USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 624 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 2 LYS NZ :NH3+ -117:sc= 0.387 (180deg=0) USER MOD Set 1.2: A 43 GLN : amide:sc= -0.281 K(o=0.11,f=-3.6!) USER MOD Single : A 3 SER OG : rot 120:sc= -0.0113 USER MOD Single : A 9 ASN : amide:sc=-0.00226 X(o=-0.0023,f=-0.3) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0.413 K(o=0.41,f=-4.4!) USER MOD Single : A 16 SER OG : rot 180:sc= 0.277 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 45:sc= 1.21 USER MOD Single : A 27 TYR OH : rot 119:sc= 0.341 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl 156:sc= -0.027 (180deg=-0.986) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 34 ASN : amide:sc=-0.00649 X(o=-0.0065,f=-0.2) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -1.06 K(o=-1.1,f=-4.2!) USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 49 SER OG : rot 144:sc= 1.26 USER MOD Single : A 56 CYS SG : rot -29:sc= 0.023 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0.26 X(o=0.26,f=-0.0017) USER MOD Single : A 61 MET CE :methyl 173:sc= 0 (180deg=-0.0709) USER MOD Single : A 62 ASN : amide:sc= 0.00556 K(o=0.0056,f=-0.58) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 110:sc= 0.873 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.17 K(o=0.17,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 18.475 33.061 14.976 1.00 0.00 N ATOM 2 CA PRO A 1 18.964 34.006 16.000 1.00 0.00 C ATOM 3 C PRO A 1 20.469 33.894 16.292 1.00 0.00 C ATOM 4 O PRO A 1 21.051 32.829 16.092 1.00 0.00 O ATOM 5 CB PRO A 1 18.078 33.793 17.235 1.00 0.00 C ATOM 6 CG PRO A 1 16.828 33.081 16.703 1.00 0.00 C ATOM 7 CD PRO A 1 17.021 33.112 15.190 1.00 0.00 C ATOM 0 H2 PRO A 1 18.849 32.122 15.112 1.00 0.00 H new ATOM 0 H3 PRO A 1 18.733 33.351 14.033 1.00 0.00 H new ATOM 0 HA PRO A 1 18.879 35.030 15.638 1.00 0.00 H new ATOM 0 HB2 PRO A 1 18.587 33.190 17.987 1.00 0.00 H new ATOM 0 HB3 PRO A 1 17.822 34.742 17.707 1.00 0.00 H new ATOM 0 HG2 PRO A 1 16.757 32.060 17.078 1.00 0.00 H new ATOM 0 HG3 PRO A 1 15.915 33.595 17.002 1.00 0.00 H new ATOM 0 HD2 PRO A 1 16.525 32.266 14.714 1.00 0.00 H new ATOM 0 HD3 PRO A 1 16.593 34.017 14.759 1.00 0.00 H new ATOM 15 N LYS A 2 21.074 34.977 16.800 1.00 0.00 N ATOM 16 CA LYS A 2 22.487 35.107 17.201 1.00 0.00 C ATOM 17 C LYS A 2 22.645 34.954 18.722 1.00 0.00 C ATOM 18 O LYS A 2 23.014 35.881 19.445 1.00 0.00 O ATOM 19 CB LYS A 2 23.033 36.445 16.663 1.00 0.00 C ATOM 20 CG LYS A 2 24.566 36.588 16.732 1.00 0.00 C ATOM 21 CD LYS A 2 25.279 35.783 15.640 1.00 0.00 C ATOM 22 CE LYS A 2 26.784 36.062 15.679 1.00 0.00 C ATOM 23 NZ LYS A 2 27.494 35.396 14.564 1.00 0.00 N ATOM 0 H LYS A 2 20.558 35.843 16.953 1.00 0.00 H new ATOM 0 HA LYS A 2 23.080 34.303 16.765 1.00 0.00 H new ATOM 0 HB2 LYS A 2 22.717 36.560 15.626 1.00 0.00 H new ATOM 0 HB3 LYS A 2 22.580 37.260 17.227 1.00 0.00 H new ATOM 0 HG2 LYS A 2 24.834 37.640 16.637 1.00 0.00 H new ATOM 0 HG3 LYS A 2 24.915 36.257 17.710 1.00 0.00 H new ATOM 0 HD2 LYS A 2 25.095 34.718 15.783 1.00 0.00 H new ATOM 0 HD3 LYS A 2 24.877 36.047 14.662 1.00 0.00 H new ATOM 0 HE2 LYS A 2 26.956 37.137 15.629 1.00 0.00 H new ATOM 0 HE3 LYS A 2 27.193 35.717 16.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 28.165 34.699 14.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 26.805 34.914 13.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 28.012 36.106 14.009 1.00 0.00 H new ATOM 37 N SER A 3 22.332 33.761 19.215 1.00 0.00 N ATOM 38 CA SER A 3 22.483 33.394 20.625 1.00 0.00 C ATOM 39 C SER A 3 23.924 33.000 20.972 1.00 0.00 C ATOM 40 O SER A 3 24.727 32.680 20.095 1.00 0.00 O ATOM 41 CB SER A 3 21.469 32.314 20.988 1.00 0.00 C ATOM 42 OG SER A 3 20.362 32.929 21.594 1.00 0.00 O ATOM 0 H SER A 3 21.959 33.006 18.639 1.00 0.00 H new ATOM 0 HA SER A 3 22.272 34.271 21.237 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.159 31.770 20.096 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.916 31.587 21.665 1.00 0.00 H new ATOM 0 HG SER A 3 19.556 32.745 21.067 1.00 0.00 H new ATOM 48 N ARG A 4 24.286 33.083 22.255 1.00 0.00 N ATOM 49 CA ARG A 4 25.672 33.072 22.753 1.00 0.00 C ATOM 50 C ARG A 4 25.768 32.297 24.075 1.00 0.00 C ATOM 51 O ARG A 4 25.135 32.656 25.067 1.00 0.00 O ATOM 52 CB ARG A 4 26.156 34.530 22.915 1.00 0.00 C ATOM 53 CG ARG A 4 26.182 35.315 21.590 1.00 0.00 C ATOM 54 CD ARG A 4 26.491 36.798 21.806 1.00 0.00 C ATOM 55 NE ARG A 4 26.373 37.552 20.545 1.00 0.00 N ATOM 56 CZ ARG A 4 27.274 37.702 19.594 1.00 0.00 C ATOM 57 NH1 ARG A 4 28.473 37.202 19.649 1.00 0.00 N ATOM 58 NH2 ARG A 4 26.928 38.370 18.538 1.00 0.00 N ATOM 0 H ARG A 4 23.600 33.163 23.006 1.00 0.00 H new ATOM 0 HA ARG A 4 26.317 32.563 22.037 1.00 0.00 H new ATOM 0 HB2 ARG A 4 25.505 35.045 23.621 1.00 0.00 H new ATOM 0 HB3 ARG A 4 27.157 34.527 23.347 1.00 0.00 H new ATOM 0 HG2 ARG A 4 26.931 34.882 20.927 1.00 0.00 H new ATOM 0 HG3 ARG A 4 25.218 35.215 21.091 1.00 0.00 H new ATOM 0 HD2 ARG A 4 25.806 37.212 22.546 1.00 0.00 H new ATOM 0 HD3 ARG A 4 27.499 36.908 22.207 1.00 0.00 H new ATOM 0 HE ARG A 4 25.479 38.018 20.388 1.00 0.00 H new ATOM 0 HH11 ARG A 4 28.762 36.658 20.462 1.00 0.00 H new ATOM 0 HH12 ARG A 4 29.125 37.354 18.879 1.00 0.00 H new ATOM 0 HH21 ARG A 4 25.987 38.758 18.465 1.00 0.00 H new ATOM 0 HH22 ARG A 4 27.597 38.508 17.780 1.00 0.00 H new ATOM 72 N LEU A 5 26.559 31.228 24.062 1.00 0.00 N ATOM 73 CA LEU A 5 26.784 30.251 25.131 1.00 0.00 C ATOM 74 C LEU A 5 28.208 30.427 25.673 1.00 0.00 C ATOM 75 O LEU A 5 29.160 30.349 24.898 1.00 0.00 O ATOM 76 CB LEU A 5 26.562 28.851 24.505 1.00 0.00 C ATOM 77 CG LEU A 5 26.521 27.624 25.431 1.00 0.00 C ATOM 78 CD1 LEU A 5 26.099 26.384 24.646 1.00 0.00 C ATOM 79 CD2 LEU A 5 27.870 27.303 26.059 1.00 0.00 C ATOM 0 H LEU A 5 27.108 31.001 23.233 1.00 0.00 H new ATOM 0 HA LEU A 5 26.103 30.383 25.972 1.00 0.00 H new ATOM 0 HB2 LEU A 5 25.622 28.881 23.955 1.00 0.00 H new ATOM 0 HB3 LEU A 5 27.354 28.687 23.774 1.00 0.00 H new ATOM 