312 26.579 23.973 1.00 0.00 H new ATOM 0 HD1 PHE A 523 32.951 28.187 27.199 1.00 0.00 H new ATOM 0 HD2 PHE A 523 30.344 28.072 23.776 1.00 0.00 H new ATOM 0 HE1 PHE A 523 32.020 30.400 27.832 1.00 0.00 H new ATOM 0 HE2 PHE A 523 29.356 30.249 24.455 1.00 0.00 H new ATOM 0 HZ PHE A 523 30.223 31.436 26.460 1.00 0.00 H new ATOM 176 N LYS A 524 33.231 24.825 27.341 1.00 0.00 N ATOM 177 CA LYS A 524 33.750 24.794 28.714 1.00 0.00 C ATOM 178 C LYS A 524 34.538 26.066 29.068 1.00 0.00 C ATOM 179 O LYS A 524 35.017 26.799 28.200 1.00 0.00 O ATOM 180 CB LYS A 524 34.617 23.546 28.900 1.00 0.00 C ATOM 181 CG LYS A 524 33.851 22.237 28.944 1.00 0.00 C ATOM 182 CD LYS A 524 34.839 21.063 28.948 1.00 0.00 C ATOM 183 CE LYS A 524 34.104 19.762 28.675 1.00 0.00 C ATOM 184 NZ LYS A 524 35.018 18.626 28.406 1.00 0.00 N ATOM 0 H LYS A 524 33.939 24.625 26.635 1.00 0.00 H new ATOM 0 HA LYS A 524 32.901 24.755 29.397 1.00 0.00 H new ATOM 0 HB2 LYS A 524 35.341 23.500 28.086 1.00 0.00 H new ATOM 0 HB3 LYS A 524 35.184 23.650 29.825 1.00 0.00 H new ATOM 0 HG2 LYS A 524 33.224 22.201 29.835 1.00 0.00 H new ATOM 0 HG3 LYS A 524 33.187 22.164 28.083 1.00 0.00 H new ATOM 0 HD2 LYS A 524 35.607 21.221 28.191 1.00 0.00 H new ATOM 0 HD3 LYS A 524 35.347 21.008 29.911 1.00 0.00 H new ATOM 0 HE2 LYS A 524 33.475 19.520 29.531 1.00 0.00 H new ATOM 0 HE3 LYS A 524 33.441 19.898 27.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 34.655 18.070 27.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 35.965 18.989 28.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 35.077 18.020 29.249 1.00 0.00 H new ATOM 198 N VAL A 525 34.754 26.261 30.364 1.00 0.00 N ATOM 199 CA VAL A 525 35.716 27.200 30.974 1.00 0.00 C ATOM 200 C VAL A 525 36.450 26.505 32.129 1.00 0.00 C ATOM 201 O VAL A 525 35.920 25.540 32.678 1.00 0.00 O ATOM 202 CB VAL A 525 35.033 28.503 31.439 1.00 0.00 C ATOM 203 CG1 VAL A 525 34.186 29.151 30.339 1.00 0.00 C ATOM 204 CG2 VAL A 525 34.130 28.200 32.634 1.00 0.00 C ATOM 0 H VAL A 525 34.234 25.739 31.070 1.00 0.00 H new ATOM 0 HA VAL A 525 36.445 27.489 30.216 1.00 0.00 H new ATOM 0 HB VAL A 525 35.825 29.203 31.707 1.00 0.00 H new ATOM 0 HG11 VAL A 525 33.729 30.064 30.722 1.00 0.00 H new ATOM 0 HG12 VAL A 525 34.820 29.393 29.486 1.00 0.00 H new ATOM 0 HG13 VAL A 525 33.405 28.458 30.026 1.00 0.00 H new ATOM 0 HG21 VAL A 525 33.645 29.118 32.966 1.00 0.00 H new ATOM 0 HG22 VAL A 525 33.371 27.474 32.342 1.00 0.00 H new ATOM 0 HG23 VAL A 525 34.729 27.791 33.448 1.00 0.00 H new ATOM 214 N GLN A 526 37.621 26.994 32.549 1.00 0.00 N ATOM 215 CA GLN A 526 38.283 26.554 33.791 1.00 0.00 C ATOM 216 C GLN A 526 38.567 27.726 34.745 1.00 0.00 C ATOM 217 O GLN A 526 39.161 28.726 34.341 1.00 0.00 O ATOM 218 CB GLN A 526 39.556 25.750 33.474 1.00 0.00 C ATOM 219 CG GLN A 526 40.154 25.104 34.741 1.00 0.00 C ATOM 220 CD GLN A 526 41.168 24.004 34.431 1.00 0.00 C ATOM 221 OE1 GLN A 526 41.960 24.086 33.498 1.00 0.00 O ATOM 222 NE2 GLN A 526 41.206 22.954 35.220 1.00 0.00 N ATOM 0 H GLN A 526 38.141 27.708 32.039 1.00 0.00 H new ATOM 0 HA GLN A 526 37.592 25.894 34.316 1.00 0.00 H new ATOM 0 HB2 GLN A 526 39.324 24.974 32.745 1.00 0.00 H new ATOM 0 HB3 GLN A 526 40.296 26.406 33.016 1.00 0.00 H new ATOM 0 HG2 GLN A 526 40.636 25.875 35.342 1.00 0.00 H new ATOM 0 HG3 GLN A 526 39.348 24.687 35.344 1.00 0.00 H new ATOM 0 HE21 GLN A 526 40.551 22.877 35.998 1.00 0.00 H new ATOM 0 HE22 GLN A 526 41.890 22.216 35.054 1.00 0.00 H new ATOM 231 N ALA A 527 38.164 27.625 36.014 1.00 0.00 N ATOM 232 CA ALA A 527 38.356 28.672 37.024 1.00 0.00 C ATOM 233 C ALA A 527 39.845 28.934 37.319 1.00 0.00 C ATOM 234 O ALA A 527 40.585 28.034 37.711 1.00 0.00 O ATOM 235 CB ALA A 527 37.545 28.311 38.274 1.00 0.00 C ATOM 0 H ALA A 527 37.687 26.799 36.376 1.00 0.00 H new ATOM 0 HA ALA A 527 37.983 29.620 36.636 1.00 0.00 H new ATOM 0 HB1 ALA A 527 37.681 29.083 39.031 1.00 0.00 H new ATOM 0 HB2 ALA A 527 36.489 28.239 38.014 1.00 0.00 H new ATOM 0 HB3 ALA A 527 37.888 27.354 38.666 1.00 0.00 H new ATOM 241 N GLN A 528 40.279 30.182 37.136 1.00 0.00 N ATOM 242 CA GLN A 528 41.623 30.674 37.464 1.00 0.00 C ATOM 243 C GLN A 528 41.712 31.175 38.921 1.00 0.00 C ATOM 244 O GLN A 528 42.793 31.208 39.503 1.00 0.00 O ATOM 245 CB GLN A 528 41.987 31.822 36.504 1.00 0.00 C ATOM 246 CG GLN A 528 41.863 31.532 34.999 1.00 0.00 C ATOM 247 CD GLN A 528 42.656 30.317 34.532 1.00 0.00 C ATOM 248 OE1 GLN A 528 43.863 30.349 34.329 1.00 0.00 O ATOM 249 NE2 GLN A 528 42.018 29.177 34.429 1.00 0.00 N ATOM 0 H GLN A 528 39.682 30.908 36.740 1.00 0.00 H new ATOM 0 HA GLN A 528 42.323 29.846 37.354 1.00 0.00 H new ATOM 0 HB2 GLN A 528 41.352 32.676 36.739 1.00 0.00 H new ATOM 0 HB3 GLN A 528 43.014 32.123 36.709 1.00 0.00 H new ATOM 0 HG2 GLN A 528 40.811 31.382 34.754 1.00 0.00 H new ATOM 0 HG3 GLN A 528 42.198 32.407 34.442 1.00 0.00 H new ATOM 0 HE21 GLN A 528 41.012 29.138 34.596 1.00 0.00 H new ATOM 0 HE22 GLN A 528 42.527 28.328 34.182 1.00 0.00 H new ATOM 258 N HIS A 529 40.576 31.552 39.515 1.00 0.00 N ATOM 259 CA HIS A 529 40.431 32.135 40.855 1.00 0.00 C ATOM 260 C HIS A 529 39.190 31.547 41.561 1.00 0.00 C ATOM 261 O HIS A 529 38.298 31.029 40.887 1.00 0.00 O ATOM 262 CB HIS A 529 40.375 33.668 40.711 1.00 0.00 C ATOM 263 CG HIS A 529 41.691 34.275 40.277 1.00 0.00 C ATOM 264 ND1 HIS A 529 42.812 34.458 41.061 1.00 0.00 N ATOM 265 CD2 HIS A 529 41.996 34.753 39.029 1.00 0.00 C ATOM 266 CE1 HIS A 529 43.767 35.018 40.298 1.00 0.00 C ATOM 267 NE2 HIS A 529 43.317 35.221 39.044 1.00 0.00 N ATOM 0 H HIS A 529 39.676 31.453 39.045 1.00 0.00 H new ATOM 0 HA HIS A 529 41.284 31.885 41.486 1.00 0.00 H new ATOM 0 HB2 HIS A 529 39.605 33.930 39.986 1.00 0.00 H new ATOM 0 HB3 HIS A 529 40.078 34.105 41.664 1.00 0.00 H new ATOM 0 HD2 HIS A 529 41.331 34.767 38.178 1.00 0.00 H new ATOM 0 HE1 HIS A 529 44.759 35.271 40.643 1.00 0.00 H new ATOM 0 HE2 HIS A 529 43.832 35.631 38.265 1.00 0.00 H new ATOM 275 N ASP A 530 39.117 31.581 42.899 1.00 0.00 N ATOM 276 CA ASP A 530 37.977 31.034 43.645 1.00 0.00 C ATOM 277 C ASP A 530 36.833 32.041 43.826 1.00 0.00 C ATOM 278 O ASP A 530 37.057 33.203 44.185 1.00 0.00 O ATOM 279 CB ASP A 530 38.347 30.333 44.970 1.00 0.00 C ATOM 280 CG ASP A 530 39.092 31.121 46.059 1.00 0.00 C ATOM 281 OD1 ASP A 530 39.704 32.187 45.807 1.00 0.00 O ATOM 282 OD2 ASP A 530 39.069 30.643 47.219 1.00 0.00 O ATOM 0 H ASP A 530 39.842 31.986 43.491 1.00 0.00 H new ATOM 0 HA ASP A 530 37.603 30.240 42.999 1.00 0.00 H new ATOM 0 HB2 ASP A 530 37.423 29.959 45.411 1.00 0.00 H new ATOM 0 HB3 ASP A 530 38.956 29.464 44.721 1.00 0.00 H new ATOM 287 N TYR A 531 35.599 31.580 43.609 1.00 0.00 N ATOM 288 CA TYR A 531 34.387 32.386 43.695 1.00 0.00 C ATOM 289 C TYR A 531 33.332 31.734 44.594 1.00 0.00 C ATOM 290 O TYR A 531 32.724 30.719 44.235 1.00 0.00 O ATOM 291 CB TYR A 531 33.828 32.688 42.300 1.00 0.00 C ATOM 292 CG TYR A 531 32.600 33.585 42.395 1.00 0.00 C ATOM 293 CD1 TYR A 531 31.294 33.055 42.319 1.00 0.00 C ATOM 294 CD2 TYR A 531 32.777 34.945 42.713 1.00 0.00 C ATOM 295 CE1 TYR A 531 30.177 33.874 42.591 1.00 0.00 C ATOM 296 CE2 TYR A 531 31.667 35.760 42.997 1.00 0.00 C ATOM 297 CZ TYR A 531 30.364 35.226 42.958 1.00 0.00 C ATOM 298 OH TYR A 531 29.313 36.023 43.299 1.00 0.00 O ATOM 0 H TYR A 531 35.414 30.608 43.362 1.00 0.00 H new ATOM 0 HA TYR A 531 34.657 33.335 44.159 1.00 0.00 H new ATOM 0 HB2 TYR A 531 34.593 33.173 41.693 1.00 0.00 H new ATOM 0 HB3 TYR A 531 33.566 31.757 41.798 1.00 0.00 H new ATOM 0 HD1 TYR A 531 31.149 32.019 42.052 1.00 0.00 H new ATOM 0 HD2 TYR A 531 33.772 35.365 42.739 1.00 0.00 H new ATOM 0 HE1 TYR A 531 29.179 33.467 42.519 1.00 0.00 H new ATOM 0 HE2 TYR A 531 31.814 36.800 43.246 1.00 0.00 H new ATOM 0 HH TYR A 531 28.625 35.485 43.744 1.00 0.00 H new ATOM 308 N THR A 532 33.097 32.339 45.757 1.00 0.00 N ATOM 309 CA THR A 532 31.962 31.994 46.622 1.00 0.00 C ATOM 310 C THR A 532 30.654 32.667 46.231 1.00 0.00 C ATOM 311 O THR A 532 30.519 33.886 46.340 1.00 0.00 O ATOM 312 CB THR A 532 32.229 32.102 48.132 1.00 0.00 C ATOM 313 OG1 THR A 532 33.594 31.914 48.423 1.00 0.00 O ATOM 314 CG2 THR A 532 31.438 31.066 48.931 1.00 0.00 C ATOM 0 H THR A 532 33.687 33.083 46.130 1.00 0.00 H new ATOM 0 HA THR A 532 31.837 30.929 46.428 1.00 0.00 H new ATOM 0 HB THR A 532 31.913 33.105 48.420 1.00 0.00 H new ATOM 0 HG1 THR A 532 33.736 31.990 49.390 1.00 0.00 H new ATOM 0 HG21 THR A 532 31.658 31.180 49.992 1.00 0.00 H new ATOM 0 HG22 THR A 532 30.371 31.214 48.764 1.00 0.00 H new ATOM 0 HG23 THR A 532 31.720 30.064 48.607 1.00 0.00 H new ATOM 322 N ALA A 533 29.682 31.869 45.797 1.00 0.00 N ATOM 323 CA ALA A 533 28.344 32.327 45.474 1.00 0.00 C ATOM 324 C ALA A 533 27.626 32.924 46.692 1.00 0.00 C ATOM 325 O ALA A 533 27.752 32.444 47.825 1.00 0.00 O ATOM 326 CB ALA A 533 27.579 31.148 44.870 1.00 0.00 C ATOM 0 H ALA A 533 29.810 30.867 45.659 1.00 0.00 H new ATOM 0 HA ALA A 533 28.397 33.140 44.750 1.00 0.00 H new ATOM 0 HB1 ALA A 533 26.567 31.463 44.616 1.00 0.00 H new ATOM 0 HB2 ALA A 533 28.089 30.806 43.969 1.00 0.00 H new ATOM 0 HB3 ALA A 533 27.535 30.334 45.593 1.00 0.00 H new ATOM 332 N THR A 534 26.846 33.961 46.409 1.00 0.00 N ATOM 333 CA THR A 534 26.023 34.739 47.349 1.00 0.00 C ATOM 334 C THR A 534 24.543 34.852 46.952 1.00 0.00 C ATOM 335 O THR A 534 23.801 35.736 47.388 1.00 0.00 O ATOM 336 CB THR A 534 26.725 36.052 47.719 1.00 0.00 C ATOM 337 OG1 THR A 534 26.146 36.547 48.901 1.00 0.00 O ATOM 338 CG2 THR A 534 26.646 37.116 46.630 1.00 0.00 C ATOM 0 H THR A 534 26.761 34.310 45.454 1.00 0.00 H new ATOM 0 HA THR A 534 25.947 34.172 48.277 1.00 0.00 H new ATOM 0 HB THR A 534 27.784 35.829 47.851 1.00 0.00 H new ATOM 0 HG1 THR A 534 25.171 36.468 48.846 1.00 0.00 H new ATOM 0 HG21 THR A 534 27.164 38.016 46.962 1.00 0.00 H new ATOM 0 HG22 THR A 534 27.116 36.742 45.721 1.00 0.00 H new ATOM 0 HG23 THR A 534 25.601 37.352 