0 HG LEU A 5 25.810 27.875 26.218 1.00 0.00 H new ATOM 0 HD11 LEU A 5 26.074 25.522 25.313 1.00 0.00 H new ATOM 0 HD12 LEU A 5 25.108 26.543 24.220 1.00 0.00 H new ATOM 0 HD13 LEU A 5 26.813 26.201 23.843 1.00 0.00 H new ATOM 0 HD21 LEU A 5 27.773 26.427 26.701 1.00 0.00 H new ATOM 0 HD22 LEU A 5 28.598 27.099 25.274 1.00 0.00 H new ATOM 0 HD23 LEU A 5 28.206 28.153 26.653 1.00 0.00 H new ATOM 91 N PHE A 6 28.358 30.619 26.984 1.00 0.00 N ATOM 92 CA PHE A 6 29.659 30.683 27.662 1.00 0.00 C ATOM 93 C PHE A 6 29.823 29.561 28.694 1.00 0.00 C ATOM 94 O PHE A 6 28.882 29.252 29.427 1.00 0.00 O ATOM 95 CB PHE A 6 29.802 32.053 28.327 1.00 0.00 C ATOM 96 CG PHE A 6 31.032 32.222 29.199 1.00 0.00 C ATOM 97 CD1 PHE A 6 32.295 32.371 28.605 1.00 0.00 C ATOM 98 CD2 PHE A 6 30.920 32.247 30.601 1.00 0.00 C ATOM 99 CE1 PHE A 6 33.427 32.616 29.400 1.00 0.00 C ATOM 100 CE2 PHE A 6 32.061 32.430 31.403 1.00 0.00 C ATOM 101 CZ PHE A 6 33.313 32.636 30.800 1.00 0.00 C ATOM 0 H PHE A 6 27.567 30.737 27.618 1.00 0.00 H new ATOM 0 HA PHE A 6 30.446 30.545 26.920 1.00 0.00 H new ATOM 0 HB2 PHE A 6 29.820 32.817 27.549 1.00 0.00 H new ATOM 0 HB3 PHE A 6 28.917 32.238 28.935 1.00 0.00 H new ATOM 0 HD1 PHE A 6 32.397 32.297 27.532 1.00 0.00 H new ATOM 0 HD2 PHE A 6 29.952 32.125 31.064 1.00 0.00 H new ATOM 0 HE1 PHE A 6 34.386 32.789 28.934 1.00 0.00 H new ATOM 0 HE2 PHE A 6 31.975 32.412 32.479 1.00 0.00 H new ATOM 0 HZ PHE A 6 34.186 32.809 31.412 1.00 0.00 H new ATOM 111 N ILE A 7 31.033 28.997 28.784 1.00 0.00 N ATOM 112 CA ILE A 7 31.428 27.987 29.776 1.00 0.00 C ATOM 113 C ILE A 7 32.775 28.369 30.406 1.00 0.00 C ATOM 114 O ILE A 7 33.698 28.749 29.686 1.00 0.00 O ATOM 115 CB ILE A 7 31.540 26.561 29.166 1.00 0.00 C ATOM 116 CG1 ILE A 7 30.578 26.200 28.011 1.00 0.00 C ATOM 117 CG2 ILE A 7 31.323 25.535 30.289 1.00 0.00 C ATOM 118 CD1 ILE A 7 31.080 26.653 26.630 1.00 0.00 C ATOM 0 H ILE A 7 31.792 29.239 28.146 1.00 0.00 H new ATOM 0 HA ILE A 7 30.644 27.965 30.533 1.00 0.00 H new ATOM 0 HB ILE A 7 32.534 26.542 28.719 1.00 0.00 H new ATOM 0 HG12 ILE A 7 30.428 25.120 27.998 1.00 0.00 H new ATOM 0 HG13 ILE A 7 29.606 26.655 28.203 1.00 0.00 H new ATOM 0 HG21 ILE A 7 31.398 24.527 29.881 1.00 0.00 H new ATOM 0 HG22 ILE A 7 32.083 25.672 31.059 1.00 0.00 H new ATOM 0 HG23 ILE A 7 30.334 25.677 30.726 1.00 0.00 H new ATOM 0 HD11 ILE A 7 30.355 26.367 25.868 1.00 0.00 H new ATOM 0 HD12 ILE A 7 31.203 27.736 26.625 1.00 0.00 H new ATOM 0 HD13 ILE A 7 32.038 26.178 26.417 1.00 0.00 H new ATOM 130 N GLY A 8 32.927 28.191 31.721 1.00 0.00 N ATOM 131 CA GLY A 8 34.227 28.178 32.407 1.00 0.00 C ATOM 132 C GLY A 8 34.513 26.842 33.097 1.00 0.00 C ATOM 133 O GLY A 8 33.618 26.017 33.242 1.00 0.00 O ATOM 0 H GLY A 8 32.138 28.049 32.352 1.00 0.00 H new ATOM 0 HA2 GLY A 8 35.017 28.387 31.685 1.00 0.00 H new ATOM 0 HA3 GLY A 8 34.252 28.978 33.147 1.00 0.00 H new ATOM 137 N ASN A 9 35.763 26.615 33.513 1.00 0.00 N ATOM 138 CA ASN A 9 36.197 25.480 34.357 1.00 0.00 C ATOM 139 C ASN A 9 35.906 24.049 33.819 1.00 0.00 C ATOM 140 O ASN A 9 36.027 23.065 34.552 1.00 0.00 O ATOM 141 CB ASN A 9 35.701 25.715 35.803 1.00 0.00 C ATOM 142 CG ASN A 9 36.588 25.059 36.850 1.00 0.00 C ATOM 143 OD1 ASN A 9 37.805 25.154 36.809 1.00 0.00 O ATOM 144 ND2 ASN A 9 36.038 24.428 37.857 1.00 0.00 N ATOM 0 H ASN A 9 36.534 27.235 33.266 1.00 0.00 H new ATOM 0 HA ASN A 9 37.287 25.481 34.331 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.654 26.787 35.995 1.00 0.00 H new ATOM 0 HB3 ASN A 9 34.687 25.328 35.901 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.624 24.027 38.589 1.00 0.00 H new ATOM 0 HD22 ASN A 9 35.023 24.338 37.910 1.00 0.00 H new ATOM 151 N LEU A 10 35.533 23.921 32.540 1.00 0.00 N ATOM 152 CA LEU A 10 35.190 22.667 31.847 1.00 0.00 C ATOM 153 C LEU A 10 35.888 22.500 30.482 1.00 0.00 C ATOM 154 O LEU A 10 36.457 21.426 30.265 1.00 0.00 O ATOM 155 CB LEU A 10 33.659 22.533 31.789 1.00 0.00 C ATOM 156 CG LEU A 10 33.130 21.218 31.184 1.00 0.00 C ATOM 157 CD1 LEU A 10 31.736 20.922 31.739 1.00 0.00 C ATOM 158 CD2 LEU A 10 32.990 21.277 29.659 1.00 0.00 C ATOM 0 H LEU A 10 35.457 24.731 31.925 1.00 0.00 H new ATOM 0 HA LEU A 10 35.585 21.831 32.424 1.00 0.00 H new ATOM 0 HB2 LEU A 10 33.265 22.632 32.800 1.00 0.00 H new ATOM 0 HB3 LEU A 10 33.261 23.365 31.209 1.00 0.00 H new ATOM 0 HG LEU A 10 33.856 20.449 31.448 1.00 0.00 H new ATOM 0 HD11 LEU A 10 31.364 19.992 31.310 1.00 0.00 H new ATOM 0 HD12 LEU A 10 31.789 20.826 32.823 1.00 0.00 H new ATOM 0 HD13 LEU A 10 31.060 21.737 31.480 1.00 0.00 H new ATOM 0 HD21 LEU A 10 32.614 20.323 29.291 1.00 0.00 H new ATOM 0 HD22 LEU A 10 32.294 22.071 29.388 1.00 0.00 H new ATOM 0 HD23 LEU A 10 33.963 21.480 29.212 1.00 0.00 H new ATOM 170 N PRO A 11 35.951 23.513 29.586 1.00 0.00 N ATOM 171 CA PRO A 11 36.723 23.436 28.333 1.00 0.00 C ATOM 172 C PRO A 11 38.252 23.547 28.533 1.00 0.00 C ATOM 173 O PRO A 11 38.982 23.976 27.638 1.00 0.00 O ATOM 174 CB PRO A 11 36.139 24.523 27.419 1.00 0.00 C ATOM 175 CG PRO A 11 35.655 25.571 28.412 1.00 0.00 C ATOM 176 CD PRO A 11 35.142 24.730 29.575 1.00 0.00 C ATOM 0 HA PRO A 11 36.623 22.451 27.878 1.00 0.00 H new ATOM 0 HB2 PRO A 11 36.889 24.926 26.739 1.00 0.00 H new ATOM 0 HB3 PRO A 11 35.324 24.140 26.805 1.00 0.00 H new ATOM 0 HG2 PRO A 11 36.461 26.237 28.720 1.00 0.00 H new ATOM 0 HG3 PRO A 11 34.869 26.196 27.988 1.00 0.00 H new ATOM 0 HD2 PRO A 11 35.237 25.269 30.517 1.00 0.00 H new ATOM 0 HD3 PRO A 11 34.085 24.494 29.448 1.00 0.00 H new ATOM 184 N LEU A 12 38.764 23.160 29.707 1.00 0.00 N ATOM 185 CA LEU A 12 40.188 23.214 30.077 1.00 0.00 C ATOM 186 C LEU A 12 41.041 22.217 29.270 1.00 0.00 C ATOM 187 O LEU A 12 42.250 22.403 29.102 1.00 0.00 O ATOM 188 CB LEU A 12 40.320 22.951 31.593 1.00 0.00 C ATOM 189 CG LEU A 12 39.439 23.837 32.499 1.00 0.00 C ATOM 190 CD1 LEU A 12 39.700 23.542 33.971 1.00 0.00 C ATOM 191 CD2 LEU A 12 39.679 25.323 32.259 1.00 0.00 C ATOM 0 H LEU A 12 38.179 22.787 30.454 1.00 0.00 H new ATOM 0 HA LEU A 12 40.569 24.207 29.837 1.00 0.00 H new ATOM 0 HB2 LEU A 12 40.075 21.907 31.786 1.00 0.00 H new ATOM 0 HB3 LEU A 12 41.362 23.092 31.879 1.00 0.00 H new ATOM 0 HG LEU A 12 38.406 23.599 32.245 1.00 0.00 H new ATOM 0 HD11 LEU A 12 39.067 24.180 34.588 1.00 0.00 H new ATOM 0 HD12 LEU A 12 39.473 22.496 34.178 1.00 0.00 H new ATOM 0 HD13 LEU A 12 40.747 23.739 34.201 1.00 0.00 H new ATOM 0 HD21 LEU A 12 39.037 25.906 32.919 1.00 0.00 H new ATOM 0 HD22 LEU A 12 40.723 25.561 32.465 1.00 0.00 H new ATOM 0 HD23 LEU A 12 39.449 25.566 31.222 1.00 0.00 H new ATOM 203 N LYS A 13 40.389 21.189 28.712 1.00 0.00 N ATOM 204 CA LYS A 13 40.955 20.191 27.793 1.00 0.00 C ATOM 205 C LYS A 13 40.643 20.492 26.315 1.00 0.00 C ATOM 206 O LYS A 13 40.827 19.617 25.468 1.00 0.00 O ATOM 207 CB LYS A 13 40.484 18.791 28.227 1.00 0.00 C ATOM 208 CG LYS A 13 40.888 18.430 29.665 1.00 0.00 C ATOM 209 CD LYS A 13 40.531 16.967 29.959 1.00 0.00 C ATOM 210 CE LYS A 13 40.781 16.595 31.421 1.00 0.00 C ATOM 211 NZ LYS A 13 39.734 17.136 32.314 1.00 0.00 N ATOM 0 H LYS A 13 39.400 21.022 28.899 1.00 0.00 H new ATOM 0 HA LYS A 13 42.042 20.234 27.857 1.00 0.00 H new ATOM 0 HB2 LYS A 13 39.399 18.737 28.138 1.00 0.00 H new ATOM 0 HB3 LYS A 13 40.897 18.049 27.544 1.00 0.00 H new ATOM 0 HG2 LYS A 13 41.958 18.586 29.801 1.00 0.00 H new ATOM 0 HG3 LYS A 13 40.378 19.086 30.370 1.00 0.00 H new ATOM 0 HD2 LYS A 13 39.483 16.795 29.716 1.00 0.00 H new ATOM 0 HD3 LYS A 13 41.119 16.314 29.314 1.00 0.00 H new ATOM 0 HE2 LYS A 13 40.816 15.510 31.519 1.00 0.00 H new ATOM 0 HE3 LYS A 13 41.754 16.975 31.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 39.940 16.862 33.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 39.717 18.173 32.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 38.808 16.754 32.035 1.00 0.00 H new ATOM 225 N ASN A 14 40.149 21.705 26.025 1.00 0.00 N ATOM 226 CA ASN A 14 39.633 22.193 24.737 1.00 0.00 C ATOM 227 C ASN A 14 38.514 21.310 24.130 1.00 0.00 C ATOM 228 O ASN A 14 38.301 20.167 24.542 1.00 0.00 O ATOM 229 CB ASN A 14 40.827 22.469 23.796 1.00 0.00 C ATOM 230 CG ASN A 14 40.550 23.463 22.678 1.00 0.00 C ATOM 231 OD1 ASN A 14 39.450 23.964 22.480 1.00 0.00 O ATOM 232 ND2 ASN A 14 41.551 23.771 21.894 1.00 0.00 N ATOM 0 H ASN A 14 40.096 22.428 26.743 1.00 0.00 H new ATOM 0 HA ASN A 14 39.110 23.135 24.900 1.00 0.00 H new ATOM 0 HB2 ASN A 14 41.661 22.839 24.392 1.00 0.00 H new ATOM 0 HB3 ASN A 14 41.146 21.526 23.352 1.00 0.00 H new ATOM 0 HD21 ASN A 14 41.413 24.425 21.123 1.00 0.00 H new ATOM 0 HD22 ASN A 14 42.470 23.357 22.053 1.00 0.00 H new ATOM 239 N VAL A 15 37.760 21.825 23.158 1.00 0.00 N ATOM 240 CA VAL A 15 36.689 21.085 22.466 1.00 0.00 C ATOM 241 C VAL A 15 36.692 21.429 20.976 1.00 0.00 C ATOM 242 O VAL A 15 36.694 22.606 20.613 1.00 0.00 O ATOM 243 CB VAL A 15 35.298 21.368 23.084 1.00 0.00 C ATOM 244 CG1 VAL A 15 34.267 20.393 22.511 1.00 0.00 C ATOM 245 CG2 VAL A 15 35.252 21.218 24.611 1.00 0.00 C ATOM 0 H VAL A 15 37.873 22.781 22.820 1.00 0.00 H new ATOM 0 HA VAL A 15 36.888 20.020 22.590 1.00 0.00 H new ATOM 0 HB VAL A 15 35.078 22.406 22.834 1.00 0.00 H new ATOM 0 HG11 VAL A 15 33.290 20.597 22.950 1.00 0.00 H new ATOM 0 HG12 VAL A 15 34.212 20.516 21.429 1.00 0.00 H new ATOM 0 HG13 VAL A 15 34.564 19.371 22.745 1.00 0.00 H new ATOM 0 HG21 VAL A 15 34.245 21.433 24.967 1.00 0.00 H new ATOM 0 HG22 VAL A 15 35.524 20.199 24.885 1.00 0.00 H new ATOM 0 HG23 VAL A 15 35.954 21.916 25.066 1.00 0.00 H new ATOM 255 N SER A 16 36.689 20.416 20.107 1.00 0.00 N ATOM 256 CA SER A 16 36.595 20.590 18.648 1.00 0.00 C ATOM 257 C SER A 16 35.246 21.163 18.216 1.00 0.00 C ATOM 258 O SER A 16 34.220 20.863 18.837 1.00 0.00 O ATOM 259 CB SER A 16 36.791 19.237 17.959 1.00 0.00 C ATOM 260 OG SER A 16 36.525 19.308 16.571 1.00 0.00 O ATOM 0 H SER A 16 36.752 19.440 20.395 1.00 0.00 H new ATOM 0 HA SER A 16 37.373 21.296 18.357 1.00 0.00 H new ATOM 0 HB2 SER A 16 37.814 18.895 18.115 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.134 18.498 18.417 1.00 0.00 H new ATOM 0 HG SER A 16 36.662 18.426 16.166 1.00 0.00 H new ATOM 266 N LYS A 17 35.233 21.872 17.075 1.00 0.00 N ATOM 267 CA LYS A 17 34.021 22.226 16.315 1.00 0.00 C ATOM 268 C LYS A 17 33.025 21.082 16.177 1.00 0.00 C ATOM 269 O LYS A 17 31.827 21.331 16.158 1.00 0.00 O ATOM 270 CB LYS A 17 34.410 22.737 14.911 1.00 0.00 C ATOM 271 CG LYS A 17 34.864 21.659 13.911 1.00 0.00 C ATOM 272 CD LYS A 17 35.390 22.297 12.624 1.00 0.00 C ATOM 273 CE LYS A 17 35.644 21.221 11.569 1.00 0.00 C ATOM 274 NZ LYS A 17 36.133 21.812 10.307 1.00 0.00 N ATOM 0 H LYS A 17 36.088 22.224 16.644 1.00 0.00 H new ATOM 0 HA LYS A 17 33.523 23.008 16.888 1.00 0.00 H new ATOM 0 HB2 LYS A 17 33.555 23.264 14.486 1.00 0.00 H new ATOM 0 HB3 LYS A 17 35.212 23.467 15.019 1.00 0.00 H new ATOM 0 HG2 LYS A 17 35.643 21.044 14.362 1.00 0.00 H new ATOM 0 HG3 LYS A 17 34.029 20.997 13.679 1.00 0.00 H new ATOM 0 HD2 LYS A 17 34.669 23.023 12.248 1.00 0.00 H new ATOM 0 HD3 LYS A 17 36.312 22.841 12.829 1.00 0.00 H new ATOM 0 HE2 LYS A 17 36.375 20.505 11.945 1.00 0.00 H new ATOM 0 HE3 LYS A 17 34.724 20.668 11.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 36.296 21.057 9.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 35.424 22.477 9.