46.427 1.00 0.00 H new ATOM 346 N ASP A 535 24.091 33.913 46.123 1.00 0.00 N ATOM 347 CA ASP A 535 22.675 33.657 45.858 1.00 0.00 C ATOM 348 C ASP A 535 22.537 32.177 45.462 1.00 0.00 C ATOM 349 O ASP A 535 23.468 31.580 44.915 1.00 0.00 O ATOM 350 CB ASP A 535 22.214 34.535 44.683 1.00 0.00 C ATOM 351 CG ASP A 535 20.693 34.678 44.556 1.00 0.00 C ATOM 352 OD1 ASP A 535 19.940 34.260 45.463 1.00 0.00 O ATOM 353 OD2 ASP A 535 20.235 35.190 43.507 1.00 0.00 O ATOM 0 H ASP A 535 24.714 33.294 45.604 1.00 0.00 H new ATOM 0 HA ASP A 535 22.071 33.883 46.737 1.00 0.00 H new ATOM 0 HB2 ASP A 535 22.652 35.527 44.793 1.00 0.00 H new ATOM 0 HB3 ASP A 535 22.606 34.115 43.756 1.00 0.00 H new ATOM 358 N THR A 536 21.353 31.591 45.640 1.00 0.00 N ATOM 359 CA THR A 536 21.005 30.278 45.062 1.00 0.00 C ATOM 360 C THR A 536 20.872 30.258 43.526 1.00 0.00 C ATOM 361 O THR A 536 20.858 29.194 42.906 1.00 0.00 O ATOM 362 CB THR A 536 19.820 29.661 45.824 1.00 0.00 C ATOM 363 OG1 THR A 536 19.698 28.270 45.596 1.00 0.00 O ATOM 364 CG2 THR A 536 18.479 30.289 45.445 1.00 0.00 C ATOM 0 H THR A 536 20.602 32.008 46.189 1.00 0.00 H new ATOM 0 HA THR A 536 21.862 29.622 45.213 1.00 0.00 H new ATOM 0 HB THR A 536 20.044 29.859 46.872 1.00 0.00 H new ATOM 0 HG1 THR A 536 20.152 28.035 44.760 1.00 0.00 H new ATOM 0 HG21 THR A 536 17.681 29.813 46.015 1.00 0.00 H new ATOM 0 HG22 THR A 536 18.500 31.355 45.670 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.299 30.147 44.379 1.00 0.00 H new ATOM 372 N ASP A 537 20.867 31.433 42.888 1.00 0.00 N ATOM 373 CA ASP A 537 21.020 31.618 41.435 1.00 0.00 C ATOM 374 C ASP A 537 22.506 31.471 41.009 1.00 0.00 C ATOM 375 O ASP A 537 22.798 31.024 39.900 1.00 0.00 O ATOM 376 CB ASP A 537 20.520 33.042 41.123 1.00 0.00 C ATOM 377 CG ASP A 537 20.334 33.393 39.642 1.00 0.00 C ATOM 378 OD1 ASP A 537 20.097 32.486 38.812 1.00 0.00 O ATOM 379 OD2 ASP A 537 20.369 34.614 39.336 1.00 0.00 O ATOM 0 H ASP A 537 20.752 32.316 43.385 1.00 0.00 H new ATOM 0 HA ASP A 537 20.454 30.864 40.889 1.00 0.00 H new ATOM 0 HB2 ASP A 537 19.566 33.187 41.630 1.00 0.00 H new ATOM 0 HB3 ASP A 537 21.223 33.753 41.556 1.00 0.00 H new ATOM 384 N GLU A 538 23.469 31.829 41.867 1.00 0.00 N ATOM 385 CA GLU A 538 24.902 31.825 41.562 1.00 0.00 C ATOM 386 C GLU A 538 25.560 30.431 41.689 1.00 0.00 C ATOM 387 O GLU A 538 25.169 29.617 42.532 1.00 0.00 O ATOM 388 CB GLU A 538 25.610 32.865 42.444 1.00 0.00 C ATOM 389 CG GLU A 538 25.410 34.327 42.004 1.00 0.00 C ATOM 390 CD GLU A 538 26.149 35.321 42.928 1.00 0.00 C ATOM 391 OE1 GLU A 538 25.886 36.548 42.877 1.00 0.00 O ATOM 392 OE2 GLU A 538 27.012 34.885 43.726 1.00 0.00 O ATOM 0 H GLU A 538 23.266 32.138 42.818 1.00 0.00 H new ATOM 0 HA GLU A 538 25.014 32.094 40.512 1.00 0.00 H new ATOM 0 HB2 GLU A 538 25.253 32.756 43.468 1.00 0.00 H new ATOM 0 HB3 GLU A 538 26.678 32.646 42.454 1.00 0.00 H new ATOM 0 HG2 GLU A 538 25.768 34.449 40.982 1.00 0.00 H new ATOM 0 HG3 GLU A 538 24.345 34.561 41.999 1.00 0.00 H new ATOM 399 N LEU A 539 26.569 30.158 40.853 1.00 0.00 N ATOM 400 CA LEU A 539 27.400 28.945 40.833 1.00 0.00 C ATOM 401 C LEU A 539 28.672 29.153 41.682 1.00 0.00 C ATOM 402 O LEU A 539 29.298 30.211 41.614 1.00 0.00 O ATOM 403 CB LEU A 539 27.785 28.619 39.367 1.00 0.00 C ATOM 404 CG LEU A 539 27.672 27.148 38.910 1.00 0.00 C ATOM 405 CD1 LEU A 539 28.367 26.963 37.571 1.00 0.00 C ATOM 406 CD2 LEU A 539 28.276 26.135 39.876 1.00 0.00 C ATOM 0 H LEU A 539 26.845 30.819 40.127 1.00 0.00 H new ATOM 0 HA LEU A 539 26.837 28.113 41.257 1.00 0.00 H new ATOM 0 HB2 LEU A 539 27.158 29.224 38.712 1.00 0.00 H new ATOM 0 HB3 LEU A 539 28.814 28.942 39.210 1.00 0.00 H new ATOM 0 HG LEU A 539 26.601 26.956 38.854 1.00 0.00 H new ATOM 0 HD11 LEU A 539 28.282 25.923 37.257 1.00 0.00 H new ATOM 0 HD12 LEU A 539 27.898 27.606 36.826 1.00 0.00 H new ATOM 0 HD13 LEU A 539 29.420 27.228 37.668 1.00 0.00 H new ATOM 0 HD21 LEU A 539 28.151 25.130 39.474 1.00 0.00 H new ATOM 0 HD22 LEU A 539 29.338 26.344 40.006 1.00 0.00 H new ATOM 0 HD23 LEU A 539 27.772 26.206 40.840 1.00 0.00 H new ATOM 418 N GLN A 540 29.081 28.146 42.455 1.00 0.00 N ATOM 419 CA GLN A 540 30.277 28.187 43.309 1.00 0.00 C ATOM 420 C GLN A 540 31.505 27.584 42.595 1.00 0.00 C ATOM 421 O GLN A 540 31.422 26.468 42.082 1.00 0.00 O ATOM 422 CB GLN A 540 29.923 27.421 44.591 1.00 0.00 C ATOM 423 CG GLN A 540 30.904 27.648 45.750 1.00 0.00 C ATOM 424 CD GLN A 540 30.580 26.748 46.942 1.00 0.00 C ATOM 425 OE1 GLN A 540 31.359 25.881 47.318 1.00 0.00 O ATOM 426 NE2 GLN A 540 29.385 26.806 47.483 1.00 0.00 N ATOM 0 H GLN A 540 28.582 27.258 42.509 1.00 0.00 H new ATOM 0 HA GLN A 540 30.555 29.215 43.542 1.00 0.00 H new ATOM 0 HB2 GLN A 540 28.924 27.715 44.912 1.00 0.00 H new ATOM 0 HB3 GLN A 540 29.885 26.355 44.365 1.00 0.00 H new ATOM 0 HG2 GLN A 540 31.921 27.452 45.411 1.00 0.00 H new ATOM 0 HG3 GLN A 540 30.867 28.692 46.060 1.00 0.00 H new ATOM 0 HE21 GLN A 540 28.723 27.521 47.182 1.00 0.00 H new ATOM 0 HE22 GLN A 540 29.119 26.136 48.204 1.00 0.00 H new ATOM 435 N LEU A 541 32.649 28.287 42.577 1.00 0.00 N ATOM 436 CA LEU A 541 33.876 27.878 41.864 1.00 0.00 C ATOM 437 C LEU A 541 35.127 27.905 42.762 1.00 0.00 C ATOM 438 O LEU A 541 35.264 28.766 43.636 1.00 0.00 O ATOM 439 CB LEU A 541 34.109 28.766 40.614 1.00 0.00 C ATOM 440 CG LEU A 541 32.972 28.823 39.571 1.00 0.00 C ATOM 441 CD1 LEU A 541 33.375 29.738 38.414 1.00 0.00 C ATOM 442 CD2 LEU A 541 32.657 27.445 38.998 1.00 0.00 C ATOM 0 H LEU A 541 32.752 29.175 43.068 1.00 0.00 H new ATOM 0 HA LEU A 541 33.719 26.845 41.554 1.00 0.00 H new ATOM 0 HB2 LEU A 541 34.308 29.782 40.953 1.00 0.00 H new ATOM 0 HB3 LEU A 541 35.011 28.415 40.113 1.00 0.00 H new ATOM 0 HG LEU A 541 32.087 29.204 40.080 1.00 0.00 H new ATOM 0 HD11 LEU A 541 32.569 29.774 37.681 1.00 0.00 H new ATOM 0 HD12 LEU A 541 33.566 30.742 38.793 1.00 0.00 H new ATOM 0 HD13 LEU A 541 34.278 29.351 37.941 1.00 0.00 H new ATOM 0 HD21 LEU A 541 31.852 27.530 38.268 1.00 0.00 H new ATOM 0 HD22 LEU A 541 33.545 27.041 38.513 1.00 0.00 H new ATOM 0 HD23 LEU A 541 32.348 26.778 39.803 1.00 0.00 H new ATOM 454 N LYS A 542 36.084 27.013 42.491 1.00 0.00 N ATOM 455 CA LYS A 542 37.444 26.986 43.068 1.00 0.00 C ATOM 456 C LYS A 542 38.482 27.101 41.954 1.00 0.00 C ATOM 457 O LYS A 542 38.242 26.605 40.858 1.00 0.00 O ATOM 458 CB LYS A 542 37.585 25.679 43.866 1.00 0.00 C ATOM 459 CG LYS A 542 38.785 25.551 44.821 1.00 0.00 C ATOM 460 CD LYS A 542 40.092 25.044 44.191 1.00 0.00 C ATOM 461 CE LYS A 542 41.020 24.488 45.276 1.00 0.00 C ATOM 462 NZ LYS A 542 42.268 23.929 44.707 1.00 0.00 N ATOM 0 H LYS A 542 35.930 26.250 41.832 1.00 0.00 H new ATOM 0 HA LYS A 542 37.610 27.829 43.738 1.00 0.00 H new ATOM 0 HB2 LYS A 542 36.675 25.543 44.450 1.00 0.00 H new ATOM 0 HB3 LYS A 542 37.633 24.855 43.154 1.00 0.00 H new ATOM 0 HG2 LYS A 542 38.974 26.527 45.268 1.00 0.00 H new ATOM 0 HG3 LYS A 542 38.509 24.877 45.632 1.00 0.00 H new ATOM 0 HD2 LYS A 542 39.874 24.269 43.456 1.00 0.00 H new ATOM 0 HD3 LYS A 542 40.587 25.856 43.659 1.00 0.00 H new ATOM 0 HE2 LYS A 542 41.267 25.280 45.982 1.00 0.00 H new ATOM 0 HE3 LYS A 542 40.498 23.712 45.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 542 42.867 23.564 45.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 542 42.035 23.155 44.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 542 42.780 24.675 44.194 1.00 0.00 H new ATOM 476 N ALA A 543 39.634 27.719 42.219 1.00 0.00 N ATOM 477 CA ALA A 543 40.750 27.802 41.272 1.00 0.00 C ATOM 478 C ALA A 543 41.213 26.399 40.801 1.00 0.00 C ATOM 479 O ALA A 543 41.929 25.687 41.509 1.00 0.00 O ATOM 480 CB ALA A 543 41.882 28.600 41.930 1.00 0.00 C ATOM 0 H ALA A 543 39.822 28.182 43.108 1.00 0.00 H new ATOM 0 HA ALA A 543 40.427 28.319 40.368 1.00 0.00 H new ATOM 0 HB1 ALA A 543 42.723 28.674 41.241 1.00 0.00 H new ATOM 0 HB2 ALA A 543 41.526 29.600 42.177 1.00 0.00 H new ATOM 0 HB3 ALA A 543 42.202 28.094 42.841 1.00 0.00 H new ATOM 486 N GLY A 544 40.757 26.007 39.610 1.00 0.00 N ATOM 487 CA GLY A 544 40.980 24.705 38.972 1.00 0.00 C ATOM 488 C GLY A 544 39.696 24.003 38.501 1.00 0.00 C ATOM 489 O GLY A 544 39.785 22.945 37.873 1.00 0.00 O ATOM 0 H GLY A 544 40.189 26.624 39.030 1.00 0.00 H new ATOM 0 HA2 GLY A 544 41.640 24.842 38.116 1.00 0.00 H new ATOM 0 HA3 GLY A 544 41.500 24.053 39.675 1.00 0.00 H new ATOM 493 N ASP A 545 38.506 24.554 38.777 1.00 0.00 N ATOM 494 CA ASP A 545 37.218 23.933 38.452 1.00 0.00 C ATOM 495 C ASP A 545 36.807 24.099 36.978 1.00 0.00 C ATOM 496 O ASP A 545 36.667 25.233 36.516 1.00 0.00 O ATOM 497 CB ASP A 545 36.114 24.437 39.409 1.00 0.00 C ATOM 498 CG ASP A 545 36.126 23.867 40.836 1.00 0.00 C ATOM 499 OD1 ASP A 545 36.945 22.980 41.168 1.00 0.00 O ATOM 500 OD2 ASP A 545 35.266 24.306 41.642 1.00 0.00 O ATOM 0 H ASP A 545 38.412 25.458 39.240 1.00 0.00 H new ATOM 0 HA ASP A 545 37.347 22.861 38.598 1.00 0.00 H new ATOM 0 HB2 ASP A 545 36.190 25.522 39.475 1.00 0.00 H new ATOM 0 HB3 ASP A 545 35.146 24.212 38.961 1.00 0.00 H new ATOM 505 N VAL A 546 36.598 23.006 36.232 1.00 0.00 N ATOM 506 CA VAL A 546 35.972 23.061 34.895 1.00 0.00 C ATOM 507 C VAL A 546 34.469 23.306 35.027 1.00 0.00 C ATOM 508 O VAL A 546 33.802 22.642 35.827 1.00 0.00 O ATOM 509 CB VAL A 546 36.254 21.814 34.022 1.00 0.00 C ATOM 510 CG1 VAL A 546 35.711 21.957 32.598 1.00 0.00 C ATOM 511 CG2 VAL A 546 37.763 21.544 33.916 1.00 0.00 C ATOM 0 H VAL A 546 36.854 22.065 36.531 1.00 0.00 H new ATOM 0 HA VAL A 546 36.435 23.897 34.371 1.00 0.00 H new ATOM 0 HB VAL A 546 35.746 20.988 34.519 1.00 0.00 H new ATOM 0 HG11 VAL A 546 35.937 21.054 32.030 1.00 0.00 H new ATOM 0 HG12 VAL A 546 34.631 22.103 32.633 1.00 0.00 H new ATOM 0 HG13 VAL A 546 36.178 22.816 32.115 1.00 0.00 H new ATOM 0 HG21 VAL A 546 37.932 20.663 33.297 1.00 0.00 H new ATOM 0 HG22 VAL A 546 38.256 22.405 33.464 1.00 0.00 H new ATOM 0 HG23 VAL A 546 