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 37.024 22.319 10.483 1.00 0.00 H new ATOM 288 N GLU A 18 33.507 19.847 16.058 1.00 0.00 N ATOM 289 CA GLU A 18 32.682 18.663 15.832 1.00 0.00 C ATOM 290 C GLU A 18 32.231 18.010 17.142 1.00 0.00 C ATOM 291 O GLU A 18 31.075 17.607 17.242 1.00 0.00 O ATOM 292 CB GLU A 18 33.474 17.708 14.938 1.00 0.00 C ATOM 293 CG GLU A 18 32.740 16.403 14.619 1.00 0.00 C ATOM 294 CD GLU A 18 33.465 15.620 13.522 1.00 0.00 C ATOM 295 OE1 GLU A 18 34.723 15.583 13.530 1.00 0.00 O ATOM 296 OE2 GLU A 18 32.767 15.030 12.659 1.00 0.00 O ATOM 0 H GLU A 18 34.503 19.637 16.117 1.00 0.00 H new ATOM 0 HA GLU A 18 31.756 18.945 15.332 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.714 18.216 14.004 1.00 0.00 H new ATOM 0 HB3 GLU A 18 34.420 17.471 15.425 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.668 15.793 15.519 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.721 16.623 14.301 1.00 0.00 H new ATOM 303 N ASP A 19 33.092 17.975 18.167 1.00 0.00 N ATOM 304 CA ASP A 19 32.725 17.459 19.492 1.00 0.00 C ATOM 305 C ASP A 19 31.588 18.290 20.105 1.00 0.00 C ATOM 306 O ASP A 19 30.562 17.731 20.489 1.00 0.00 O ATOM 307 CB ASP A 19 33.930 17.454 20.443 1.00 0.00 C ATOM 308 CG ASP A 19 34.955 16.357 20.165 1.00 0.00 C ATOM 309 OD1 ASP A 19 34.603 15.153 20.148 1.00 0.00 O ATOM 310 OD2 ASP A 19 36.152 16.690 20.018 1.00 0.00 O ATOM 0 H ASP A 19 34.056 18.301 18.102 1.00 0.00 H new ATOM 0 HA ASP A 19 32.385 16.432 19.358 1.00 0.00 H new ATOM 0 HB2 ASP A 19 34.428 18.422 20.383 1.00 0.00 H new ATOM 0 HB3 ASP A 19 33.569 17.345 21.466 1.00 0.00 H new ATOM 315 N LEU A 20 31.717 19.623 20.136 1.00 0.00 N ATOM 316 CA LEU A 20 30.664 20.490 20.679 1.00 0.00 C ATOM 317 C LEU A 20 29.393 20.457 19.818 1.00 0.00 C ATOM 318 O LEU A 20 28.288 20.410 20.355 1.00 0.00 O ATOM 319 CB LEU A 20 31.208 21.911 20.923 1.00 0.00 C ATOM 320 CG LEU A 20 31.608 22.698 19.660 1.00 0.00 C ATOM 321 CD1 LEU A 20 30.455 23.558 19.134 1.00 0.00 C ATOM 322 CD2 LEU A 20 32.795 23.611 19.968 1.00 0.00 C ATOM 0 H LEU A 20 32.537 20.123 19.793 1.00 0.00 H new ATOM 0 HA LEU A 20 30.359 20.100 21.650 1.00 0.00 H new ATOM 0 HB2 LEU A 20 30.452 22.483 21.461 1.00 0.00 H new ATOM 0 HB3 LEU A 20 32.078 21.840 21.576 1.00 0.00 H new ATOM 0 HG LEU A 20 31.874 21.967 18.896 1.00 0.00 H new ATOM 0 HD11 LEU A 20 30.779 24.096 18.243 1.00 0.00 H new ATOM 0 HD12 LEU A 20 29.609 22.918 18.883 1.00 0.00 H new ATOM 0 HD13 LEU A 20 30.155 24.273 19.900 1.00 0.00 H new ATOM 0 HD21 LEU A 20 33.072 24.164 19.070 1.00 0.00 H new ATOM 0 HD22 LEU A 20 32.520 24.312 20.756 1.00 0.00 H new ATOM 0 HD23 LEU A 20 33.641 23.009 20.298 1.00 0.00 H new ATOM 334 N PHE A 21 29.533 20.429 18.487 1.00 0.00 N ATOM 335 CA PHE A 21 28.394 20.372 17.569 1.00 0.00 C ATOM 336 C PHE A 21 27.608 19.073 17.754 1.00 0.00 C ATOM 337 O PHE A 21 26.379 19.115 17.798 1.00 0.00 O ATOM 338 CB PHE A 21 28.898 20.545 16.130 1.00 0.00 C ATOM 339 CG PHE A 21 27.846 20.511 15.037 1.00 0.00 C ATOM 340 CD1 PHE A 21 27.356 19.282 14.555 1.00 0.00 C ATOM 341 CD2 PHE A 21 27.389 21.714 14.462 1.00 0.00 C ATOM 342 CE1 PHE A 21 26.399 19.265 13.526 1.00 0.00 C ATOM 343 CE2 PHE A 21 26.409 21.695 13.454 1.00 0.00 C ATOM 344 CZ PHE A 21 25.916 20.468 12.982 1.00 0.00 C ATOM 0 H PHE A 21 30.439 20.445 18.019 1.00 0.00 H new ATOM 0 HA PHE A 21 27.703 21.185 17.790 1.00 0.00 H new ATOM 0 HB2 PHE A 21 29.427 21.496 16.065 1.00 0.00 H new ATOM 0 HB3 PHE A 21 29.627 19.760 15.927 1.00 0.00 H new ATOM 0 HD1 PHE A 21 27.715 18.354 14.975 1.00 0.00 H new ATOM 0 HD2 PHE A 21 27.794 22.657 14.798 1.00 0.00 H new ATOM 0 HE1 PHE A 21 26.032 18.321 13.151 1.00 0.00 H new ATOM 0 HE2 PHE A 21 26.036 22.622 13.044 1.00 0.00 H new ATOM 0 HZ PHE A 21 25.168 20.448 12.203 1.00 0.00 H new ATOM 354 N ARG A 22 28.278 17.923 17.912 1.00 0.00 N ATOM 355 CA ARG A 22 27.600 16.631 18.085 1.00 0.00 C ATOM 356 C ARG A 22 27.058 16.429 19.494 1.00 0.00 C ATOM 357 O ARG A 22 25.884 16.084 19.618 1.00 0.00 O ATOM 358 CB ARG A 22 28.468 15.477 17.571 1.00 0.00 C ATOM 359 CG ARG A 22 29.589 15.021 18.510 1.00 0.00 C ATOM 360 CD ARG A 22 30.514 14.097 17.729 1.00 0.00 C ATOM 361 NE ARG A 22 31.630 13.611 18.549 1.00 0.00 N ATOM 362 CZ ARG A 22 32.511 12.711 18.164 1.00 0.00 C ATOM 363 NH1 ARG A 22 32.477 12.193 16.976 1.00 0.00 N ATOM 364 NH2 ARG A 22 33.435 12.307 18.980 1.00 0.00 N ATOM 0 H ARG A 22 29.296 17.862 17.924 1.00 0.00 H new ATOM 0 HA ARG A 22 26.708 16.639 17.458 1.00 0.00 H new ATOM 0 HB2 ARG A 22 27.822 14.624 17.365 1.00 0.00 H new ATOM 0 HB3 ARG A 22 28.913 15.776 16.622 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.141 15.881 18.889 1.00 0.00 H new ATOM 0 HG3 ARG A 22 29.174 14.502 19.374 1.00 0.00 H new ATOM 0 HD2 ARG A 22 29.944 13.247 17.353 1.00 0.00 H new ATOM 0 HD3 ARG A 22 30.906 14.627 16.861 1.00 0.00 H new ATOM 0 HE ARG A 22 31.731 13.999 19.487 1.00 0.00 H new ATOM 0 HH11 ARG A 22 31.756 12.481 16.315 1.00 0.00 H new ATOM 0 HH12 ARG A 22 33.171 11.498 16.703 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.482 12.687 19.926 1.00 0.00 H new ATOM 0 HH22 ARG A 22 34.115 11.610 18.676 1.00 0.00 H new ATOM 378 N ILE A 23 27.817 16.717 20.557 1.00 0.00 N ATOM 379 CA ILE A 23 27.317 16.504 21.927 1.00 0.00 C ATOM 380 C ILE A 23 26.167 17.456 22.285 1.00 0.00 C ATOM 381 O ILE A 23 25.298 17.065 23.061 1.00 0.00 O ATOM 382 CB ILE A 23 28.432 16.484 22.995 1.00 0.00 C ATOM 383 CG1 ILE A 23 29.113 17.850 23.226 1.00 0.00 C ATOM 384 CG2 ILE A 23 29.460 15.387 22.673 1.00 0.00 C ATOM 385 CD1 ILE A 23 28.664 18.503 24.536 1.00 0.00 C ATOM 0 H ILE A 23 28.764 17.092 20.502 1.00 0.00 H new ATOM 0 HA ILE A 23 26.899 15.497 21.933 1.00 0.00 H new ATOM 0 HB ILE A 23 27.944 16.252 23.941 1.00 0.00 H new ATOM 0 HG12 ILE A 23 30.195 17.718 23.240 1.00 0.00 H new ATOM 0 HG13 ILE A 23 28.884 18.514 22.393 1.00 0.00 H new ATOM 0 HG21 ILE A 23 30.240 15.385 23.434 1.00 0.00 H new ATOM 0 HG22 ILE A 23 28.964 14.416 22.659 1.00 0.00 H new ATOM 0 HG23 ILE A 23 29.906 15.581 21.697 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.169 19.462 24.656 1.00 0.00 H new ATOM 0 HD12 ILE A 23 27.586 18.661 24.513 1.00 0.00 H new ATOM 0 HD13 ILE A 23 28.917 17.852 25.373 1.00 0.00 H new ATOM 397 N PHE A 24 26.082 18.631 21.643 1.00 0.00 N ATOM 398 CA PHE A 24 24.927 19.532 21.728 1.00 0.00 C ATOM 399 C PHE A 24 23.957 19.457 20.528 1.00 0.00 C ATOM 400 O PHE A 24 23.030 20.267 20.457 1.00 0.00 O ATOM 401 CB PHE A 24 25.385 20.976 21.997 1.00 0.00 C ATOM 402 CG PHE A 24 26.187 21.197 23.267 1.00 0.00 C ATOM 403 CD1 PHE A 24 25.664 20.800 24.512 1.00 0.00 C ATOM 404 CD2 PHE A 24 27.432 21.856 23.217 1.00 0.00 C ATOM 405 CE1 PHE A 24 26.379 21.065 25.694 1.00 0.00 C ATOM 406 CE2 PHE A 24 28.145 22.114 24.400 1.00 0.00 C ATOM 407 CZ PHE A 24 27.620 21.719 25.642 1.00 0.00 C ATOM 0 H PHE A 24 26.826 18.985 21.042 1.00 0.00 H new ATOM 0 HA PHE A 24 24.340 19.178 22.575 1.00 0.00 H new ATOM 0 HB2 PHE A 24 25.985 21.309 21.150 1.00 0.00 H new ATOM 0 HB3 PHE A 24 24.502 21.615 22.033 1.00 0.00 H new ATOM 0 HD1 PHE A 24 24.713 20.291 24.560 1.00 0.00 H new ATOM 0 HD2 PHE A 24 27.840 22.164 22.265 1.00 0.00 H new ATOM 0 HE1 PHE A 24 25.971 20.763 26.647 1.00 0.00 H new ATOM 0 HE2 PHE A 24 29.099 22.617 24.354 1.00 0.00 H new ATOM 0 HZ PHE A 24 28.168 21.917 26.551 1.00 0.00 H new ATOM 417 N SER A 25 24.096 18.500 19.597 1.00 0.00 N ATOM 418 CA SER A 25 23.186 18.365 18.437 1.00 0.00 C ATOM 419 C SER A 25 21.714 18.224 18.853 1.00 0.00 C ATOM 420 O SER A 25 20.927 19.095 18.487 1.00 0.00 O ATOM 421 CB SER A 25 23.602 17.239 17.480 1.00 0.00 C ATOM 422 OG SER A 25 24.566 17.720 16.556 1.00 0.00 O ATOM 0 H SER A 25 24.837 17.799 19.622 1.00 0.00 H new ATOM 0 HA SER A 25 23.279 19.302 17.887 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.014 16.403 18.046 1.00 0.00 H new ATOM 0 HB3 SER A 25 22.729 16.863 16.946 1.00 0.00 H new ATOM 0 HG SER A 25 25.243 18.245 17.033 1.00 0.00 H new ATOM 428 N PRO A 26 21.318 17.248 19.698 1.00 0.00 N ATOM 429 CA PRO A 26 19.944 17.162 20.196 1.00 0.00 C ATOM 430 C PRO A 26 19.581 18.251 21.222 1.00 0.00 C ATOM 431 O PRO A 26 18.397 18.492 21.464 1.00 0.00 O ATOM 432 CB PRO A 26 19.803 15.746 20.768 1.00 0.00 C ATOM 433 CG PRO A 26 21.229 15.356 21.149 1.00 0.00 C ATOM 434 CD PRO A 26 22.094 16.093 20.131 1.00 0.00 C ATOM 0 HA PRO A 26 19.237 17.344 19.387 1.00 0.00 H new ATOM 0 HB2 PRO A 26 19.140 15.730 21.633 1.00 0.00 H new ATOM 0 HB3 PRO A 26 19.384 15.059 20.033 1.00 0.00 H new ATOM 0 HG2 PRO A 26 21.467 15.658 22.169 1.00 0.00 H new ATOM 0 HG3 PRO A 26 21.377 14.278 21.093 1.00 0.00 H new ATOM 0 HD2 PRO A 26 23.039 16.404 20.576 1.00 0.00 H new ATOM 0 HD3 PRO A 26 22.336 15.448 19.286 1.00 0.00 H new ATOM 442 N TYR A 27 20.561 18.933 21.826 1.00 0.00 N ATOM 443 CA TYR A 27 20.348 19.925 22.895 1.00 0.00 C ATOM 444 C TYR A 27 19.922 21.306 22.369 1.00 0.00 C ATOM 445 O TYR A 27 19.448 22.141 23.139 1.00 0.00 O ATOM 446 CB TYR A 27 21.600 20.043 23.786 1.00 0.00 C ATOM 447 CG TYR A 27 21.911 18.822 24.639 1.00 0.00 C ATOM 448 CD1 TYR A 27 22.332 17.619 24.042 1.00 0.00 C ATOM 449 CD2 TYR A 27 21.780 18.881 26.042 1.00 0.00 C ATOM 450 CE1 TYR A 27 22.569 16.478 24.830 1.00 0.00 C ATOM 451 CE2 TYR A 27 22.067 17.754 26.838 1.00 0.00 C ATOM 452 CZ TYR A 27 22.460 16.542 26.230 1.00 0.00 C ATOM 453 OH TYR A 27 22.704 15.432 26.970 1.00 0.00 O ATOM 0 H TYR A 27 21.544 18.811 21.583 1.00 0.00 H new ATOM 0 HA TYR A 27 19.516 19.556 23.494 1.00 0.00 H new ATOM 0 HB2 TYR A 27 22.460 20.249 23.149 1.00 0.00 H new ATOM 0 HB3 TYR A 27 21.477 20.903 24.444 1.00 0.00 H new ATOM 0 HD1 TYR A 27 22.474 17.572 22.972 1.00 0.00 H new ATOM 0 HD2 TYR A 27 21.457 19.799 26.511 1.00 0.00 H new ATOM 0 HE1 TYR A 27 22.837 15.545 24.356 1.00 0.00 H new ATOM 0 HE2 TYR A 27 21.986 17.818 27.913 1.00 0.00 H new ATOM 0 HH TYR A 27 23.461 15.598 27.569 1.00 0.00 H new ATOM 463 N GLY A 28 20.042 21.559 21.063 1.00 0.00 N ATOM 464 CA GLY A 28 19.740 22.860 20.467 1.00 0.00 C ATOM 465 C GLY A 28 19.949 22.903 18.956 1.00 0.00 C ATOM 466 O GLY A 28 19.947 21.851 18.318 1.00 0.00 O ATOM 0 H GLY A 28 20.353 20.862 20.387 1.00 0.00 H new ATOM 0 HA2 GLY A 28 18.705 23.121 20.690 1.00 0.00 H new ATOM 0 HA3 GLY A 28 20.368 23.619 20.934 1.00 0.00 H new ATOM 470 N HIS A 29 20.173 24.095 18.389 1.00 0.00 N ATOM 471 CA HIS A 29 20.307 24.282 16.928 1.00 0.00 C ATOM 472 C HIS A 29 21.649 24.857 16.429 1.00 0.00 C ATOM 473 O HIS A 29 21.897 24.773 15.231 1.00 0.00 O ATOM 474 CB HIS A 29 19.106 25.097 16.428 1.00 0.00 C ATOM 475 CG HIS A 29 17.781 24.497 16.818 1.00 0.00 C ATOM 476 ND1 HIS A 29 16.822 25.125 17.615 1.00 0.00 N ATOM 477 CD2 HIS A 29 17.365 23.229 16.537 1.00 0.00 C ATOM 478 CE1 HIS A 29 15.856 24.210 17.809 1.00 0.00 C ATOM 479 NE2 HIS A 29 16.157 23.064 17.171 1.00 0.00 N ATOM 0 H HIS A 29 20.267 24.959 18.923 1.00 0.00 H new ATOM 0 HA HIS A 29 20.311 23.283 16.492 1.00 0.00 H new ATOM 0 HB2 HIS A 29 19.171 26.110 16.826 1.00 0.00 H new ATOM 0 HB3 HIS A 29 19.156 25.178 15.342 1.00 0.00 H new ATOM 0 HD2 HIS A 29 17.883 22.498 15.934 1.00 0.00 H new ATOM 0 HE1 HIS A 29 14.963 24.372 18.395 1.00 0.00 H new ATOM 0 HE2 HIS A 29 15.587 22.218 17.160 1.00 0.00 H new ATOM 487 N ILE A 30 22.506 25.369 17.328 1.00 0.00 N ATOM 488 CA ILE A 30 23.909 25.840 17.138 1.00 0.00 C ATOM 489 C ILE A 30 24.142 26.884 16.012 1.00 0.00 C ATOM 490 O ILE A 30 23.271 27.127 15.186 1.00 0.00 O ATOM 491 CB ILE A 30 24.884 24.630 17.178 1.00 0.00 C ATOM 492 CG1 ILE A 30 26.249 24.932 17.860 1.00 0.00 C ATOM 493 CG2 ILE A 30 25.033 23.902 15.837 1.00 0.00 C ATOM 494 CD1 ILE A 30 27.472 25.204 16.971 1.00 0.00 C ATOM 0 H ILE A 30 22.218 25.478 18.300 1.00 0.00 H new ATOM 0 HA ILE A 30 24.153 26.471 17.993 1.00 0.00 H new ATOM 0 HB ILE A 30 24.387 23.919 17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 30 26.111 25.798 18.507 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.490 24.087 18.505 1.00 0.00 H new ATOM 0 HG21 ILE A 30 25.730 23.071 15.949 1.00 0.00 H new ATOM 0 HG22 ILE A 30 24.062 23.521 15.520 1.00 0.00 H new ATOM 0 HG23 ILE A 30 25.413 24.595 15.087 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.342 25.396 17.598 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.664 24.336 16.341 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.279 26.073 16.342 1.00 0.00 H new ATOM 506 N MET A 31 25.283 27.586 16.005 1.00 0.00 N ATOM 507 CA MET A 31 25.714 28.507 14.932 1.00 0.00 C ATOM 508 C MET A 31 27.238 28.462 14.678 1.00 0.00 C ATOM 509 O MET A 31 27.652 27.993 13.617 1.00 0.00 O ATOM 510 CB MET A 31 25.279 29.964 15.201 1.00 0.00 C ATOM 511 CG MET A 31 23.809 30.324 14.957 1.00 0.00 C ATOM 512 SD MET A 31 23.386 30.795 13.253 1.00 0.00 S ATOM 513 CE MET