38.173 21.373 34.911 1.00 0.00 H new ATOM 521 N VAL A 547 33.925 24.215 34.217 1.00 0.00 N ATOM 522 CA VAL A 547 32.491 24.515 34.107 1.00 0.00 C ATOM 523 C VAL A 547 31.995 24.344 32.684 1.00 0.00 C ATOM 524 O VAL A 547 32.520 24.960 31.758 1.00 0.00 O ATOM 525 CB VAL A 547 32.056 25.869 34.727 1.00 0.00 C ATOM 526 CG1 VAL A 547 30.642 25.772 35.292 1.00 0.00 C ATOM 527 CG2 VAL A 547 32.991 26.390 35.818 1.00 0.00 C ATOM 0 H VAL A 547 34.492 24.788 33.592 1.00 0.00 H new ATOM 0 HA VAL A 547 31.996 23.769 34.729 1.00 0.00 H new ATOM 0 HB VAL A 547 32.098 26.584 33.905 1.00 0.00 H new ATOM 0 HG11 VAL A 547 30.355 26.732 35.722 1.00 0.00 H new ATOM 0 HG12 VAL A 547 29.948 25.511 34.493 1.00 0.00 H new ATOM 0 HG13 VAL A 547 30.611 25.004 36.065 1.00 0.00 H new ATOM 0 HG21 VAL A 547 32.614 27.340 36.197 1.00 0.00 H new ATOM 0 HG22 VAL A 547 33.038 25.667 36.632 1.00 0.00 H new ATOM 0 HG23 VAL A 547 33.989 26.535 35.403 1.00 0.00 H new ATOM 537 N LEU A 548 31.002 23.480 32.507 1.00 0.00 N ATOM 538 CA LEU A 548 30.327 23.251 31.240 1.00 0.00 C ATOM 539 C LEU A 548 29.324 24.401 31.010 1.00 0.00 C ATOM 540 O LEU A 548 28.259 24.415 31.629 1.00 0.00 O ATOM 541 CB LEU A 548 29.609 21.888 31.312 1.00 0.00 C ATOM 542 CG LEU A 548 30.400 20.620 31.704 1.00 0.00 C ATOM 543 CD1 LEU A 548 29.445 19.451 31.927 1.00 0.00 C ATOM 544 CD2 LEU A 548 31.420 20.172 30.672 1.00 0.00 C ATOM 0 H LEU A 548 30.636 22.904 33.265 1.00 0.00 H new ATOM 0 HA LEU A 548 31.031 23.231 30.408 1.00 0.00 H new ATOM 0 HB2 LEU A 548 28.788 21.991 32.022 1.00 0.00 H new ATOM 0 HB3 LEU A 548 29.164 21.704 30.334 1.00 0.00 H new ATOM 0 HG LEU A 548 30.937 20.897 32.611 1.00 0.00 H new ATOM 0 HD11 LEU A 548 30.014 18.563 32.203 1.00 0.00 H new ATOM 0 HD12 LEU A 548 28.748 19.698 32.728 1.00 0.00 H new ATOM 0 HD13 LEU A 548 28.889 19.255 31.010 1.00 0.00 H new ATOM 0 HD21 LEU A 548 31.929 19.276 31.028 1.00 0.00 H new ATOM 0 HD22 LEU A 548 30.914 19.952 29.732 1.00 0.00 H new ATOM 0 HD23 LEU A 548 32.150 20.965 30.514 1.00 0.00 H new ATOM 556 N VAL A 549 29.663 25.384 30.174 1.00 0.00 N ATOM 557 CA VAL A 549 28.736 26.468 29.758 1.00 0.00 C ATOM 558 C VAL A 549 27.509 25.997 28.949 1.00 0.00 C ATOM 559 O VAL A 549 27.634 25.274 27.954 1.00 0.00 O ATOM 560 CB VAL A 549 29.474 27.602 29.016 1.00 0.00 C ATOM 561 CG1 VAL A 549 28.635 28.878 28.910 1.00 0.00 C ATOM 562 CG2 VAL A 549 30.789 27.949 29.726 1.00 0.00 C ATOM 0 H VAL A 549 30.591 25.462 29.758 1.00 0.00 H new ATOM 0 HA VAL A 549 28.339 26.856 30.696 1.00 0.00 H new ATOM 0 HB VAL A 549 29.669 27.228 28.011 1.00 0.00 H new ATOM 0 HG11 VAL A 549 29.202 29.643 28.379 1.00 0.00 H new ATOM 0 HG12 VAL A 549 27.715 28.665 28.365 1.00 0.00 H new ATOM 0 HG13 VAL A 549 28.390 29.236 29.910 1.00 0.00 H new ATOM 0 HG21 VAL A 549 31.293 28.751 29.186 1.00 0.00 H new ATOM 0 HG22 VAL A 549 30.578 28.274 30.745 1.00 0.00 H new ATOM 0 HG23 VAL A 549 31.432 27.069 29.752 1.00 0.00 H new ATOM 572 N ILE A 550 26.315 26.460 29.343 1.00 0.00 N ATOM 573 CA ILE A 550 25.008 26.131 28.744 1.00 0.00 C ATOM 574 C ILE A 550 24.172 27.408 28.483 1.00 0.00 C ATOM 575 O ILE A 550 24.366 28.421 29.157 1.00 0.00 O ATOM 576 CB ILE A 550 24.224 25.131 29.636 1.00 0.00 C ATOM 577 CG1 ILE A 550 23.759 25.772 30.966 1.00 0.00 C ATOM 578 CG2 ILE A 550 25.032 23.839 29.855 1.00 0.00 C ATOM 579 CD1 ILE A 550 23.048 24.816 31.933 1.00 0.00 C ATOM 0 H ILE A 550 26.227 27.107 30.127 1.00 0.00 H new ATOM 0 HA ILE A 550 25.196 25.653 27.783 1.00 0.00 H new ATOM 0 HB ILE A 550 23.313 24.858 29.103 1.00 0.00 H new ATOM 0 HG12 ILE A 550 24.627 26.196 31.471 1.00 0.00 H new ATOM 0 HG13 ILE A 550 23.087 26.600 30.738 1.00 0.00 H new ATOM 0 HG21 ILE A 550 24.461 23.155 30.483 1.00 0.00 H new ATOM 0 HG22 ILE A 550 25.232 23.367 28.893 1.00 0.00 H new ATOM 0 HG23 ILE A 550 25.976 24.079 30.345 1.00 0.00 H new ATOM 0 HD11 ILE A 550 22.761 25.357 32.834 1.00 0.00 H new ATOM 0 HD12 ILE A 550 22.157 24.410 31.454 1.00 0.00 H new ATOM 0 HD13 ILE A 550 23.721 24.000 32.198 1.00 0.00 H new ATOM 591 N PRO A 551 23.232 27.381 27.518 1.00 0.00 N ATOM 592 CA PRO A 551 22.285 28.466 27.258 1.00 0.00 C ATOM 593 C PRO A 551 21.206 28.552 28.344 1.00 0.00 C ATOM 594 O PRO A 551 20.790 27.551 28.936 1.00 0.00 O ATOM 595 CB PRO A 551 21.689 28.149 25.882 1.00 0.00 C ATOM 596 CG PRO A 551 21.689 26.620 25.854 1.00 0.00 C ATOM 597 CD PRO A 551 22.959 26.264 26.626 1.00 0.00 C ATOM 0 HA PRO A 551 22.772 29.441 27.271 1.00 0.00 H new ATOM 0 HB2 PRO A 551 20.683 28.555 25.774 1.00 0.00 H new ATOM 0 HB3 PRO A 551 22.290 28.568 25.075 1.00 0.00 H new ATOM 0 HG2 PRO A 551 20.799 26.207 26.329 1.00 0.00 H new ATOM 0 HG3 PRO A 551 21.714 26.235 24.835 1.00 0.00 H new ATOM 0 HD2 PRO A 551 22.823 25.342 27.191 1.00 0.00 H new ATOM 0 HD3 PRO A 551 23.793 26.100 25.944 1.00 0.00 H new ATOM 605 N PHE A 552 20.719 29.767 28.593 1.00 0.00 N ATOM 606 CA PHE A 552 19.709 30.010 29.618 1.00 0.00 C ATOM 607 C PHE A 552 18.304 29.479 29.282 1.00 0.00 C ATOM 608 O PHE A 552 17.821 29.591 28.152 1.00 0.00 O ATOM 609 CB PHE A 552 19.659 31.485 30.029 1.00 0.00 C ATOM 610 CG PHE A 552 20.847 32.028 30.804 1.00 0.00 C ATOM 611 CD1 PHE A 552 22.038 32.370 30.133 1.00 0.00 C ATOM 612 CD2 PHE A 552 20.722 32.307 32.178 1.00 0.00 C ATOM 613 CE1 PHE A 552 23.097 32.981 30.829 1.00 0.00 C ATOM 614 CE2 PHE A 552 21.774 32.937 32.867 1.00 0.00 C ATOM 615 CZ PHE A 552 22.962 33.273 32.197 1.00 0.00 C ATOM 0 H PHE A 552 21.013 30.606 28.092 1.00 0.00 H new ATOM 0 HA PHE A 552 20.041 29.419 30.472 1.00 0.00 H new ATOM 0 HB2 PHE A 552 19.542 32.084 29.126 1.00 0.00 H new ATOM 0 HB3 PHE A 552 18.764 31.638 30.631 1.00 0.00 H new ATOM 0 HD1 PHE A 552 22.138 32.162 29.078 1.00 0.00 H new ATOM 0 HD2 PHE A 552 19.818 32.037 32.703 1.00 0.00 H new ATOM 0 HE1 PHE A 552 24.013 33.226 30.312 1.00 0.00 H new ATOM 0 HE2 PHE A 552 21.668 33.164 33.918 1.00 0.00 H new ATOM 0 HZ PHE A 552 23.768 33.754 32.731 1.00 0.00 H new ATOM 625 N GLN A 553 17.624 28.963 30.296 1.00 0.00 N ATOM 626 CA GLN A 553 16.202 28.588 30.330 1.00 0.00 C ATOM 627 C GLN A 553 15.228 29.787 30.324 1.00 0.00 C ATOM 628 O GLN A 553 14.039 29.616 30.042 1.00 0.00 O ATOM 629 CB GLN A 553 15.977 27.755 31.606 1.00 0.00 C ATOM 630 CG GLN A 553 16.129 28.521 32.940 1.00 0.00 C ATOM 631 CD GLN A 553 17.442 29.271 33.116 1.00 0.00 C ATOM 632 OE1 GLN A 553 17.551 30.464 32.894 1.00 0.00 O ATOM 633 NE2 GLN A 553 18.552 28.580 33.166 1.00 0.00 N ATOM 0 H GLN A 553 18.080 28.778 31.189 1.00 0.00 H new ATOM 0 HA GLN A 553 15.986 28.030 29.419 1.00 0.00 H new ATOM 0 HB2 GLN A 553 14.976 27.326 31.566 1.00 0.00 H new ATOM 0 HB3 GLN A 553 16.681 26.923 31.604 1.00 0.00 H new ATOM 0 HG2 GLN A 553 15.309 29.234 33.026 1.00 0.00 H new ATOM 0 HG3 GLN A 553 16.022 27.812 33.761 1.00 0.00 H new ATOM 0 HE21 GLN A 553 18.521 27.577 33.349 1.00 0.00 H new ATOM 0 HE22 GLN A 553 19.449 29.044 33.022 1.00 0.00 H new ATOM 642 N ASN A 554 15.706 30.983 30.677 1.00 0.00 N ATOM 643 CA ASN A 554 14.915 32.195 30.882 1.00 0.00 C ATOM 644 C ASN A 554 15.637 33.466 30.390 1.00 0.00 C ATOM 645 O ASN A 554 16.872 33.515 30.361 1.00 0.00 O ATOM 646 CB ASN A 554 14.572 32.333 32.380 1.00 0.00 C ATOM 647 CG ASN A 554 13.269 31.679 32.789 1.00 0.00 C ATOM 648 OD1 ASN A 554 12.225 31.931 32.204 1.00 0.00 O ATOM 649 ND2 ASN A 554 13.254 30.913 33.852 1.00 0.00 N ATOM 0 H ASN A 554 16.702 31.138 30.835 1.00 0.00 H new ATOM 0 HA ASN A 554 14.005 32.097 30.290 1.00 0.00 H new ATOM 0 HB2 ASN A 554 15.382 31.899 32.967 1.00 0.00 H new ATOM 0 HB3 ASN A 554 14.527 33.392 32.633 1.00 0.00 H new ATOM 0 HD21 ASN A 554 12.372 30.528 34.191 1.00 0.00 H new ATOM 0 HD22 ASN A 554 14.124 30.702 34.341 1.00 0.00 H new ATOM 656 N PRO A 555 14.883 34.542 30.101 1.00 0.00 N ATOM 657 CA PRO A 555 15.422 35.896 30.045 1.00 0.00 C ATOM 658 C PRO A 555 15.731 36.426 31.458 1.00 0.00 C ATOM 659 O PRO A 555 16.804 36.981 31.691 1.00 0.00 O ATOM 660 CB PRO A 555 14.326 36.709 29.346 1.00 0.00 C ATOM 661 CG PRO A 555 13.025 36.006 29.742 1.00 0.00 C ATOM 662 CD PRO A 555 13.437 34.545 29.931 1.00 0.00 C ATOM 0 HA PRO A 555 16.369 35.954 29.509 1.00 0.00 H new ATOM 0 HB2 PRO A 555 14.332 37.749 29.673 1.00 0.00 H new ATOM 0 HB3 PRO A 555 14.463 36.714 28.265 1.00 0.00 H new ATOM 0 HG2 PRO A 555 12.608 36.425 30.658 1.00 0.00 H new ATOM 0 HG3 PRO A 555 12.264 36.109 28.969 1.00 0.00 H new ATOM 0 HD2 PRO A 555 12.943 34.112 30.801 1.00 0.00 H new ATOM 0 HD3 PRO A 555 13.147 33.945 29.068 1.00 0.00 H new ATOM 670 N GLU A 556 14.828 36.201 32.421 1.00 0.00 N ATOM 671 CA GLU A 556 14.860 36.789 33.771 1.00 0.00 C ATOM 672 C GLU A 556 15.958 36.235 34.693 1.00 0.00 C ATOM 673 O GLU A 556 16.202 36.801 35.757 1.00 0.00 O ATOM 674 CB GLU A 556 13.486 36.624 34.450 1.00 0.00 C ATOM 675 CG GLU A 556 13.091 35.167 34.785 1.00 0.00 C ATOM 676 CD GLU A 556 12.013 35.050 35.876 1.00 0.00 C ATOM 677 OE1 GLU A 556 11.502 36.079 36.372 1.00 0.00 O ATOM 678 OE2 GLU A 556 11.678 33.912 36.281 1.00 0.00 O ATOM 0 H GLU A 556 14.028 35.585 32.280 1.00 0.00 H new ATOM 0 HA GLU A 556 15.101 37.841 33.621 1.00 0.00 H new ATOM 0 HB2 GLU A 556 13.481 37.206 35.371 1.00 0.00 H new ATOM 0 HB3 GLU A 556 12.723 37.051 33.799 1.00 0.00 H new ATOM 0 HG2 GLU A 556 12.731 34.681 33.878 1.00 0.00 H new ATOM 0 HG3 GLU A 556 13.980 34.624 35.106 1.00 0.00 H new ATOM 685 N GLU A 557 16.594 35.127 34.308 1.00 0.00 N ATOM 686 CA GLU A 557 17.717 34.503 35.020 1.00 0.00 C ATOM 687 C GLU A 557 19.092 35.017 34.547 1.00 0.00 C ATOM 688 O GLU A 557 20.085 34.879 35.270 1.00 0.00 O ATOM 689 CB GLU A 557 17.615 32.976 34.851 1.00 0.00 C ATOM 690 CG GLU A 557 16.420 32.386 35.634 1.00 0.00 C ATOM 691 CD GLU A 557 16.452 30.863 35.870 1.00 0.00 C ATOM 692 OE1 GLU A 557 15.402 30.204 35.668 1.00 0.00 O ATOM 693 OE2 GLU A 557 17.475 30.316 36.352 1.00 0.00 O ATOM 0 H GLU A 557 16.334 34.620 33.462 1.00 0.00 H new ATOM 0 HA GLU A 557 17.646 34.776 36.073 1.00 0.00 H new