A 31 23.095 29.193 12.457 1.00 0.00 C ATOM 0 H MET A 31 25.957 27.530 16.769 1.00 0.00 H new ATOM 0 HA MET A 31 25.210 28.151 14.033 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.514 30.198 16.239 1.00 0.00 H new ATOM 0 HB3 MET A 31 25.892 30.617 14.580 1.00 0.00 H new ATOM 0 HG2 MET A 31 23.193 29.471 15.242 1.00 0.00 H new ATOM 0 HG3 MET A 31 23.541 31.147 15.619 1.00 0.00 H new ATOM 0 HE1 MET A 31 22.443 29.329 11.594 1.00 0.00 H new ATOM 0 HE2 MET A 31 24.045 28.771 12.131 1.00 0.00 H new ATOM 0 HE3 MET A 31 22.621 28.515 13.167 1.00 0.00 H new ATOM 523 N GLN A 32 28.074 28.948 15.608 1.00 0.00 N ATOM 524 CA GLN A 32 29.531 29.174 15.426 1.00 0.00 C ATOM 525 C GLN A 32 30.315 28.882 16.720 1.00 0.00 C ATOM 526 O GLN A 32 29.705 28.551 17.733 1.00 0.00 O ATOM 527 CB GLN A 32 29.825 30.618 14.955 1.00 0.00 C ATOM 528 CG GLN A 32 28.916 31.115 13.820 1.00 0.00 C ATOM 529 CD GLN A 32 29.346 32.440 13.206 1.00 0.00 C ATOM 530 OE1 GLN A 32 30.217 33.148 13.691 1.00 0.00 O ATOM 531 NE2 GLN A 32 28.715 32.829 12.125 1.00 0.00 N ATOM 0 H GLN A 32 27.752 29.206 16.541 1.00 0.00 H new ATOM 0 HA GLN A 32 29.862 28.479 14.654 1.00 0.00 H new ATOM 0 HB2 GLN A 32 29.724 31.292 15.806 1.00 0.00 H new ATOM 0 HB3 GLN A 32 30.862 30.675 14.624 1.00 0.00 H new ATOM 0 HG2 GLN A 32 28.886 30.358 13.036 1.00 0.00 H new ATOM 0 HG3 GLN A 32 27.901 31.218 14.203 1.00 0.00 H new ATOM 0 HE21 GLN A 32 27.988 32.240 11.719 1.00 0.00 H new ATOM 0 HE22 GLN A 32 28.951 33.721 11.690 1.00 0.00 H new ATOM 540 N ILE A 33 31.652 28.996 16.724 1.00 0.00 N ATOM 541 CA ILE A 33 32.499 28.631 17.883 1.00 0.00 C ATOM 542 C ILE A 33 33.685 29.587 18.075 1.00 0.00 C ATOM 543 O ILE A 33 34.246 30.072 17.087 1.00 0.00 O ATOM 544 CB ILE A 33 33.013 27.167 17.771 1.00 0.00 C ATOM 545 CG1 ILE A 33 34.283 27.054 16.894 1.00 0.00 C ATOM 546 CG2 ILE A 33 31.914 26.203 17.279 1.00 0.00 C ATOM 547 CD1 ILE A 33 34.811 25.638 16.717 1.00 0.00 C ATOM 0 H ILE A 33 32.182 29.344 15.925 1.00 0.00 H new ATOM 0 HA ILE A 33 31.860 28.718 18.761 1.00 0.00 H new ATOM 0 HB ILE A 33 33.289 26.865 18.781 1.00 0.00 H new ATOM 0 HG12 ILE A 33 34.067 27.472 15.911 1.00 0.00 H new ATOM 0 HG13 ILE A 33 35.068 27.667 17.336 1.00 0.00 H new ATOM 0 HG21 ILE A 33 32.318 25.193 17.216 1.00 0.00 H new ATOM 0 HG22 ILE A 33 31.078 26.217 17.978 1.00 0.00 H new ATOM 0 HG23 ILE A 33 31.568 26.518 16.294 1.00 0.00 H new ATOM 0 HD11 ILE A 33 35.701 25.658 16.089 1.00 0.00 H new ATOM 0 HD12 ILE A 33 35.064 25.219 17.691 1.00 0.00 H new ATOM 0 HD13 ILE A 33 34.047 25.021 16.244 1.00 0.00 H new ATOM 559 N ASN A 34 34.148 29.743 19.320 1.00 0.00 N ATOM 560 CA ASN A 34 35.499 30.216 19.646 1.00 0.00 C ATOM 561 C ASN A 34 35.896 29.834 21.089 1.00 0.00 C ATOM 562 O ASN A 34 35.357 30.358 22.065 1.00 0.00 O ATOM 563 CB ASN A 34 35.617 31.729 19.378 1.00 0.00 C ATOM 564 CG ASN A 34 34.613 32.601 20.111 1.00 0.00 C ATOM 565 OD1 ASN A 34 33.419 32.588 19.852 1.00 0.00 O ATOM 566 ND2 ASN A 34 35.072 33.429 21.014 1.00 0.00 N ATOM 0 H ASN A 34 33.584 29.540 20.145 1.00 0.00 H new ATOM 0 HA ASN A 34 36.212 29.715 18.992 1.00 0.00 H new ATOM 0 HB2 ASN A 34 36.621 32.052 19.652 1.00 0.00 H new ATOM 0 HB3 ASN A 34 35.508 31.901 18.307 1.00 0.00 H new ATOM 0 HD21 ASN A 34 34.434 34.060 21.499 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.068 33.443 21.233 1.00 0.00 H new ATOM 573 N ILE A 35 36.859 28.919 21.246 1.00 0.00 N ATOM 574 CA ILE A 35 37.269 28.359 22.550 1.00 0.00 C ATOM 575 C ILE A 35 38.755 28.638 22.806 1.00 0.00 C ATOM 576 O ILE A 35 39.610 28.295 21.984 1.00 0.00 O ATOM 577 CB ILE A 35 36.894 26.860 22.646 1.00 0.00 C ATOM 578 CG1 ILE A 35 35.355 26.703 22.548 1.00 0.00 C ATOM 579 CG2 ILE A 35 37.434 26.238 23.948 1.00 0.00 C ATOM 580 CD1 ILE A 35 34.836 25.265 22.653 1.00 0.00 C ATOM 0 H ILE A 35 37.387 28.537 20.461 1.00 0.00 H new ATOM 0 HA ILE A 35 36.720 28.857 23.349 1.00 0.00 H new ATOM 0 HB ILE A 35 37.356 26.326 21.816 1.00 0.00 H new ATOM 0 HG12 ILE A 35 34.895 27.297 23.338 1.00 0.00 H new ATOM 0 HG13 ILE A 35 35.023 27.123 21.599 1.00 0.00 H new ATOM 0 HG21 ILE A 35 37.157 25.185 23.990 1.00 0.00 H new ATOM 0 HG22 ILE A 35 38.520 26.329 23.971 1.00 0.00 H new ATOM 0 HG23 ILE A 35 37.008 26.760 24.805 1.00 0.00 H new ATOM 0 HD11 ILE A 35 33.749 25.264 22.573 1.00 0.00 H new ATOM 0 HD12 ILE A 35 35.260 24.665 21.847 1.00 0.00 H new ATOM 0 HD13 ILE A 35 35.129 24.841 23.614 1.00 0.00 H new ATOM 592 N LYS A 36 39.053 29.295 23.931 1.00 0.00 N ATOM 593 CA LYS A 36 40.374 29.825 24.301 1.00 0.00 C ATOM 594 C LYS A 36 40.420 30.105 25.808 1.00 0.00 C ATOM 595 O LYS A 36 39.405 30.495 26.390 1.00 0.00 O ATOM 596 CB LYS A 36 40.618 31.116 23.496 1.00 0.00 C ATOM 597 CG LYS A 36 42.036 31.685 23.664 1.00 0.00 C ATOM 598 CD LYS A 36 42.303 32.909 22.778 1.00 0.00 C ATOM 599 CE LYS A 36 41.306 34.028 23.079 1.00 0.00 C ATOM 600 NZ LYS A 36 41.562 35.233 22.269 1.00 0.00 N ATOM 0 H LYS A 36 38.348 29.482 24.644 1.00 0.00 H new ATOM 0 HA LYS A 36 41.154 29.099 24.072 1.00 0.00 H new ATOM 0 HB2 LYS A 36 40.438 30.915 22.440 1.00 0.00 H new ATOM 0 HB3 LYS A 36 39.894 31.870 23.805 1.00 0.00 H new ATOM 0 HG2 LYS A 36 42.190 31.959 24.708 1.00 0.00 H new ATOM 0 HG3 LYS A 36 42.763 30.908 23.428 1.00 0.00 H new ATOM 0 HD2 LYS A 36 43.319 33.268 22.943 1.00 0.00 H new ATOM 0 HD3 LYS A 36 42.232 32.625 21.728 1.00 0.00 H new ATOM 0 HE2 LYS A 36 40.294 33.672 22.888 1.00 0.00 H new ATOM 0 HE3 LYS A 36 41.359 34.285 24.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 40.863 35.965 22.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 42.518 35.589 22.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 41.486 34.995 21.259 1.00 0.00 H new ATOM 614 N ASN A 37 41.605 29.992 26.408 1.00 0.00 N ATOM 615 CA ASN A 37 41.853 30.129 27.847 1.00 0.00 C ATOM 616 C ASN A 37 41.062 29.087 28.687 1.00 0.00 C ATOM 617 O ASN A 37 40.576 28.091 28.147 1.00 0.00 O ATOM 618 CB ASN A 37 41.650 31.618 28.233 1.00 0.00 C ATOM 619 CG ASN A 37 42.253 31.988 29.575 1.00 0.00 C ATOM 620 OD1 ASN A 37 42.994 31.217 30.168 1.00 0.00 O ATOM 621 ND2 ASN A 37 41.912 33.131 30.113 1.00 0.00 N ATOM 0 H ASN A 37 42.457 29.794 25.883 1.00 0.00 H new ATOM 0 HA ASN A 37 42.885 29.879 28.092 1.00 0.00 H new ATOM 0 HB2 ASN A 37 42.091 32.248 27.460 1.00 0.00 H new ATOM 0 HB3 ASN A 37 40.582 31.837 28.252 1.00 0.00 H new ATOM 0 HD21 ASN A 37 42.265 33.386 31.035 1.00 0.00 H new ATOM 0 HD22 ASN A 37 41.293 33.767 29.610 1.00 0.00 H new ATOM 628 N ALA A 38 40.909 29.297 29.999 1.00 0.00 N ATOM 629 CA ALA A 38 40.148 28.455 30.933 1.00 0.00 C ATOM 630 C ALA A 38 38.611 28.452 30.698 1.00 0.00 C ATOM 631 O ALA A 38 37.822 28.074 31.573 1.00 0.00 O ATOM 632 CB ALA A 38 40.521 28.896 32.355 1.00 0.00 C ATOM 0 H ALA A 38 41.334 30.100 30.463 1.00 0.00 H new ATOM 0 HA ALA A 38 40.424 27.414 30.763 1.00 0.00 H new ATOM 0 HB1 ALA A 38 39.974 28.292 33.079 1.00 0.00 H new ATOM 0 HB2 ALA A 38 41.592 28.764 32.508 1.00 0.00 H new ATOM 0 HB3 ALA A 38 40.262 29.946 32.490 1.00 0.00 H new ATOM 638 N PHE A 39 38.186 28.894 29.514 1.00 0.00 N ATOM 639 CA PHE A 39 36.821 29.223 29.136 1.00 0.00 C ATOM 640 C PHE A 39 36.528 28.776 27.696 1.00 0.00 C ATOM 641 O PHE A 39 37.415 28.352 26.955 1.00 0.00 O ATOM 642 CB PHE A 39 36.621 30.743 29.256 1.00 0.00 C ATOM 643 CG PHE A 39 37.044 31.378 30.570 1.00 0.00 C ATOM 644 CD1 PHE A 39 36.266 31.197 31.727 1.00 0.00 C ATOM 645 CD2 PHE A 39 38.210 32.165 30.634 1.00 0.00 C ATOM 646 CE1 PHE A 39 36.650 31.792 32.942 1.00 0.00 C ATOM 647 CE2 PHE A 39 38.599 32.757 31.849 1.00 0.00 C ATOM 648 CZ PHE A 39 37.821 32.568 33.003 1.00 0.00 C ATOM 0 H PHE A 39 38.837 29.040 28.743 1.00 0.00 H new ATOM 0 HA PHE A 39 36.135 28.700 29.802 1.00 0.00 H new ATOM 0 HB2 PHE A 39 37.174 31.225 28.450 1.00 0.00 H new ATOM 0 HB3 PHE A 39 35.566 30.963 29.094 1.00 0.00 H new ATOM 0 HD1 PHE A 39 35.369 30.598 31.682 1.00 0.00 H new ATOM 0 HD2 PHE A 39 38.808 32.315 29.747 1.00 0.00 H new ATOM 0 HE1 PHE A 39 36.046 31.653 33.827 1.00 0.00 H new ATOM 0 HE2 PHE A 39 39.496 33.357 31.895 1.00 0.00 H new ATOM 0 HZ PHE A 39 38.122 33.019 33.937 1.00 0.00 H new ATOM 658 N GLY A 40 35.275 28.903 27.271 1.00 0.00 N ATOM 659 CA GLY A 40 34.882 28.704 25.882 1.00 0.00 C ATOM 660 C GLY A 40 33.593 29.434 25.540 1.00 0.00 C ATOM 661 O GLY A 40 32.733 29.618 26.402 1.00 0.00 O ATOM 0 H GLY A 40 34.499 29.149 27.886 1.00 0.00 H new ATOM 0 HA2 GLY A 40 35.680 29.053 25.227 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.756 27.638 25.691 1.00 0.00 H new ATOM 665 N PHE A 41 33.464 29.829 24.272 1.00 0.00 N ATOM 666 CA PHE A 41 32.243 30.384 23.704 1.00 0.00 C ATOM 667 C PHE A 41 31.751 29.519 22.541 1.00 0.00 C ATOM 668 O PHE A 41 32.529 29.056 21.699 1.00 0.00 O ATOM 669 CB PHE A 41 32.442 31.836 23.254 1.00 0.00 C ATOM 670 CG PHE A 41 32.592 32.845 24.375 1.00 0.00 C ATOM 671 CD1 PHE A 41 33.804 32.942 25.082 1.00 0.00 C ATOM 672 CD2 PHE A 41 31.523 33.702 24.701 1.00 0.00 C ATOM 673 CE1 PHE A 41 33.946 33.891 26.110 1.00 0.00 C ATOM 674 CE2 PHE A 41 31.666 34.653 25.726 1.00 0.00 C ATOM 675 CZ PHE A 41 32.878 34.748 26.431 1.00 0.00 C ATOM 0 H PHE A 41 34.227 29.768 23.598 1.00 0.00 H new ATOM 0 HA PHE A 41 31.482 30.383 24.485 1.00 0.00 H new ATOM 0 HB2 PHE A 41 33.328 31.885 22.622 1.00 0.00 H new ATOM 0 HB3 PHE A 41 31.593 32.127 22.636 1.00 0.00 H new ATOM 0 HD1 PHE A 41 34.626 32.287 24.835 1.00 0.00 H new ATOM 0 HD2 PHE A 41 30.590 33.628 24.162 1.00 0.00 H new ATOM 0 HE1 PHE A 41 34.876 33.962 26.654 1.00 0.00 H new ATOM 0 HE2 PHE A 41 30.845 35.310 25.972 1.00 0.00 H new ATOM 0 HZ PHE A 41 32.989 35.479 27.219 1.00 0.00 H new ATOM 685 N ILE A 42 30.436 29.332 22.482 1.00 0.00 N ATOM 686 CA ILE A 42 29.733 28.719 21.356 1.00 0.00 C ATOM 687 C ILE A 42 28.574 29.648 20.998 1.00 0.00 C ATOM 688 O ILE A 42 27.813 30.077 21.858 1.00 0.00 O ATOM 689 CB ILE A 42 29.258 27.280 21.674 1.00 0.00 C ATOM 690 CG1 ILE A 42 30.388 26.385 22.244 1.00 0.00 C ATOM 691 CG2 ILE A 42 28.682 26.661 20.388 1.00 0.00 C ATOM 692 CD1 ILE A 42 29.892 25.054 22.822 1.00 0.00 C ATOM 0 H ILE A 42 29.810 29.610 23.238 1.00 0.00 H new ATOM 0 HA ILE A 42 30.404 28.607 20.505 1.00 0.00 H new ATOM 0 HB ILE A 42 28.495 27.338 22.450 1.00 0.00 H new ATOM 0 HG12 ILE A 42 31.110 26.180 21.454 1.00 0.00 H new ATOM 0 HG13 ILE A 42 30.916 26.935 23.023 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.342 25.646 20.593 1.00 0.00 H new ATOM 0 HG22 ILE A 42 27.842 27.262 20.040 1.00 0.00 H new ATOM 0 HG23 ILE A 42 29.454 26.636 19.619 1.00 0.00 H new ATOM 0 HD11 ILE A 42 30.740 24.483 23.201 1.00 0.00 H new ATOM 0 HD12 ILE A 42 29.193 25.249 23.635 1.00 0.00 H new ATOM 0 HD13 ILE A 42 29.390 24.483 22.041 1.00 0.00 H new ATOM 704 N GLN A 43 28.420 29.975 19.726 1.00 0.00 N ATOM 705 CA GLN A 43 27.286 30.750 19.238 1.00 0.00 C ATOM 706 C GLN A 43 26.207 29.790 18.746 1.00 0.00 C ATOM 707 O GLN A 43 26.504 28.706 18.239 1.00 0.00 O ATOM 708 CB GLN A 43 27.739 31.778 18.199 1.00 0.00 C ATOM 709 CG GLN A 43 28.852 32.667 18.787 1.00 0.00 C ATOM 710 CD GLN A 43 29.237 33.840 17.903 1.00 0.00 C ATOM 711 OE1 GLN A 43 28.743 34.026 16.802 1.00 0.00 O ATOM 712 NE2 GLN A 43 30.125 34.678 18.380 1.00 0.00 N ATOM 0 H GLN A 43 29.081 29.710 18.996 1.00 0.00 H new ATOM 0 HA GLN A 43 26.844 31.339 20.041 1.00 0.00 H new ATOM 0 HB2 GLN A 43 28.102 31.269 17.306 1.00 0.00 H new ATOM 0 HB3 GLN A 43 26.894 32.394 17.893 1.00 0.00 H new ATOM 0 HG2 GLN A 43 28.526 33.047 19.755 1.00 0.00 H new ATOM 0 HG3 GLN A 43 29.736 32.055 18.966 1.00 0.00 H new ATOM 0 HE21 GLN A 43 30.535 34.518 19.300 1.00 0.00 H new ATOM 0 HE22 GLN A 43 30.406 35.490 17.831 1.00 0.00 H new ATOM 721 N PHE A 44 24.949 30.172 18.914 1.00 0.00 N ATOM 722 CA PHE A 44 23.800 29.279 18.859 1.00 0.00 C ATOM 723 C PHE A 44 22.607 29.891 18.141 1.00 0.00 C ATOM 724 O PHE A 44 22.416 31.103 18.160 1.00 0.00 O ATOM 725 CB PHE A 44 23.414 28.865 20.289 1.00 0.00 C ATOM 726 CG PHE A 44 23.796 27.440 20.616 1.00 0.00 C ATOM 727 CD1 PHE A 44 22.889 26.401 20.344 1.00 0.00 C