ATOM 0 HB2 GLU A 557 17.510 32.734 33.793 1.00 0.00 H new ATOM 0 HB3 GLU A 557 18.539 32.511 35.194 1.00 0.00 H new ATOM 0 HG2 GLU A 557 16.365 32.883 36.603 1.00 0.00 H new ATOM 0 HG3 GLU A 557 15.503 32.631 35.098 1.00 0.00 H new ATOM 700 N GLN A 558 19.153 35.613 33.351 1.00 0.00 N ATOM 701 CA GLN A 558 20.386 36.092 32.716 1.00 0.00 C ATOM 702 C GLN A 558 20.783 37.523 33.113 1.00 0.00 C ATOM 703 O GLN A 558 20.125 38.506 32.754 1.00 0.00 O ATOM 704 CB GLN A 558 20.295 35.903 31.191 1.00 0.00 C ATOM 705 CG GLN A 558 21.598 36.325 30.489 1.00 0.00 C ATOM 706 CD GLN A 558 21.811 35.691 29.114 1.00 0.00 C ATOM 707 OE1 GLN A 558 20.900 35.174 28.473 1.00 0.00 O ATOM 708 NE2 GLN A 558 23.030 35.712 28.619 1.00 0.00 N ATOM 0 H GLN A 558 18.323 35.780 32.782 1.00 0.00 H new ATOM 0 HA GLN A 558 21.202 35.479 33.098 1.00 0.00 H new ATOM 0 HB2 GLN A 558 20.081 34.858 30.965 1.00 0.00 H new ATOM 0 HB3 GLN A 558 19.464 36.490 30.800 1.00 0.00 H new ATOM 0 HG2 GLN A 558 21.602 37.409 30.380 1.00 0.00 H new ATOM 0 HG3 GLN A 558 22.441 36.066 31.129 1.00 0.00 H new ATOM 0 HE21 GLN A 558 23.788 36.141 29.149 1.00 0.00 H new ATOM 0 HE22 GLN A 558 23.216 35.300 27.705 1.00 0.00 H new ATOM 717 N ASP A 559 21.918 37.623 33.808 1.00 0.00 N ATOM 718 CA ASP A 559 22.576 38.865 34.213 1.00 0.00 C ATOM 719 C ASP A 559 23.644 39.309 33.185 1.00 0.00 C ATOM 720 O ASP A 559 24.248 38.473 32.507 1.00 0.00 O ATOM 721 CB ASP A 559 23.159 38.673 35.624 1.00 0.00 C ATOM 722 CG ASP A 559 22.110 38.317 36.674 1.00 0.00 C ATOM 723 OD1 ASP A 559 22.191 37.236 37.304 1.00 0.00 O ATOM 724 OD2 ASP A 559 21.175 39.115 36.906 1.00 0.00 O ATOM 0 H ASP A 559 22.429 36.797 34.119 1.00 0.00 H new ATOM 0 HA ASP A 559 21.846 39.674 34.242 1.00 0.00 H new ATOM 0 HB2 ASP A 559 23.912 37.886 35.593 1.00 0.00 H new ATOM 0 HB3 ASP A 559 23.667 39.589 35.926 1.00 0.00 H new ATOM 729 N GLU A 560 23.893 40.613 33.049 1.00 0.00 N ATOM 730 CA GLU A 560 24.842 41.170 32.069 1.00 0.00 C ATOM 731 C GLU A 560 26.292 41.065 32.586 1.00 0.00 C ATOM 732 O GLU A 560 26.590 41.491 33.705 1.00 0.00 O ATOM 733 CB GLU A 560 24.460 42.631 31.753 1.00 0.00 C ATOM 734 CG GLU A 560 25.213 43.229 30.548 1.00 0.00 C ATOM 735 CD GLU A 560 24.650 42.842 29.168 1.00 0.00 C ATOM 736 OE1 GLU A 560 23.527 42.293 29.058 1.00 0.00 O ATOM 737 OE2 GLU A 560 25.322 43.123 28.146 1.00 0.00 O ATOM 0 H GLU A 560 23.438 41.325 33.621 1.00 0.00 H new ATOM 0 HA GLU A 560 24.786 40.590 31.148 1.00 0.00 H new ATOM 0 HB2 GLU A 560 23.388 42.682 31.561 1.00 0.00 H new ATOM 0 HB3 GLU A 560 24.656 43.245 32.632 1.00 0.00 H new ATOM 0 HG2 GLU A 560 25.203 44.315 30.636 1.00 0.00 H new ATOM 0 HG3 GLU A 560 26.256 42.915 30.599 1.00 0.00 H new ATOM 744 N GLY A 561 27.207 40.498 31.791 1.00 0.00 N ATOM 745 CA GLY A 561 28.590 40.202 32.212 1.00 0.00 C ATOM 746 C GLY A 561 28.762 38.872 32.965 1.00 0.00 C ATOM 747 O GLY A 561 29.860 38.565 33.440 1.00 0.00 O ATOM 0 H GLY A 561 27.011 40.227 30.827 1.00 0.00 H new ATOM 0 HA2 GLY A 561 29.229 40.189 31.329 1.00 0.00 H new ATOM 0 HA3 GLY A 561 28.943 41.013 32.849 1.00 0.00 H new ATOM 751 N TRP A 562 27.686 38.088 33.070 1.00 0.00 N ATOM 752 CA TRP A 562 27.613 36.770 33.708 1.00 0.00 C ATOM 753 C TRP A 562 27.403 35.637 32.697 1.00 0.00 C ATOM 754 O TRP A 562 26.840 35.868 31.625 1.00 0.00 O ATOM 755 CB TRP A 562 26.462 36.809 34.718 1.00 0.00 C ATOM 756 CG TRP A 562 26.716 37.605 35.954 1.00 0.00 C ATOM 757 CD1 TRP A 562 26.752 38.953 36.044 1.00 0.00 C ATOM 758 CD2 TRP A 562 27.189 37.116 37.238 1.00 0.00 C ATOM 759 NE1 TRP A 562 27.166 39.318 37.306 1.00 0.00 N ATOM 760 CE2 TRP A 562 27.484 38.227 38.075 1.00 0.00 C ATOM 761 CE3 TRP A 562 27.362 35.836 37.783 1.00 0.00 C ATOM 762 CZ2 TRP A 562 27.959 38.074 39.382 1.00 0.00 C ATOM 763 CZ3 TRP A 562 27.815 35.667 39.100 1.00 0.00 C ATOM 764 CH2 TRP A 562 28.121 36.779 39.901 1.00 0.00 C ATOM 0 H TRP A 562 26.785 38.375 32.687 1.00 0.00 H new ATOM 0 HA TRP A 562 28.562 36.560 34.201 1.00 0.00 H new ATOM 0 HB2 TRP A 562 25.580 37.214 34.221 1.00 0.00 H new ATOM 0 HB3 TRP A 562 26.223 35.786 35.009 1.00 0.00 H new ATOM 0 HD1 TRP A 562 26.496 39.638 35.249 1.00 0.00 H new ATOM 0 HE1 TRP A 562 27.229 40.283 37.630 1.00 0.00 H new ATOM 0 HE3 TRP A 562 27.143 34.967 37.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 28.198 38.939 39.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 27.930 34.671 39.502 1.00 0.00 H new ATOM 0 HH2 TRP A 562 28.479 36.639 40.910 1.00 0.00 H new ATOM 775 N LEU A 563 27.768 34.402 33.048 1.00 0.00 N ATOM 776 CA LEU A 563 27.493 33.212 32.223 1.00 0.00 C ATOM 777 C LEU A 563 26.919 32.075 33.074 1.00 0.00 C ATOM 778 O LEU A 563 27.164 32.022 34.276 1.00 0.00 O ATOM 779 CB LEU A 563 28.769 32.773 31.474 1.00 0.00 C ATOM 780 CG LEU A 563 28.927 33.385 30.066 1.00 0.00 C ATOM 781 CD1 LEU A 563 30.274 32.951 29.483 1.00 0.00 C ATOM 782 CD2 LEU A 563 27.851 32.903 29.085 1.00 0.00 C ATOM 0 H LEU A 563 28.264 34.193 33.914 1.00 0.00 H new ATOM 0 HA LEU A 563 26.739 33.471 31.479 1.00 0.00 H new ATOM 0 HB2 LEU A 563 29.638 33.043 32.074 1.00 0.00 H new ATOM 0 HB3 LEU A 563 28.768 31.687 31.386 1.00 0.00 H new ATOM 0 HG LEU A 563 28.844 34.465 30.184 1.00 0.00 H new ATOM 0 HD11 LEU A 563 30.395 33.379 28.488 1.00 0.00 H new ATOM 0 HD12 LEU A 563 31.080 33.301 30.128 1.00 0.00 H new ATOM 0 HD13 LEU A 563 30.309 31.864 29.417 1.00 0.00 H new ATOM 0 HD21 LEU A 563 28.012 33.366 28.112 1.00 0.00 H new ATOM 0 HD22 LEU A 563 27.909 31.819 28.985 1.00 0.00 H new ATOM 0 HD23 LEU A 563 26.866 33.181 29.460 1.00 0.00 H new ATOM 794 N MET A 564 26.143 31.180 32.452 1.00 0.00 N ATOM 795 CA MET A 564 25.566 30.001 33.105 1.00 0.00 C ATOM 796 C MET A 564 26.267 28.709 32.685 1.00 0.00 C ATOM 797 O MET A 564 26.625 28.513 31.525 1.00 0.00 O ATOM 798 CB MET A 564 24.050 29.921 32.864 1.00 0.00 C ATOM 799 CG MET A 564 23.401 28.715 33.562 1.00 0.00 C ATOM 800 SD MET A 564 21.602 28.763 33.722 1.00 0.00 S ATOM 801 CE MET A 564 21.402 30.054 34.973 1.00 0.00 C ATOM 0 H MET A 564 25.895 31.256 31.466 1.00 0.00 H new ATOM 0 HA MET A 564 25.730 30.115 34.177 1.00 0.00 H new ATOM 0 HB2 MET A 564 23.581 30.838 33.221 1.00 0.00 H new ATOM 0 HB3 MET A 564 23.859 29.861 31.792 1.00 0.00 H new ATOM 0 HG2 MET A 564 23.673 27.814 33.013 1.00 0.00 H new ATOM 0 HG3 MET A 564 23.832 28.623 34.559 1.00 0.00 H new ATOM 0 HE1 MET A 564 20.607 30.735 34.669 1.00 0.00 H new ATOM 0 HE2 MET A 564 21.143 29.598 35.928 1.00 0.00 H new ATOM 0 HE3 MET A 564 22.335 30.608 35.076 1.00 0.00 H new ATOM 811 N GLY A 565 26.417 27.797 33.636 1.00 0.00 N ATOM 812 CA GLY A 565 26.935 26.460 33.412 1.00 0.00 C ATOM 813 C GLY A 565 26.663 25.529 34.589 1.00 0.00 C ATOM 814 O GLY A 565 25.946 25.869 35.534 1.00 0.00 O ATOM 0 H GLY A 565 26.174 27.975 34.611 1.00 0.00 H new ATOM 0 HA2 GLY A 565 26.484 26.044 32.511 1.00 0.00 H new ATOM 0 HA3 GLY A 565 28.009 26.514 33.235 1.00 0.00 H new ATOM 818 N VAL A 566 27.286 24.358 34.526 1.00 0.00 N ATOM 819 CA VAL A 566 27.354 23.358 35.600 1.00 0.00 C ATOM 820 C VAL A 566 28.791 22.858 35.723 1.00 0.00 C ATOM 821 O VAL A 566 29.477 22.705 34.711 1.00 0.00 O ATOM 822 CB VAL A 566 26.339 22.224 35.346 1.00 0.00 C ATOM 823 CG1 VAL A 566 26.635 21.438 34.063 1.00 0.00 C ATOM 824 CG2 VAL A 566 26.295 21.240 36.518 1.00 0.00 C ATOM 0 H VAL A 566 27.783 24.060 33.687 1.00 0.00 H new ATOM 0 HA VAL A 566 27.076 23.805 36.554 1.00 0.00 H new ATOM 0 HB VAL A 566 25.373 22.718 35.236 1.00 0.00 H new ATOM 0 HG11 VAL A 566 25.889 20.654 33.936 1.00 0.00 H new ATOM 0 HG12 VAL A 566 26.601 22.112 33.207 1.00 0.00 H new ATOM 0 HG13 VAL A 566 27.626 20.988 34.132 1.00 0.00 H new ATOM 0 HG21 VAL A 566 25.570 20.454 36.306 1.00 0.00 H new ATOM 0 HG22 VAL A 566 27.281 20.796 36.658 1.00 0.00 H new ATOM 0 HG23 VAL A 566 26.003 21.768 37.426 1.00 0.00 H new ATOM 834 N LYS A 567 29.295 22.633 36.940 1.00 0.00 N ATOM 835 CA LYS A 567 30.642 22.084 37.115 1.00 0.00 C ATOM 836 C LYS A 567 30.774 20.693 36.516 1.00 0.00 C ATOM 837 O LYS A 567 29.914 19.835 36.715 1.00 0.00 O ATOM 838 CB LYS A 567 31.088 22.121 38.579 1.00 0.00 C ATOM 839 CG LYS A 567 31.539 23.546 38.936 1.00 0.00 C ATOM 840 CD LYS A 567 32.465 23.556 40.148 1.00 0.00 C ATOM 841 CE LYS A 567 31.715 23.433 41.471 1.00 0.00 C ATOM 842 NZ LYS A 567 32.678 23.492 42.589 1.00 0.00 N ATOM 0 H LYS A 567 28.796 22.820 37.810 1.00 0.00 H new ATOM 0 HA LYS A 567 31.321 22.731 36.560 1.00 0.00 H new ATOM 0 HB2 LYS A 567 30.269 21.813 39.229 1.00 0.00 H new ATOM 0 HB3 LYS A 567 31.905 21.417 38.740 1.00 0.00 H new ATOM 0 HG2 LYS A 567 32.051 23.990 38.083 1.00 0.00 H new ATOM 0 HG3 LYS A 567 30.665 24.164 39.140 1.00 0.00 H new ATOM 0 HD2 LYS A 567 33.176 22.735 40.062 1.00 0.00 H new ATOM 0 HD3 LYS A 567 33.044 24.480 40.149 1.00 0.00 H new ATOM 0 HE2 LYS A 567 30.984 24.237 41.563 1.00 0.00 H new ATOM 0 HE3 LYS A 567 31.162 22.494 41.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 567 32.759 22.552 43.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 567 33.608 23.788 42.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 567 32.346 24.177 43.297 1.00 0.00 H new ATOM 856 N GLU A 568 31.868 20.478 35.789 1.00 0.00 N ATOM 857 CA GLU A 568 32.110 19.219 35.096 1.00 0.00 C ATOM 858 C GLU A 568 32.097 18.037 36.066 1.00 0.00 C ATOM 859 O GLU A 568 31.448 17.048 35.760 1.00 0.00 O ATOM 860 CB GLU A 568 33.416 19.270 34.294 1.00 0.00 C ATOM 861 CG GLU A 568 33.603 17.984 33.477 1.00 0.00 C ATOM 862 CD GLU A 568 34.674 18.136 32.397 1.00 0.00 C ATOM 863 OE1 GLU A 568 35.875 18.298 32.729 1.00 0.00 O ATOM 864 OE2 GLU A 568 34.318 18.035 31.202 1.00 0.00 O ATOM 0 H GLU A 568 32.608 21.169 35.665 1.00 0.00 H new ATOM 0 HA GLU A 568 31.294 19.069 34.389 1.00 0.00 H new ATOM 0 HB2 GLU A 568 33.405 20.132 33.627 1.00 0.00 H new ATOM 0 HB3 GLU A 568 34.260 19.402 34.972 1.00 0.00 H new ATOM 0 HG2 GLU A 568 33.877 17.168 34.145 1.00 0.00 H new ATOM 0 HG3 GLU A 568 32.656 17.711 33.011 1.00 0.00 H new ATOM 871 N SER A 569 32.719 18.149 37.244 1.00 0.00 N ATOM 872 CA SER A 569 32.783 17.064 38.230 1.00 0.00 C ATOM 873 C SER A 569 31.405 16.640 38.767 1.00 0.00 C ATOM 874 O SER A 569 31.187 15.457 39.030 1.00 0.00 O ATOM 875 CB SER A 569 33.702 17.482 39.381 1.00 0.00 C ATOM 876 OG SER A 569 33.852 16.422 40.309 1.00 0.00 O ATOM 0 H SER A 569 33.195 19.000 37.543 1.00 0.00 H new ATOM 0 HA SER A 569 33.186 16.189 37.720 1.00 0.00 H new ATOM 0 HB2 SER A 569 34.677 17.770 38.989 1.00 0.00 H new ATOM 0 HB3 SER A 569 33.290 18.357 39.884 1.00 0.00 H new ATOM 0 HG SER A 569 34.443 16.706 41.037 1.00 0.00 H new ATOM 882 N ASP A 570 30.442 17.560 38.896 1.00 0.00 N ATOM 883 CA ASP A 570 29.075 17.220 39.324 1.00 0.00 C ATOM 884 C ASP A 570 28.385 16.423 38.198 1.00 0.00 C ATOM 885 O ASP A 570 27.816 15.349 38.428 1.00 0.00 O ATOM 886 CB ASP A 570 28.300 18.518 39.600 1.00 0.00 C ATOM 887 CG ASP A 570 27.052 18.221 40.427 1.00 0.00 C ATOM 888 OD1 ASP A 570 25.935 18.164 39.867 1.00 0.00 O ATOM 889 OD2 ASP A 570 27.202 18.003 41.654 1.00 0.00 O ATOM 0 H ASP A 570 30.583 18.553 38.709 1.00 0.00 H new ATOM 0 HA ASP A 570 29.100 16.617 40.232 1.00 0.00 H new ATOM 0 HB2 ASP A 570 28.937 19.225 40.131 1.00 0.00 H new ATOM 0 HB3 ASP A 570 28.018 18.989 38.658 1.00 0.00 H new ATOM 894 N TRP A 571 28.518 16.906 36.957 1.00 0.00 N ATOM 895 CA TRP A 571 27.946 16.284 35.765 1.00 0.00 C ATOM 896 C TRP A 571 28.588 14.920 35.445 1.00 0.00 C ATOM 897 O TRP A 571 27.891 13.979 35.057 1.00 0.00 O ATOM 898 CB TRP A 571 28.063 17.291 34.611 1.00 0.00 C ATOM 899 CG TRP A 571 27.485 16.852 33.301 1.00 0.00 C ATOM 900 CD1 TRP A 571 28.169 16.262 32.297 1.00 0.00 C ATOM 901 CD2 TRP A 571 26.077 16.764 32.922 1.00 0.00 C ATOM 902 NE1 TRP A 571 27.298 15.843 31.313 1.00 0.00 N ATOM 903 CE2 TRP A 571 25.991 16.134 31.644 1.00 0.00 C ATOM 904 CE3 TRP A 571 24.869 17.185 33.521 1.00 0.00 C ATOM 905 CZ2 TRP A 571 24.765 15.921 30.999 1.00 0.00 C ATOM 906 CZ3 TRP A 571 23.635 16.993 32.867 1.00 0.00 C ATOM 907 CH2 TRP A 571 23.581 16.351 31.618 1.00 0.00 C ATOM 0 H TRP A 571 29.038 17.759 36.753 1.00 0.00 H new ATOM 0 HA TRP A 571 26.895 16.051 35.935 1.00 0.00 H new ATOM 0 HB2 TRP A 571 27.572 18.217 34.911 1.00 0.00 H new ATOM 0 HB3 TRP A 571 29.118 17.523 34.462 1.00 0.00 H new ATOM 0 HD1 TRP A 571 29.241 16.137 32.269 1.00 0.00 H new ATOM 0 HE1 TRP A 571 27.584 15.378 30.451 1.00 0.00 H new ATOM 0 HE3 TRP A 571 24.891 17.659 34.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 571 24.732 15.432 30.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 571 22.724 17.342 33.330 1.00 0.00 H new ATOM 0 HH2 TRP A 571 22.629 16.189 31.135 1.00 0.00 H new ATOM 918 N ASN A 572 29.897 14.767 35.675 1.00 0.00 N ATOM 919 CA ASN A 572 30.667 13.522 35.529 1.00 0.00 C ATOM 920 C ASN A 572 30.260 12.472 36.579 1.00 0.00 C ATOM 921 O ASN A 572 30.264 11.277 36.285 1.00 0.00 O ATOM 922 CB ASN A 572 32.174 13.849 35.636 1.00 0.00 C ATOM 923 CG ASN A 572 32.998 13.190 34.547 1.00 0.00 C ATOM 924 OD1 ASN A 572 33.096 11.975 34.449 1.00 0.00 O ATOM 925 ND2 ASN A 572 33.635 13.974 33.712 1.00 0.00 N ATOM 0 H ASN A 572 30.479 15.546 35.983 1.00 0.00 H new ATOM 0 HA ASN A 572 30.452 13.090 34.552 1.00 0.00 H new ATOM 0 HB2 ASN A 572 32.311 14.929 35.585 1.00 0.00 H new ATOM 0 HB3 ASN A 572 32.543 13.526 36.610 1.00 0.00 H new ATOM 0 HD21 ASN A 572 34.216 13.571 32.976 1.00 0.00 H new ATOM 0 HD22 ASN A 572 33.550 14.987 33.798 1.00 0.00 H new ATOM 932 N GLN A 573 29.844 12.910 37.774 1.00 0.00 N ATOM 933 CA GLN A 573 29.271 12.056 38.822 1.00 0.00 C ATOM 934 C GLN A 573 27.806 11.655 38.563 1.00 0.00 C ATOM 935 O GLN A 573 27.243 10.903 39.363 1.00 0.00 O ATOM 936 CB GLN A 573 29.438 12.734 40.194 1.00 0.00 C ATOM 937 CG GLN A 573 30.876 12.658 40.729 1.00 0.00 C ATOM 938 CD GLN A 573 31.032 13.495 41.995 1.00 0.00 C ATOM 939 OE1 GLN A 573 30.808 13.024 43.106 1.00 0.00 O ATOM 940 NE2 GLN A 573 31.222 14.788 41.863 1.00 0.00 N ATOM 0 H GLN A 573 29.898 13.892 38.045 1.00 0.00 H new ATOM 0 HA GLN A 573 29.827 11.119 38.810 1.00 0.00 H new ATOM 0 HB2 GLN A 573 29.140 13.780 40.115 1.00 0.00 H new ATOM 0 HB3 GLN A 573 28.764 12.264 40.910 1.00 0.00 H new ATOM 0 HG2 GLN A 573 31.135 11.621 40.940 1.00 0.00 H new ATOM 0 HG3 GLN A 573 31.571 13.011 39.967 1.00 0.00 H new ATOM 0 HE21 GLN A 573 31.409 15.185 40.942 1.00 0.00 H new ATOM 0 HE22 GLN A 573 31.183 15.395 42.682 1.00 0.00 H new ATOM 949 N HIS A 574 27.212 12.118 37.453 1.00 0.00 N ATOM 950 CA HIS A 574 25.822 11.901 37.009 1.00 0.00 C ATOM 951 C HIS A 574 24.742 12.586 37.876 1.00 0.00 C ATOM 952 O HIS A 574 23.568 12.200 37.829 1.00 0.00 O ATOM 953 CB HIS A 574 25.530 10.405 36.763 1.00 0.00 C ATOM 954 CG HIS A 574 26.428 9.715 35.767 1.00 0.00 C ATOM 955 ND1 HIS A 574 26.149 9.486 34.439 1.00 0.00 N ATOM 956 CD2 HIS A 574 27.617 9.094 36.040 1.00 0.00 C ATOM 957 CE1 HIS A 574 27.139 8.740 33.926 1.00 0.00 C ATOM 958 NE2 HIS A 574 28.066 8.476 34.866 1.00 0.00 N ATOM 0 H HIS A 574 27.727 12.698 36.791 1.00 0.00 H new ATOM 0 HA HIS A 574 25.748 12.417 36.052 1.00 0.00 H new ATOM 0 HB2 HIS A 574 25.603 9.879 37.715 1.00 0.00 H new ATOM 0 HB3 HIS A 574 24.499 10.307 36.423 1.00 0.00 H new ATOM 0 HD2 HIS A 574 28.121 9.083 36.995 1.00 0.00 H new ATOM 0 HE1 HIS A 574 27.186 8.399 32.902 1.00 0.00 H new ATOM 0 HE2 HIS A 574 28.923 7.935 34.747 1.00 0.00 H new ATOM 966 N LYS A 575 25.120 13.590 38.675 1.00 0.00 N ATOM 967 CA LYS A 575 24.253 14.269 39.657 1.00 0.00 C ATOM 968 C LYS A 575 23.268 15.254 39.008 1.00 0.00 C ATOM 969 O LYS A 575 23.478 15.681 37.868 1.00 0.00 O ATOM 970 CB LYS A 575 25.147 14.956 40.702 1.00 0.00 C ATOM 971 CG LYS A 575 25.992 13.957 41.519 1.00 0.00 C ATOM 972 CD LYS A 575 27.196 14.599 42.224 1.00 0.00 C ATOM 973 CE LYS A 575 26.915 15.240 43.586 1.00 0.00 C ATOM 974 NZ LYS A 575 25.999 16.404 43.528 1.00 0.00 N ATOM 0 H LYS A 575 26.067 13.968 38.659 1.00 0.00 H new ATOM 0 HA LYS A 575 23.625 13.522 40.142 1.00 0.00 H new ATOM 0 HB2 LYS A 575 25.811 15.659 40.199 1.00 0.00 H new ATOM 0 HB3 LYS A 575 24.523 15.537 41.381 1.00 0.00 H new ATOM 0 HG2 LYS A 575 25.356 13.482 42.266 1.00 0.00 H new ATOM 0 HG3 LYS A 575 26.348 13.169 40.856 1.00 0.00 H new ATOM 0 HD2 LYS A 575 27.964 13.836 42.355 1.00 0.00 H new ATOM 0 HD3 LYS A 575 27.613 15.361 41.566 1.00 0.00 H new ATOM 0 HE2 LYS A 575 26.488 14.487 44.249 1.00 0.00 H new ATOM 0 HE3 LYS A 575 27.859 15.556 44.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 26.152 17.008 44.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 26.188 16.952 42.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 25.014 16.070 43.518 1.00 0.00 H new ATOM 988 N GLU A 576 22.200 15.616 39.723 1.00 0.00 N ATOM 989 CA GLU A 576 21.114 16.466 39.206 1.00 0.00 C ATOM 990 C GLU A 576 21.576 17.856 38.719 1.00 0.00 C ATOM 991 O GLU A 576 22.228 18.620 39.441 1.00 0.00 O ATOM 992 CB GLU A 576 19.940 16.575 40.194 1.00 0.00 C ATOM 993 CG GLU A 576 20.290 17.069 41.606 1.00 0.00 C ATOM 994 CD GLU A 576 20.739 15.991 42.603 1.00 0.00 C ATOM 995 OE1 GLU A 576 20.983 14.817 42.235 1.00 0.00 O ATOM 996 OE2 GLU A 576 20.892 16.312 43.807 1.00 0.00 O ATOM 0 H GLU A 576 22.059 15.325 40.691 1.00 0.00 H new ATOM 0 HA GLU A 576 20.755 15.949 38.316 1.00 0.00 H new ATOM 0 HB2 GLU A 576 19.195 17.248 39.769 1.00 0.00 H new ATOM 0 HB3 GLU A 576 19.471 15.595 40.280 1.00 0.00 H new ATOM 0 HG2 GLU A 576 21.083 17.812 41.523 1.00 0.00 H new ATOM 0 HG3 GLU A 576 19.418 17.577 42.018 1.00 0.00 H new ATOM 1003 N LEU A 577 21.203 18.190 37.481 1.00 0.00 N ATOM 1004 CA LEU A 577 21.631 19.391 36.761 1.00 0.00 C ATOM 1005 C LEU A 577 20.921 20.648 37.274 1.00 0.00 C ATOM 1006 O LEU A 577 21.560 21.662 37.553 1.00 0.00 O ATOM 1007 CB LEU A 577 21.365 19.139 35.263 1.00 0.00 C ATOM 1008 CG LEU A 577 21.650 20.322 34.318 1.00 0.00 C ATOM 1009 CD1 LEU A 577 23.112 20.752 34.356 1.00 0.00 C ATOM 1010 CD2 LEU A 577 21.291 20.013 32.864 1.00 0.00 C ATOM 0 H LEU A 577 20.570 17.608 36.932 1.00 0.00 H new ATOM 0 HA LEU A 577 22.692 19.578 36.927 1.00 0.00 H new ATOM 0 HB2 LEU A 577 21.971 18.291 34.944 1.00 0.00 H new ATOM 0 HB3 LEU A 577 20.321 18.848 35.144 1.00 0.00 H new ATOM 0 HG LEU A 577 21.017 21.130 34.685 1.00 0.00 H new ATOM 0 HD11 LEU A 577 23.263 21.588 33.674 1.00 0.00 H new ATOM 0 HD12 LEU A 577 23.375 21.058 35.369 1.00 0.00 H new ATOM 0 HD13 LEU A 577 23.745 19.918 34.053 1.00 0.00 H new ATOM 0 HD21 LEU A 577 21.512 20.881 32.242 1.00 0.00 H new ATOM 0 HD22 LEU A 577 21.876 19.161 32.518 1.00 0.00 H new ATOM 0 HD23 LEU A 577 20.229 19.777 32.794 1.00 0.00 H new ATOM 1022 N GLU A 578 19.601 20.563 37.457 1.00 0.00 N ATOM 1023 CA GLU A 578 18.745 21.699 37.831 1.00 0.00 C ATOM 1024 C GLU A 578 19.082 22.307 39.206 1.00 0.00 C ATOM 1025 O GLU A 578 18.724 23.451 39.479 1.00 0.00 O ATOM 1026 CB GLU A 578 17.264 21.286 37.737 1.00 0.00 C ATOM 1027 CG GLU A 578 16.816 20.179 38.713 1.00 0.00 C ATOM 1028 CD GLU A 578 15.397 19.656 38.418 1.00 0.00 C ATOM 1029 OE1 GLU A 578 14.737 20.123 37.453 1.00 0.00 O ATOM 1030 OE2 GLU A 578 14.903 18.765 39.151 1.00 0.00 O ATOM 0 H GLU A 578 19.085 19.690 37.348 1.00 0.00 H new ATOM 0 HA GLU A 578 18.944 22.498 37.117 1.00 0.00 H new ATOM 0 HB2 GLU A 578 16.648 22.168 37.910 1.00 0.00 H new ATOM 0 HB3 GLU A 578 17.063 20.951 36.719 1.00 0.00 H new ATOM 0 HG2 GLU A 578 17.521 19.349 38.662 1.00 0.00 H new ATOM 0 HG3 GLU A 578 16.851 20.564 39.732 1.00 0.00 H new ATOM 1037 N LYS A 579 19.804 21.564 40.057 1.00 0.00 N ATOM 1038 CA LYS A 579 20.278 21.982 41.378 1.00 0.00 C ATOM 1039 C LYS A 579 21.709 22.532 41.374 1.00 0.00 C ATOM 1040 O LYS A 579 21.978 23.522 42.058 1.00 0.00 O ATOM 1041 CB LYS A 579 20.144 20.781 42.335 1.00 0.00 C ATOM 1042 CG LYS A 579 20.506 21.098 43.794 1.00 0.00 C ATOM 1043 CD LYS A 579 19.613 22.189 44.404 1.00 0.00 C ATOM 1044 CE LYS A 579 18.129 21.812 44.532 1.00 0.00 C ATOM 1045 NZ LYS A 579 17.912 20.601 45.360 1.00 0.00 N ATOM 0 H LYS A 579 20.085 20.610 39.829 1.00 0.00 H new ATOM 0 HA LYS A 579 19.661 22.815 41.713 1.00 0.00 H new ATOM 0 HB2 LYS A 579 19.119 20.413 42.298 1.00 0.00 H new ATOM 0 HB3 LYS A 579 20.785 19.974 41.980 1.00 0.00 H new ATOM 0 HG2 LYS A 579 20.421 20.190 44.390 1.00 0.00 H new ATOM 0 HG3 LYS A 579 21.547 21.416 43.845 1.00 0.00 H new ATOM 0 HD2 LYS A 579 19.996 22.441 45.393 1.00 0.00 H new ATOM 0 HD3 LYS A 579 19.693 23.088 43.793 1.00 0.00 H new ATOM 0 HE2 LYS A 579 17.583 22.648 44.969 1.00 0.00 H new ATOM 0 HE3 LYS A 579 17.714 21.646 43.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 579 16.891 20.433 45.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 579 18.351 19.780 44.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 579 18.341 20.740 46.297 1.00 0.00 H new ATOM 1059 N CYS A 580 22.631 21.909 40.634 1.00 0.00 N ATOM 1060 CA CYS A 580 24.027 22.361 40.572 1.00 0.00 C ATOM 1061 C CYS A 580 24.211 23.579 39.648 1.00 0.00 C ATOM 1062 O CYS A 580 25.094 24.402 39.902 1.00 0.00 O ATOM 1063 CB CYS A 580 24.923 21.183 40.166 1.00 0.00 C ATOM 1064 SG CYS A 580 26.677 21.667 40.236 1.00 0.00 S ATOM 0 H CYS A 580 22.435 21.085 40.066 1.00 0.00 H new ATOM 0 HA CYS A 580 24.325 22.704 41.563 1.00 0.00 H new ATOM 0 HB2 CYS A 580 24.746 20.337 40.830 1.00 0.00 H new ATOM 0 HB3 CYS A 580 24.669 20.855 39.158 1.00 0.00 H new ATOM 0 HG CYS A 580 26.775 22.959 40.130 1.00 0.00 H new ATOM 1070 N ARG A 581 23.364 23.747 38.618 1.00 0.00 N ATOM 1071 CA ARG A 581 23.465 24.876 37.680 1.00 0.00 C ATOM 1072 C ARG A 581 23.471 26.225 38.393 1.00 0.00 C ATOM 1073 O ARG A 581 22.811 26.421 39.415 1.00 0.00 O ATOM 1074 CB ARG A 581 22.351 24.843 36.619 1.00 0.00 C ATOM 1075 CG ARG A 581 20.965 25.292 37.129 1.00 0.00 C ATOM 1076 CD ARG A 581 19.985 25.255 35.960 1.00 0.00 C ATOM 1077 NE ARG A 581 18.624 25.737 36.303 1.00 0.00 N ATOM 1078 CZ ARG A 581 18.204 26.992 36.343 1.00 0.00 C ATOM 1079 NH1 ARG A 581 18.997 28.017 36.273 1.00 0.00 N ATOM 1080 NH2 ARG A 581 16.939 27.271 36.465 1.00 0.00 N ATOM 0 H ARG A 581 22.595 23.108 38.414 1.00 0.00 H new ATOM 0 HA ARG A 581 24.424 24.760 37.175 1.00 0.00 H new ATOM 0 HB2 ARG A 581 22.642 25.483 35.786 1.00 0.00 H new ATOM 0 HB3 ARG A 581 22.269 23.829 36.229 1.00 0.00 H new ATOM 0 HG2 ARG A 581 20.625 24.635 37.930 1.00 0.00 H new ATOM 0 HG3 ARG A 581 21.022 26.298 37.544 1.00 0.00 H new ATOM 0 HD2 ARG A 581 20.381 25.863 35.147 1.00 0.00 H new ATOM 0 HD3 ARG A 581 19.915 24.232 35.589 1.00 0.00 H new ATOM 0 HE ARG A 581 17.935 25.021 36.534 1.00 0.00 H new ATOM 0 HH11 ARG A 581 20.003 27.878 36.182 1.00 0.00 H new ATOM 0 HH12 ARG A 581 18.614 28.962 36.309 1.00 0.00 H new ATOM 0 HH21 ARG A 581 16.255 26.518 36.531 1.00 0.00 H new ATOM 0 HH22 ARG A 581 16.632 28.243 36.494 1.00 0.00 H new ATOM 1094 N GLY A 582 24.153 27.182 37.788 1.00 0.00 N ATOM 1095 CA GLY A 582 24.211 28.551 38.299 1.00 0.00 C ATOM 1096 C GLY A 582 24.895 29.539 37.368 1.00 0.00 C ATOM 1097 O GLY A 582 25.528 29.154 36.383 1.00 0.00 O ATOM 0 H GLY A 582 24.684 27.038 36.929 1.00 0.00 H new ATOM 0 HA2 GLY A 582 23.196 28.897 38.494 1.00 0.00 H new ATOM 0 HA3 GLY A 582 24.735 28.548 39.255 1.00 0.00 H new ATOM 1101 N VAL A 583 24.786 30.817 37.727 1.00 0.00 N ATOM 1102 CA VAL A 583 25.497 31.927 37.090 1.00 0.00 C ATOM 1103 C VAL A 583 26.820 32.215 37.789 1.00 0.00 C ATOM 1104 O VAL A 583 26.889 32.250 39.015 1.00 0.00 O ATOM 1105 CB VAL A 583 24.624 33.189 36.934 1.00 0.00 C ATOM 1106 CG1 VAL A 583 23.331 32.880 36.177 1.00 0.00 C ATOM 1107 CG2 VAL A 583 24.248 33.857 38.260 1.00 0.00 C ATOM 0 H VAL A 583 24.183 31.119 38.492 1.00 0.00 H new ATOM 0 HA VAL A 583 25.732 31.608 36.075 1.00 0.00 H new ATOM 0 HB VAL A 583 25.248 33.884 36.372 1.00 0.00 H new ATOM 0 HG11 VAL A 583 22.738 33.790 36.084 1.00 0.00 H new ATOM 0 HG12 VAL A 583 23.572 32.501 35.184 1.00 0.00 H new ATOM 0 HG13 VAL A 583 22.760 32.129 36.723 1.00 0.00 H new ATOM 0 HG21 VAL A 583 23.634 34.736 38.063 1.00 0.00 H new ATOM 0 HG22 VAL A 583 23.687 33.154 38.876 1.00 0.00 H new ATOM 0 HG23 VAL A 583 25.154 34.157 38.786 1.00 0.00 H new ATOM 1117 N PHE A 584 27.876 32.445 37.017 1.00 0.00 N ATOM 1118 CA PHE A 584 29.197 32.825 37.517 1.00 0.00 C ATOM 1119 C PHE A 584 29.805 34.019 36.760 1.00 0.00 C ATOM 1120 O PHE A 584 29.455 34.251 35.595 1.00 0.00 O ATOM 1121 CB PHE A 584 30.144 31.620 37.553 1.00 0.00 C ATOM 1122 CG PHE A 584 30.331 30.928 36.222 1.00 0.00 C ATOM 1123 CD1 PHE A 584 29.424 29.941 35.801 1.00 0.00 C ATOM 1124 CD2 PHE A 584 31.420 31.282 35.403 1.00 0.00 C ATOM 1125 CE1 PHE A 584 29.623 29.285 34.576 1.00 0.00 C ATOM 1126 CE2 PHE A 584 31.609 30.637 34.171 1.00 0.00 C ATOM 1127 CZ PHE A 584 30.720 29.625 33.770 1.00 0.00 C ATOM 0 H PHE A 584 27.839 32.371 36.000 1.00 0.00 H new ATOM 0 HA PHE A 584 29.058 33.167 38.543 1.00 0.00 H new ATOM 0 HB2 PHE A 584 31.117 31.950 37.916 1.00 0.00 H new ATOM 0 HB3 PHE A 584 29.763 30.896 38.274 1.00 0.00 H new ATOM 0 HD1 PHE A 584 28.575 29.687 36.419 1.00 0.00 H new ATOM 0 HD2 PHE A 584 32.109 32.049 35.723 1.00 0.00 H new ATOM 0 HE1 PHE A 584 28.932 28.519 34.254 1.00 0.00 H new ATOM 0 HE2 PHE A 584 32.434 30.917 33.533 1.00 0.00 H new ATOM 0 HZ PHE A 584 30.882 29.106 32.837 1.00 0.00 H new ATOM 1137 N PRO A 585 30.714 34.785 37.390 1.00 0.00 N ATOM 1138 CA PRO A 585 31.500 35.793 36.691 1.00 0.00 C ATOM 1139 C PRO A 585 32.487 35.117 35.732 1.00 0.00 C ATOM 1140 O PRO A 585 33.460 34.498 36.163 1.00 0.00 O ATOM 1141 CB PRO A 585 32.210 36.567 37.799 1.00 0.00 C ATOM 1142 CG PRO A 585 32.365 35.541 38.923 1.00 0.00 C ATOM 1143 CD PRO A 585 31.097 34.715 38.798 1.00 0.00 C ATOM 0 HA PRO A 585 30.895 36.458 36.075 1.00 0.00 H new ATOM 0 HB2 PRO A 585 33.177 36.944 37.466 1.00 0.00 H new ATOM 0 HB3 PRO A 585 31.626 37.429 38.122 1.00 0.00 H new ATOM 0 HG2 PRO A 585 33.260 34.932 38.794 1.00 0.00 H new ATOM 0 HG3 PRO A 585 32.442 36.019 39.900 1.00 0.00 H new ATOM 0 HD2 PRO A 585 31.270 33.684 39.105 1.00 0.00 H new ATOM 0 HD3 PRO A 585 30.308 35.110 39.438 1.00 0.00 H new ATOM 1151 N GLU A 586 32.273 35.252 34.421 1.00 0.00 N ATOM 1152 CA GLU A 586 33.151 34.645 33.404 1.00 0.00 C ATOM 1153 C GLU A 586 34.628 35.073 33.575 1.00 0.00 C ATOM 1154 O GLU A 586 35.541 34.290 33.306 1.00 0.00 O ATOM 1155 CB GLU A 586 32.621 35.000 31.997 1.00 0.00 C ATOM 1156 CG GLU A 586 32.864 36.468 31.604 1.00 0.00 C ATOM 1157 CD GLU A 586 32.206 36.911 30.288 1.00 0.00 C ATOM 1158 OE1 GLU A 586 31.605 36.098 29.548 1.00 0.00 O ATOM 1159 OE2 GLU A 586 32.347 38.109 29.939 1.00 0.00 O ATOM 0 H GLU A 586 31.493 35.781 34.031 1.00 0.00 H new ATOM 0 HA GLU A 586 33.132 33.563 33.534 1.00 0.00 H new ATOM 0 HB2 GLU A 586 33.099 34.351 31.263 1.00 0.00 H new ATOM 0 HB3 GLU A 586 31.552 34.793 31.957 1.00 0.00 H new ATOM 0 HG2 GLU A 586 32.499 37.108 32.407 1.00 0.00 H new ATOM 0 HG3 GLU A 586 33.939 36.634 31.528 1.00 0.00 H new ATOM 1166 N ASN A 587 34.857 36.282 34.110 1.00 0.00 N ATOM 1167 CA ASN A 587 36.170 36.877 34.370 1.00 0.00 C ATOM 1168 C ASN A 587 36.989 36.167 35.470 1.00 0.00 C ATOM 1169 O ASN A 587 38.168 36.477 35.649 1.00 0.00 O ATOM 1170 CB ASN A 587 36.005 38.386 34.654 1.00 0.00 C ATOM 1171 CG ASN A 587 34.993 38.721 35.735 1.00 0.00 C ATOM 1172 OD1 ASN A 587 33.795 38.522 35.575 1.00 0.00 O ATOM 1173 ND2 ASN A 587 35.425 39.286 36.836 1.00 0.00 N ATOM 0 H ASN A 587 34.092 36.898 34.385 1.00 0.00 H new ATOM 0 HA ASN A 587 36.764 36.737 33.467 1.00 0.00 H new ATOM 0 HB2 ASN A 587 36.973 38.796 34.942 1.00 0.00 H new ATOM 0 HB3 ASN A 587 35.709 38.885 33.731 1.00 0.00 H new ATOM 0 HD21 ASN A 587 34.763 39.561 37.562 1.00 0.00 H new ATOM 0 HD22 ASN A 587 36.423 39.451 36.967 1.00 0.00 H new ATOM 1180 N PHE A 588 36.388 35.218 36.196 1.00 0.00 N ATOM 1181 CA PHE A 588 37.089 34.270 37.070 1.00 0.00 C ATOM 1182 C PHE A 588 37.691 33.026 36.400 1.00 0.00 C ATOM 1183 O PHE A 588 38.446 32.282 37.031 1.00 0.00 O ATOM 1184 CB PHE A 588 36.224 33.901 38.284 1.00 0.00 C ATOM 1185 CG PHE A 588 36.153 34.940 39.388 1.00 0.00 C ATOM 1186 CD1 PHE A 588 35.548 36.194 39.169 1.00 0.00 C ATOM 1187 CD2 PHE A 588 36.641 34.625 40.670 1.00 0.00 C ATOM 1188 CE1 PHE A 588 35.414 37.108 40.222 1.00 0.00 C ATOM 1189 CE2 PHE A 588 36.500 35.544 41.724 1.00 0.00 C ATOM 1190 CZ PHE A 588 35.879 36.782 41.503 1.00 0.00 C ATOM 0 H PHE A 588 35.377 35.084 36.192 1.00 0.00 H new ATOM 0 HA PHE A 588 37.971 34.820 37.398 1.00 0.00 H new ATOM 0 HB2 PHE A 588 35.211 33.699 37.936 1.00 0.00 H new ATOM 0 HB3 PHE A 588 36.606 32.973 38.709 1.00 0.00 H new ATOM 0 HD1 PHE A 588 35.186 36.451 38.185 1.00 0.00 H new ATOM 0 HD2 PHE A 588 37.125 33.675 40.844 1.00 0.00 H new ATOM 0 HE1 PHE A 588 34.951 38.067 40.046 1.00 0.00 H new ATOM 0 HE2 PHE A 588 36.871 35.296 42.707 1.00 0.00 H new ATOM 0 HZ PHE A 588 35.760 37.481 42.317 1.00 0.00 H new ATOM 1200 N THR A 589 37.338 32.763 35.139 1.00 0.00 N ATOM 1201 CA THR A 589 37.673 31.542 34.397 1.00 0.00 C ATOM 1202 C THR A 589 38.436 31.860 33.105 1.00 0.00 C ATOM 1203 O THR A 589 38.608 33.022 32.738 1.00 0.00 O ATOM 1204 CB THR A 589 36.394 30.731 34.110 1.00 0.00 C ATOM 1205 OG1 THR A 589 35.491 31.445 33.290 1.00 0.00 O ATOM 1206 CG2 THR A 589 35.631 30.244 35.353 1.00 0.00 C ATOM 0 H THR A 589 36.789 33.420 34.584 1.00 0.00 H new ATOM 0 HA THR A 589 38.335 30.936 35.015 1.00 0.00 H new ATOM 0 HB THR A 589 36.772 29.847 33.597 1.00 0.00 H new ATOM 0 HG1 THR A 589 35.664 32.406 33.373 1.00 0.00 H new ATOM 0 HG21 THR A 589 34.749 29.685 35.042 1.00 0.00 H new ATOM 0 HG22 THR A 589 36.278 29.600 35.948 1.00 0.00 H new ATOM 0 HG23 THR A 589 35.325 31.102 35.951 1.00 0.00 H new ATOM 1214 N GLU A 590 38.915 30.822 32.418 1.00 0.00 N ATOM 1215 CA GLU A 590 39.482 30.921 31.069 1.00 0.00 C ATOM 1216 C GLU A 590 38.727 29.962 30.138 1.00 0.00 C ATOM 1217 O GLU A 590 38.397 28.841 30.533 1.00 0.00 O ATOM 1218 CB GLU A 590 41.014 30.699 31.074 1.00 0.00 C ATOM 1219 CG GLU A 590 41.499 29.236 31.091 1.00 0.00 C ATOM 1220 CD GLU A 590 43.032 29.087 31.019 1.00 0.00 C ATOM 1221 OE1 GLU A 590 43.542 27.999 31.381 1.00 0.00 O ATOM 1222 OE2 GLU A 590 43.748 30.004 30.541 1.00 0.00 O ATOM 0 H GLU A 590 38.921 29.872 32.788 1.00 0.00 H new ATOM 0 HA GLU A 590 39.347 31.933 30.686 1.00 0.00 H new ATOM 0 HB2 GLU A 590 41.432 31.186 30.193 1.00 0.00 H new ATOM 0 HB3 GLU A 590 41.429 31.206 31.945 1.00 0.00 H new ATOM 0 HG2 GLU A 590 41.139 28.754 32.000 1.00 0.00 H new ATOM 0 HG3 GLU A 590 41.052 28.705 30.250 1.00 0.00 H new ATOM 1229 N ARG A 591 38.443 30.394 28.907 1.00 0.00 N ATOM 1230 CA ARG A 591 37.781 29.599 27.863 1.00 0.00 C ATOM 1231 C ARG A 591 38.678 28.409 27.492 1.00 0.00 C ATOM 1232 O ARG A 591 39.889 28.575 27.331 1.00 0.00 O ATOM 1233 CB ARG A 591 37.525 30.521 26.647 1.00 0.00 C ATOM 1234 CG ARG A 591 36.142 30.398 25.988 1.00 0.00 C ATOM 1235 CD ARG A 591 35.821 28.995 25.462 1.00 0.00 C ATOM 1236 NE ARG A 591 34.955 29.061 24.272 1.00 0.00 N ATOM 1237 CZ ARG A 591 34.780 28.093 23.394 1.00 0.00 C ATOM 1238 NH1 ARG A 591 35.292 26.907 23.551 1.00 0.00 N ATOM 1239 NH2 ARG A 591 34.064 28.283 22.328 1.00 0.00 N ATOM 0 H ARG A 591 38.674 31.338 28.597 1.00 0.00 H new ATOM 0 HA ARG A 591 36.827 29.202 28.211 1.00 0.00 H new ATOM 0 HB2 ARG A 591 37.664 31.555 26.964 1.00 0.00 H new ATOM 0 HB3 ARG A 591 38.285 30.314 25.893 1.00 0.00 H new ATOM 0 HG2 ARG A 591 35.380 30.686 26.712 1.00 0.00 H new ATOM 0 HG3 ARG A 591 36.081 31.107 25.162 1.00 0.00 H new ATOM 0 HD2 ARG A 591 36.747 28.476 25.214 1.00 0.00 H new ATOM 0 HD3 ARG A 591 35.329 28.414 26.242 1.00 0.00 H new ATOM 0 HE ARG A 591 34.447 29.931 24.114 1.00 0.00 H new ATOM 0 HH11 ARG A 591 35.853 26.699 24.377 1.00 0.00 H new ATOM 0 HH12 ARG A 591 35.133 26.186 22.848 1.00 0.00 H new ATOM 0 HH21 ARG A 591 33.628 29.190 22.161 1.00 0.00 H new ATOM 0 HH22 ARG A 591 33.937 27.525 21.657 1.00 0.00 H new ATOM 1253 N VAL A 592 38.105 27.220 27.347 1.00 0.00 N ATOM 1254 CA VAL A 592 38.815 25.983 26.947 1.00 0.00 C ATOM 1255 C VAL A 592 38.098 25.346 25.735 1.00 0.00 C ATOM 1256 O VAL A 592 36.910 25.616 25.512 1.00 0.00 O ATOM 1257 CB VAL A 592 38.895 24.990 28.130 1.00 0.00 C ATOM 1258 CG1 VAL A 592 40.027 25.369 29.091 1.00 0.00 C ATOM 1259 CG2 VAL A 592 37.594 24.897 28.922 1.00 0.00 C ATOM 0 H VAL A 592 37.108 27.072 27.505 1.00 0.00 H new ATOM 0 HA VAL A 592 39.836 26.234 26.660 1.00 0.00 H new ATOM 0 HB VAL A 592 39.090 24.016 27.682 1.00 0.00 H new ATOM 0 HG11 VAL A 592 40.061 24.654 29.913 1.00 0.00 H new ATOM 0 HG12 VAL A 592 40.977 25.354 28.558 1.00 0.00 H new ATOM 0 HG13 VAL A 592 39.849 26.369 29.486 1.00 0.00 H new ATOM 0 HG21 VAL A 592 37.715 24.184 29.738 1.00 0.00 H new ATOM 0 HG22 VAL A 592 37.345 25.877 29.330 1.00 0.00 H new ATOM 0 HG23 VAL A 592 36.791 24.563 28.265 1.00 0.00 H new ATOM 1269 N PRO A 593 38.810 24.541 24.915 1.00 0.00 N ATOM 1270 CA PRO A 593 38.320 24.026 23.630 1.00 0.00 C ATOM 1271 C PRO A 593 37.241 22.944 23.748 1.00 0.00 C ATOM 1272 O PRO A 593 37.294 22.092 24.665 1.00 0.00 O ATOM 1273 CB PRO A 593 39.561 23.519 22.885 1.00 0.00 C ATOM 1274 CG PRO A 593 40.505 23.114 24.012 1.00 0.00 C ATOM 1275 CD PRO A 593 40.211 24.165 25.083 1.00 0.00 C ATOM 1276 OXT PRO A 593 36.327 22.959 22.890 1.00 0.00 O ATOM 0 HA PRO A 593 37.810 24.823 23.088 1.00 0.00 H new ATOM 0 HB2 PRO A 593 39.324 22.676 22.236 1.00 0.00 H new ATOM 0 HB3 PRO A 593 39.996 24.294 22.254 1.00 0.00 H new ATOM 0 HG2 PRO A 593 40.302 22.104 24.368 1.00 0.00 H new ATOM 0 HG3 PRO A 593 41.548 23.137 23.696 1.00 0.00 H new ATOM 0 HD2 PRO A 593 40.389 23.764 26.081 1.00 0.00 H new ATOM 0 HD3 PRO A 593 40.863 25.031 24.967 1.00 0.00 H new TER 1284 PRO A 593 ATOM 1285 N SER B1728 44.577 42.208 47.605 1.00 0.00 N ATOM 1286 CA SER B1728 44.919 41.100 46.698 1.00 0.00 C ATOM 1287 C SER B1728 44.391 41.367 45.295 1.00 0.00 C ATOM 1288 O SER B1728 43.338 41.984 45.114 1.00 0.00 O ATOM 1289 CB SER B1728 44.405 39.768 47.242 1.00 0.00 C ATOM 1290 OG SER B1728 42.996 39.804 47.329 1.00 0.00 O ATOM 0 HA SER B1728 46.005 41.033 46.638 1.00 0.00 H new ATOM 0 HB2 SER B1728 44.718 38.952 46.591 1.00 0.00 H new ATOM 0 HB3 SER B1728 44.835 39.575 48.225 1.00 0.00 H new ATOM 0 HG SER B1728 42.698 40.733 47.424 1.00 0.00 H new ATOM 1298 N THR B1729 45.132 40.912 44.284 1.00 0.00 N ATOM 1299 CA THR B1729 44.982 41.222 42.846 1.00 0.00 C ATOM 1300 C THR B1729 43.931 40.421 42.063 1.00 0.00 C ATOM 1301 O THR B1729 43.847 40.470 40.834 1.00 0.00 O ATOM 1302 CB THR B1729 46.352 41.283 42.134 1.00 0.00 C ATOM 1303 OG1 THR B1729 47.392 41.640 43.025 1.00 0.00 O ATOM 1304 CG2 THR B1729 46.402 42.288 40.989 1.00 0.00 C ATOM 0 H THR B1729 45.909 40.272 44.451 1.00 0.00 H new ATOM 0 HA THR B1729 44.544 42.220 42.843 1.00 0.00 H new ATOM 0 HB THR B1729 46.489 40.275 41.742 1.00 0.00 H new ATOM 0 HG1 THR B1729 48.243 41.667 42.540 1.00 0.00 H new ATOM 0 HG21 THR B1729 47.394 42.275 40.537 1.00 0.00 H new ATOM 0 HG22 THR B1729 45.658 42.022 40.239 1.00 0.00 H new ATOM 0 HG23 THR B1729 46.190 43.286 41.372 1.00 0.00 H new ATOM 1312 N VAL B1730 43.139 39.637 42.790 1.00 0.00 N ATOM 1313 CA VAL B1730 42.050 38.785 42.275 1.00 0.00 C ATOM 1314 C VAL B1730 40.914 39.587 41.597 1.00 0.00 C ATOM 1315 O VAL B1730 40.683 40.743 41.971 1.00 0.00 O ATOM 1316 CB VAL B1730 41.501 37.873 43.397 1.00 0.00 C ATOM 1317 CG1 VAL B1730 42.616 37.047 44.052 1.00 0.00 C ATOM 1318 CG2 VAL B1730 40.782 38.652 44.505 1.00 0.00 C ATOM 0 H VAL B1730 43.237 39.569 43.803 1.00 0.00 H new ATOM 0 HA VAL B1730 42.482 38.162 41.492 1.00 0.00 H new ATOM 0 HB VAL B1730 40.784 37.219 42.901 1.00 0.00 H new ATOM 0 HG11 VAL B1730 42.191 36.419 44.835 1.00 0.00 H new ATOM 0 HG12 VAL B1730 43.092 36.417 43.300 1.00 0.00 H new ATOM 0 HG13 VAL B1730 43.358 37.717 44.487 1.00 0.00 H new ATOM 0 HG21 VAL B1730 40.420 37.957 45.262 1.00 0.00 H new ATOM 0 HG22 VAL B1730 41.475 39.358 44.962 1.00 0.00 H new ATOM 0 HG23 VAL B1730 39.939 39.196 44.079 1.00 0.00 H new ATOM 1328 N PRO B1731 40.189 39.007 40.617 1.00 0.00 N ATOM 1329 CA PRO B1731 39.033 39.644 39.970 1.00 0.00 C ATOM 1330 C PRO B1731 37.817 39.778 40.908 1.00 0.00 C ATOM 1331 O PRO B1731 37.778 39.184 41.992 1.00 0.00 O ATOM 1332 CB PRO B1731 38.718 38.763 38.752 1.00 0.00 C ATOM 1333 CG PRO B1731 39.198 37.380 39.184 1.00 0.00 C ATOM 1334 CD PRO B1731 40.434 37.701 40.019 1.00 0.00 C ATOM 0 HA PRO B1731 39.264 40.670 39.685 1.00 0.00 H new ATOM 0 HB2 PRO B1731 37.653 38.764 38.519 1.00 0.00 H new ATOM 0 HB3 PRO B1731 39.240 39.109 37.860 1.00 0.00 H new ATOM 0 HG2 PRO B1731 38.442 36.852 39.766 1.00 0.00 H new ATOM 0 HG3 PRO B1731 39.440 36.749 38.328 1.00 0.00 H new ATOM 0 HD2 PRO B1731 40.593 36.944 40.787 1.00 0.00 H new ATOM 0 HD3 PRO B1731 41.330 37.718 39.398 1.00 0.00 H new ATOM 1342 N VAL B1732 36.803 40.536 40.464 1.00 0.00 N ATOM 1343 CA VAL B1732 35.533 40.786 41.179 1.00 0.00 C ATOM 1344 C VAL B1732 34.297 40.601 40.287 1.00 0.00 C ATOM 1345 O VAL B1732 34.309 40.962 39.108 1.00 0.00 O ATOM 1346 CB VAL B1732 35.513 42.151 41.909 1.00 0.00 C ATOM 1347 CG1 VAL B1732 34.421 42.188 42.986 1.00 0.00 C ATOM 1348 CG2 VAL B1732 36.847 42.512 42.579 1.00 0.00 C ATOM 0 H VAL B1732 36.842 41.012 39.563 1.00 0.00 H new ATOM 0 HA VAL B1732 35.480 40.017 41.949 1.00 0.00 H new ATOM 0 HB VAL B1732 35.314 42.882 41.126 1.00 0.00 H new ATOM 0 HG11 VAL B1732 34.431 43.159 43.481 1.00 0.00 H new ATOM 0 HG12 VAL B1732 33.447 42.027 42.523 1.00 0.00 H new ATOM 0 HG13 VAL B1732 34.607 41.404 43.720 1.00 0.00 H new ATOM 0 HG21 VAL B1732 36.757 43.481 43.070 1.00 0.00 H new ATOM 0 HG22 VAL B1732 37.100 41.752 43.319 1.00 0.00 H new ATOM 0 HG23 VAL B1732 37.632 42.559 41.824 1.00 0.00 H new ATOM 1358 N ALA B1733 33.230 39.987 40.802 1.00 0.00 N ATOM 1359 CA ALA B1733 32.030 39.696 40.013 1.00 0.00 C ATOM 1360 C ALA B1733 31.193 40.968 39.700 1.00 0.00 C ATOM 1361 O ALA B1733 31.028 41.808 40.594 1.00 0.00 O ATOM 1362 CB ALA B1733 31.201 38.642 40.751 1.00 0.00 C ATOM 0 H ALA B1733 33.173 39.679 41.773 1.00 0.00 H new ATOM 0 HA ALA B1733 32.339 39.307 39.043 1.00 0.00 H new ATOM 0 HB1 ALA B1733 30.304 38.416 40.175 1.00 0.00 H new ATOM 0 HB2 ALA B1733 31.792 37.735 40.874 1.00 0.00 H new ATOM 0 HB3 ALA B1733 30.916 39.024 41.731 1.00 0.00 H new ATOM 1368 N PRO B1734 30.629 41.134 38.484 1.00 0.00 N ATOM 1369 CA PRO B1734 29.872 42.339 38.108 1.00 0.00 C ATOM 1370 C PRO B1734 28.442 42.405 38.709 1.00 0.00 C ATOM 1371 O PRO B1734 27.937 41.385 39.194 1.00 0.00 O ATOM 1372 CB PRO B1734 29.869 42.349 36.576 1.00 0.00 C ATOM 1373 CG PRO B1734 30.056 40.890 36.169 1.00 0.00 C ATOM 1374 CD PRO B1734 30.795 40.242 37.342 1.00 0.00 C ATOM 0 HA PRO B1734 30.345 43.230 38.522 1.00 0.00 H new ATOM 0 HB2 PRO B1734 28.934 42.750 36.186 1.00 0.00 H new ATOM 0 HB3 PRO B1734 30.672 42.974 36.184 1.00 0.00 H new ATOM 0 HG2 PRO B1734 29.097 40.404 35.990 1.00 0.00 H new ATOM 0 HG3 PRO B1734 30.631 40.808 35.247 1.00 0.00 H new ATOM 0 HD2 PRO B1734 30.387 39.255 37.559 1.00 0.00 H new ATOM 0 HD3 PRO B1734 31.851 40.106 37.107 1.00 0.00 H new ATOM 1382 N PRO B1735 27.754 43.568 38.693 1.00 0.00 N ATOM 1383 CA PRO B1735 26.394 43.727 39.232 1.00 0.00 C ATOM 1384 C PRO B1735 25.322 42.914 38.488 1.00 0.00 C ATOM 1385 O PRO B1735 25.471 42.618 37.295 1.00 0.00 O ATOM 1386 CB PRO B1735 26.081 45.226 39.160 1.00 0.00 C ATOM 1387 CG PRO B1735 27.456 45.884 39.101 1.00 0.00 C ATOM 1388 CD PRO B1735 28.273 44.873 38.306 1.00 0.00 C ATOM 0 HA PRO B1735 26.368 43.340 40.251 1.00 0.00 H new ATOM 0 HB2 PRO B1735 25.484 45.468 38.281 1.00 0.00 H new ATOM 0 HB3 PRO B1735 25.516 45.559 40.031 1.00 0.00 H new ATOM 0 HG2 PRO B1735 27.420 46.855 38.607 1.00 0.00 H new ATOM 0 HG3 PRO B1735 27.870 46.048 40.096 1.00 0.00 H new ATOM 0 HD2 PRO B1735 28.165 45.037 37.234 1.00 0.00 H new ATOM 0 HD3 PRO B1735 29.335 44.958 38.536 1.00 0.00 H new ATOM 1396 N ARG B1736 24.222 42.576 39.183 1.00 0.00 N ATOM 1397 CA ARG B1736 23.151 41.681 38.693 1.00 0.00 C ATOM 1398 C ARG B1736 21.761 42.343 38.734 1.00 0.00 C ATOM 1399 O ARG B1736 21.590 43.424 39.314 1.00 0.00 O ATOM 1400 CB ARG B1736 23.187 40.341 39.458 1.00 0.00 C ATOM 1401 CG ARG B1736 24.600 39.767 39.650 1.00 0.00 C ATOM 1402 CD ARG B1736 24.658 38.269 39.985 1.00 0.00 C ATOM 1403 NE ARG B1736 23.766 37.886 41.088 1.00 0.00 N ATOM 1404 CZ ARG B1736 22.798 36.995 41.075 1.00 0.00 C ATOM 1405 NH1 ARG B1736 22.342 36.450 39.986 1.00 0.00 N ATOM 1406 NH2 ARG B1736 22.280 36.649 42.214 1.00 0.00 N ATOM 0 H ARG B1736 24.046 42.925 40.125 1.00 0.00 H new ATOM 0 HA ARG B1736 23.342 41.475 37.640 1.00 0.00 H new ATOM 0 HB2 ARG B1736 22.727 40.481 40.436 1.00 0.00 H new ATOM 0 HB3 ARG B1736 22.580 39.612 38.921 1.00 0.00 H new ATOM 0 HG2 ARG B1736 25.172 39.942 38.739 1.00 0.00 H new ATOM 0 HG3 ARG B1736 25.094 40.321 40.448 1.00 0.00 H new ATOM 0 HD2 ARG B1736 24.394 37.695 39.097 1.00 0.00 H new ATOM 0 HD3 ARG B1736 25.682 38.001 40.245 1.00 0.00 H new ATOM 0 HE ARG B1736 23.916 38.371 41.973 1.00 0.00 H new ATOM 0 HH11 ARG B1736 22.737 36.709 39.082 1.00 0.00 H new ATOM 0 HH12 ARG B1736 21.589 35.764 40.036 1.00 0.00 H new ATOM 0 HH21 ARG B1736 22.625 37.065 43.079 1.00 0.00 H new ATOM 0 HH22 ARG B1736 21.528 35.961 42.244 1.00 0.00 H new ATOM 1420 N ARG B1737 20.773 41.717 38.085 1.00 0.00 N ATOM 1421 CA ARG B1737 19.419 42.259 37.835 1.00 0.00 C ATOM 1422 C ARG B1737 18.307 41.626 38.684 1.00 0.00 C ATOM 1423 O ARG B1737 18.441 40.494 39.161 1.00 0.00 O ATOM 1424 CB ARG B1737 19.127 42.166 36.325 1.00 0.00 C ATOM 1425 CG ARG B1737 19.883 43.259 35.552 1.00 0.00 C ATOM 1426 CD ARG B1737 19.990 42.945 34.056 1.00 0.00 C ATOM 1427 NE ARG B1737 20.568 44.091 33.329 1.00 0.00 N ATOM 1428 CZ ARG B1737 19.925 45.044 32.674 1.00 0.00 C ATOM 1429 NH1 ARG B1737 18.631 45.041 32.532 1.00 0.00 N ATOM 1430 NH2 ARG B1737 20.583 46.048 32.172 1.00 0.00 N ATOM 0 H ARG B1737 20.893 40.780 37.701 1.00 0.00 H new ATOM 0 HA ARG B1737 19.417 43.301 38.156 1.00 0.00 H new ATOM 0 HB2 ARG B1737 19.420 41.184 35.954 1.00 0.00 H new ATOM 0 HB3 ARG B1737 18.056 42.266 36.151 1.00 0.00 H new ATOM 0 HG2 ARG B1737 19.374 44.213 35.685 1.00 0.00 H new ATOM 0 HG3 ARG B1737 20.883 43.371 35.970 1.00 0.00 H new ATOM 0 HD2 ARG B1737 20.611 42.061 33.907 1.00 0.00 H new ATOM 0 HD3 ARG B1737 19.003 42.713 33.655 1.00 0.00 H new ATOM 0 HE ARG B1737 21.586 44.157 33.332 1.00 0.00 H new ATOM 0 HH11 ARG B1737 18.076 44.285 32.933 1.00 0.00 H new ATOM 0 HH12 ARG B1737 18.172 45.794 32.020 1.00 0.00 H new ATOM 0 HH21 ARG B1737 21.596 46.101 32.283 1.00 0.00 H new ATOM 0 HH22 ARG B1737 20.086 46.782 31.667 1.00 0.00 H new ATOM 1444 N ARG B1738 17.196 42.345 38.872 1.00 0.00 N ATOM 1445 CA ARG B1738 15.996 41.863 39.579 1.00 0.00 C ATOM 1446 C ARG B1738 15.299 40.749 38.789 1.00 0.00 C ATOM 1447 O ARG B1738 14.793 40.989 37.693 1.00 0.00 O ATOM 1448 CB ARG B1738 15.045 43.047 39.864 1.00 0.00 C ATOM 1449 CG ARG B1738 13.680 42.649 40.461 1.00 0.00 C ATOM 1450 CD ARG B1738 13.793 41.864 41.777 1.00 0.00 C ATOM 1451 NE ARG B1738 12.500 41.278 42.167 1.00 0.00 N ATOM 1452 CZ ARG B1738 11.633 41.733 43.051 1.00 0.00 C ATOM 1453 NH1 ARG B1738 11.760 42.878 43.651 1.00 0.00 N ATOM 1454 NH2 ARG B1738 10.575 41.048 43.358 1.00 0.00 N ATOM 0 H ARG B1738 17.100 43.301 38.530 1.00 0.00 H new ATOM 0 HA ARG B1738 16.297 41.431 40.533 1.00 0.00 H new ATOM 0 HB2 ARG B1738 15.539 43.735 40.550 1.00 0.00 H new ATOM 0 HB3 ARG B1738 14.875 43.590 38.935 1.00 0.00 H new ATOM 0 HG2 ARG B1738 13.091 43.550 40.634 1.00 0.00 H new ATOM 0 HG3 ARG B1738 13.136 42.047 39.733 1.00 0.00 H new ATOM 0 HD2 ARG B1738 14.534 41.073 41.667 1.00 0.00 H new ATOM 0 HD3 ARG B1738 14.147 42.526 42.568 1.00 0.00 H new ATOM 0 HE ARG B1738 12.242 40.412 41.694 1.00 0.00 H new ATOM 0 HH11 ARG B1738 12.561 43.475 43.446 1.00 0.00 H new ATOM 0 HH12 ARG B1738 11.058 43.180 44.327 1.00 0.00 H new ATOM 0 HH21 ARG B1738 10.405 40.145 42.914 1.00 0.00 H new ATOM 0 HH22 ARG B1738 9.913 41.412 44.043 1.00 0.00 H new ATOM 1468 N ARG B1739 15.247 39.540 39.353 1.00 0.00 N ATOM 1469 CA ARG B1739 14.459 38.415 38.825 1.00 0.00 C ATOM 1470 C ARG B1739 12.982 38.536 39.232 1.00 0.00 C ATOM 1471 O ARG B1739 12.670 39.023 40.323 1.00 0.00 O ATOM 1472 CB ARG B1739 15.130 37.102 39.256 1.00 0.00 C ATOM 1473 CG ARG B1739 14.467 35.858 38.647 1.00 0.00 C ATOM 1474 CD ARG B1739 15.450 34.686 38.563 1.00 0.00 C ATOM 1475 NE ARG B1739 15.924 34.243 39.888 1.00 0.00 N ATOM 1476 CZ ARG B1739 15.744 33.061 40.448 1.00 0.00 C ATOM 1477 NH1 ARG B1739 14.999 32.142 39.907 1.00 0.00 N ATOM 1478 NH2 ARG B1739 16.307 32.767 41.583 1.00 0.00 N ATOM 0 H ARG B1739 15.759 39.308 40.204 1.00 0.00 H new ATOM 0 HA ARG B1739 14.445 38.429 37.735 1.00 0.00 H new ATOM 0 HB2 ARG B1739 16.180 37.125 38.966 1.00 0.00 H new ATOM 0 HB3 ARG B1739 15.101 37.026 40.343 1.00 0.00 H new ATOM 0 HG2 ARG B1739 13.606 35.570 39.250 1.00 0.00 H new ATOM 0 HG3 ARG B1739 14.093 36.094 37.651 1.00 0.00 H new ATOM 0 HD2 ARG B1739 14.969 33.850 38.056 1.00 0.00 H new ATOM 0 HD3 ARG B1739 16.306 34.978 37.955 1.00 0.00 H new ATOM 0 HE ARG B1739 16.450 34.927 40.433 1.00 0.00 H new ATOM 0 HH11 ARG B1739 14.530 32.323 39.020 1.00 0.00 H new ATOM 0 HH12 ARG B1739 14.884 31.241 40.370 1.00 0.00 H new ATOM 0 HH21 ARG B1739 16.897 33.454 42.053 1.00 0.00 H new ATOM 0 HH22 ARG B1739 16.159 31.850 42.003 1.00 0.00 H new ATOM 1492 N GLY B1740 12.065 38.122 38.358 1.00 0.00 N ATOM 1493 CA GLY B1740 10.634 38.403 38.496 1.00 0.00 C ATOM 1494 C GLY B1740 10.294 39.892 38.398 1.00 0.00 C ATOM 1495 O GLY B1740 11.037 40.670 37.798 1.00 0.00 O ATOM 0 H GLY B1740 12.295 37.577 37.527 1.00 0.00 H new ATOM 0 HA2 GLY B1740 10.089 37.862 37.723 1.00 0.00 H new ATOM 0 HA3 GLY B1740 10.287 38.021 39.456 1.00 0.00 H new ATOM 1499 N ARG B1741 9.157 40.285 38.981 1.00 0.00 N ATOM 1500 CA ARG B1741 8.653 41.667 38.969 1.00 0.00 C ATOM 1501 C ARG B1741 8.717 42.290 40.364 1.00 0.00 C ATOM 1502 O ARG B1741 8.322 41.659 41.344 1.00 0.00 O ATOM 1503 CB ARG B1741 7.223 41.668 38.391 1.00 0.00 C ATOM 1504 CG ARG B1741 6.631 43.058 38.091 1.00 0.00 C ATOM 1505 CD ARG B1741 7.350 43.815 36.962 1.00 0.00 C ATOM 1506 NE ARG B1741 7.201 43.140 35.660 1.00 0.00 N ATOM 1507 CZ ARG B1741 7.448 43.634 34.462 1.00 0.00 C ATOM 1508 NH1 ARG B1741 7.976 44.804 34.256 1.00 0.00 N ATOM 1509 NH2 ARG B1741 7.159 42.919 33.419 1.00 0.00 N ATOM 0 H ARG B1741 8.548 39.641 39.485 1.00 0.00 H new ATOM 0 HA ARG B1741 9.285 42.286 38.333 1.00 0.00 H new ATOM 0 HB2 ARG B1741 7.222 41.085 37.470 1.00 0.00 H new ATOM 0 HB3 ARG B1741 6.565 41.156 39.093 1.00 0.00 H new ATOM 0 HG2 ARG B1741 5.580 42.944 37.826 1.00 0.00 H new ATOM 0 HG3 ARG B1741 6.667 43.660 38.999 1.00 0.00 H new ATOM 0 HD2 ARG B1741 6.951 44.827 36.893 1.00 0.00 H new ATOM 0 HD3 ARG B1741 8.409 43.906 37.204 1.00 0.00 H new ATOM 0 HE ARG B1741 6.867 42.177 35.689 1.00 0.00 H new ATOM 0 HH11 ARG B1741 8.225 45.398 35.047 1.00 0.00 H new ATOM 0 HH12 ARG B1741 8.142 45.128 33.303 1.00 0.00 H new ATOM 0 HH21 ARG B1741 6.748 41.992 33.534 1.00 0.00 H new ATOM 0 HH22 ARG B1741 7.342 43.283 32.484 1.00 0.00 H new ATOM 1523 N ASN B1742 9.127 43.554 40.431 1.00 0.00 N ATOM 1524 CA ASN B1742 9.144 44.466 41.590 1.00 0.00 C ATOM 1525 C ASN B1742 7.792 44.744 42.304 1.00 0.00 C ATOM 1526 O ASN B1742 7.667 45.748 43.009 1.00 0.00 O ATOM 1527 CB ASN B1742 9.789 45.789 41.120 1.00 0.00 C ATOM 1528 CG ASN B1742 9.037 46.483 39.990 1.00 0.00 C ATOM 1529 OD1 ASN B1742 8.146 45.939 39.353 1.00 0.00 O ATOM 1530 ND2 ASN B1742 9.388 47.701 39.665 1.00 0.00 N ATOM 0 H ASN B1742 9.492 44.018 39.599 1.00 0.00 H new ATOM 0 HA ASN B1742 9.714 43.954 42.365 1.00 0.00 H new ATOM 0 HB2 ASN B1742 9.856 46.470 41.969 1.00 0.00 H new ATOM 0 HB3 ASN B1742 10.809 45.587 40.793 1.00 0.00 H new ATOM 0 HD21 ASN B1742 8.921 48.178 38.894 1.00 0.00 H new ATOM 0 HD22 ASN B1742 10.129 48.174 40.183 1.00 0.00 H new ATOM 1537 N LEU B1743 6.775 43.894 42.138 1.00 0.00 N ATOM 1538 CA LEU B1743 5.399 44.114 42.599 1.00 0.00 C ATOM 1539 C LEU B1743 5.315 44.412 44.109 1.00 0.00 C ATOM 1540 O LEU B1743 4.836 45.478 44.506 1.00 0.00 O ATOM 1541 CB LEU B1743 4.570 42.882 42.182 1.00 0.00 C ATOM 1542 CG LEU B1743 3.098 42.898 42.631 1.00 0.00 C ATOM 1543 CD1 LEU B1743 2.317 44.037 41.976 1.00 0.00 C ATOM 1544 CD2 LEU B1743 2.437 41.579 42.235 1.00 0.00 C ATOM 0 H LEU B1743 6.890 43.000 41.661 1.00 0.00 H new ATOM 0 HA LEU B1743 4.990 45.009 42.131 1.00 0.00 H new ATOM 0 HB2 LEU B1743 4.601 42.795 41.096 1.00 0.00 H new ATOM 0 HB3 LEU B1743 5.047 41.990 42.587 1.00 0.00 H new ATOM 0 HG LEU B1743 3.084 43.040 43.712 1.00 0.00 H new ATOM 0 HD11 LEU B1743 1.283 44.013 42.319 1.00 0.00 H new ATOM 0 HD12 LEU B1743 2.768 44.991 42.249 1.00 0.00 H new ATOM 0 HD13 LEU B1743 2.343 43.920 40.893 1.00 0.00 H new ATOM 0 HD21 LEU B1743 1.394 41.586 42.551 1.00 0.00 H new ATOM 0 HD22 LEU B1743 2.488 41.457 41.153 1.00 0.00 H new ATOM 0 HD23 LEU B1743 2.957 40.752 42.718 1.00 0.00 H new ATOM 1556 N THR B1744 5.856 43.520 44.940 1.00 0.00 N ATOM 1557 CA THR B1744 5.946 43.625 46.413 1.00 0.00 C ATOM 1558 C THR B1744 6.826 44.748 46.972 1.00 0.00 C ATOM 1559 O THR B1744 6.569 45.256 48.091 1.00 0.00 O ATOM 1560 CB THR B1744 6.228 42.252 47.057 1.00 0.00 C ATOM 1561 OG1 THR B1744 5.766 41.201 46.224 1.00 0.00 O ATOM 1562 CG2 THR B1744 5.554 42.075 48.416 1.00 0.00 C ATOM 1563 OXT THR B1744 7.750 45.184 46.244 1.00 0.00 O ATOM 0 H THR B1744 6.268 42.654 44.593 1.00 0.00 H new ATOM 0 HA THR B1744 4.951 43.951 46.718 1.00 0.00 H new ATOM 0 HB THR B1744 7.309 42.214 47.188 1.00 0.00 H new ATOM 0 HG1 THR B1744 5.956 40.339 46.649 1.00 0.00 H new ATOM 0 HG21 THR B1744 5.792 41.089 48.815 1.00 0.00 H new ATOM 0 HG22 THR B1744 5.914 42.841 49.103 1.00 0.00 H new ATOM 0 HG23 THR B1744 4.474 42.169 48.302 1.00 0.00 H new TER 1571 THR B1744