ATOM 728 CD2 PHE A 44 25.067 27.142 21.138 1.00 0.00 C ATOM 729 CE1 PHE A 44 23.249 25.063 20.589 1.00 0.00 C ATOM 730 CE2 PHE A 44 25.426 25.804 21.379 1.00 0.00 C ATOM 731 CZ PHE A 44 24.520 24.768 21.108 1.00 0.00 C ATOM 0 H PHE A 44 24.692 31.142 19.098 1.00 0.00 H new ATOM 0 HA PHE A 44 24.089 28.403 18.278 1.00 0.00 H new ATOM 0 HB2 PHE A 44 23.897 29.537 20.998 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.338 28.985 20.418 1.00 0.00 H new ATOM 0 HD1 PHE A 44 21.912 26.631 19.945 1.00 0.00 H new ATOM 0 HD2 PHE A 44 25.765 27.938 21.353 1.00 0.00 H new ATOM 0 HE1 PHE A 44 22.551 24.266 20.379 1.00 0.00 H new ATOM 0 HE2 PHE A 44 26.404 25.573 21.775 1.00 0.00 H new ATOM 0 HZ PHE A 44 24.800 23.743 21.299 1.00 0.00 H new ATOM 741 N ASP A 45 21.767 29.030 17.574 1.00 0.00 N ATOM 742 CA ASP A 45 20.415 29.383 17.163 1.00 0.00 C ATOM 743 C ASP A 45 19.402 28.974 18.253 1.00 0.00 C ATOM 744 O ASP A 45 19.518 27.897 18.849 1.00 0.00 O ATOM 745 CB ASP A 45 20.135 28.780 15.783 1.00 0.00 C ATOM 746 CG ASP A 45 18.750 29.148 15.269 1.00 0.00 C ATOM 747 OD1 ASP A 45 18.293 30.286 15.517 1.00 0.00 O ATOM 748 OD2 ASP A 45 18.127 28.329 14.557 1.00 0.00 O ATOM 0 H ASP A 45 22.010 28.057 17.386 1.00 0.00 H new ATOM 0 HA ASP A 45 20.308 30.463 17.058 1.00 0.00 H new ATOM 0 HB2 ASP A 45 20.888 29.128 15.076 1.00 0.00 H new ATOM 0 HB3 ASP A 45 20.225 27.695 15.837 1.00 0.00 H new ATOM 753 N ASN A 46 18.433 29.861 18.500 1.00 0.00 N ATOM 754 CA ASN A 46 17.546 29.967 19.672 1.00 0.00 C ATOM 755 C ASN A 46 18.259 30.094 21.047 1.00 0.00 C ATOM 756 O ASN A 46 19.105 29.265 21.383 1.00 0.00 O ATOM 757 CB ASN A 46 16.484 28.843 19.657 1.00 0.00 C ATOM 758 CG ASN A 46 15.410 29.029 18.601 1.00 0.00 C ATOM 759 OD1 ASN A 46 15.455 29.920 17.763 1.00 0.00 O ATOM 760 ND2 ASN A 46 14.359 28.252 18.646 1.00 0.00 N ATOM 0 H ASN A 46 18.227 30.595 17.822 1.00 0.00 H new ATOM 0 HA ASN A 46 17.044 30.929 19.565 1.00 0.00 H new ATOM 0 HB2 ASN A 46 16.982 27.888 19.491 1.00 0.00 H new ATOM 0 HB3 ASN A 46 16.011 28.790 20.638 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.592 28.393 17.989 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.306 27.505 19.338 1.00 0.00 H new ATOM 767 N PRO A 47 17.867 31.042 21.926 1.00 0.00 N ATOM 768 CA PRO A 47 18.451 31.176 23.273 1.00 0.00 C ATOM 769 C PRO A 47 18.100 29.998 24.183 1.00 0.00 C ATOM 770 O PRO A 47 18.884 29.616 25.049 1.00 0.00 O ATOM 771 CB PRO A 47 17.913 32.500 23.827 1.00 0.00 C ATOM 772 CG PRO A 47 16.585 32.673 23.093 1.00 0.00 C ATOM 773 CD PRO A 47 16.868 32.082 21.715 1.00 0.00 C ATOM 0 HA PRO A 47 19.540 31.173 23.225 1.00 0.00 H new ATOM 0 HB2 PRO A 47 17.773 32.457 24.907 1.00 0.00 H new ATOM 0 HB3 PRO A 47 18.594 33.327 23.626 1.00 0.00 H new ATOM 0 HG2 PRO A 47 15.775 32.147 23.598 1.00 0.00 H new ATOM 0 HG3 PRO A 47 16.294 33.721 23.029 1.00 0.00 H new ATOM 0 HD2 PRO A 47 15.961 31.669 21.273 1.00 0.00 H new ATOM 0 HD3 PRO A 47 17.237 32.846 21.030 1.00 0.00 H new ATOM 781 N GLN A 48 16.961 29.346 23.932 1.00 0.00 N ATOM 782 CA GLN A 48 16.564 28.126 24.632 1.00 0.00 C ATOM 783 C GLN A 48 17.588 27.001 24.441 1.00 0.00 C ATOM 784 O GLN A 48 17.895 26.293 25.393 1.00 0.00 O ATOM 785 CB GLN A 48 15.171 27.695 24.166 1.00 0.00 C ATOM 786 CG GLN A 48 14.147 28.792 24.473 1.00 0.00 C ATOM 787 CD GLN A 48 12.702 28.383 24.241 1.00 0.00 C ATOM 788 OE1 GLN A 48 12.364 27.435 23.537 1.00 0.00 O ATOM 789 NE2 GLN A 48 11.794 29.106 24.840 1.00 0.00 N ATOM 0 H GLN A 48 16.286 29.654 23.232 1.00 0.00 H new ATOM 0 HA GLN A 48 16.529 28.338 25.701 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.185 27.490 23.096 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.883 26.769 24.664 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.263 29.100 25.512 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.369 29.663 23.856 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.073 29.894 25.425 1.00 0.00 H new ATOM 0 HE22 GLN A 48 10.806 28.883 24.723 1.00 0.00 H new ATOM 798 N SER A 49 18.206 26.908 23.259 1.00 0.00 N ATOM 799 CA SER A 49 19.295 25.969 22.967 1.00 0.00 C ATOM 800 C SER A 49 20.533 26.197 23.834 1.00 0.00 C ATOM 801 O SER A 49 21.215 25.243 24.198 1.00 0.00 O ATOM 802 CB SER A 49 19.748 26.166 21.523 1.00 0.00 C ATOM 803 OG SER A 49 18.704 25.978 20.587 1.00 0.00 O ATOM 0 H SER A 49 17.959 27.495 22.462 1.00 0.00 H new ATOM 0 HA SER A 49 18.899 24.972 23.162 1.00 0.00 H new ATOM 0 HB2 SER A 49 20.154 27.171 21.409 1.00 0.00 H new ATOM 0 HB3 SER A 49 20.556 25.469 21.303 1.00 0.00 H new ATOM 0 HG SER A 49 18.815 26.606 19.843 1.00 0.00 H new ATOM 809 N VAL A 50 20.834 27.457 24.167 1.00 0.00 N ATOM 810 CA VAL A 50 22.000 27.826 24.979 1.00 0.00 C ATOM 811 C VAL A 50 21.822 27.331 26.406 1.00 0.00 C ATOM 812 O VAL A 50 22.638 26.561 26.907 1.00 0.00 O ATOM 813 CB VAL A 50 22.216 29.349 24.955 1.00 0.00 C ATOM 814 CG1 VAL A 50 23.322 29.775 25.912 1.00 0.00 C ATOM 815 CG2 VAL A 50 22.588 29.831 23.555 1.00 0.00 C ATOM 0 H VAL A 50 20.271 28.257 23.878 1.00 0.00 H new ATOM 0 HA VAL A 50 22.885 27.352 24.555 1.00 0.00 H new ATOM 0 HB VAL A 50 21.273 29.798 25.266 1.00 0.00 H new ATOM 0 HG11 VAL A 50 23.445 30.857 25.867 1.00 0.00 H new ATOM 0 HG12 VAL A 50 23.057 29.482 26.928 1.00 0.00 H new ATOM 0 HG13 VAL A 50 24.256 29.291 25.627 1.00 0.00 H new ATOM 0 HG21 VAL A 50 22.734 30.911 23.569 1.00 0.00 H new ATOM 0 HG22 VAL A 50 23.509 29.344 23.235 1.00 0.00 H new ATOM 0 HG23 VAL A 50 21.786 29.583 22.860 1.00 0.00 H new ATOM 825 N ARG A 51 20.724 27.727 27.055 1.00 0.00 N ATOM 826 CA ARG A 51 20.404 27.266 28.412 1.00 0.00 C ATOM 827 C ARG A 51 20.178 25.755 28.463 1.00 0.00 C ATOM 828 O ARG A 51 20.703 25.107 29.361 1.00 0.00 O ATOM 829 CB ARG A 51 19.265 28.106 29.014 1.00 0.00 C ATOM 830 CG ARG A 51 17.987 28.228 28.160 1.00 0.00 C ATOM 831 CD ARG A 51 16.926 27.173 28.478 1.00 0.00 C ATOM 832 NE ARG A 51 16.354 27.401 29.810 1.00 0.00 N ATOM 833 CZ ARG A 51 15.789 26.501 30.584 1.00 0.00 C ATOM 834 NH1 ARG A 51 15.673 25.251 30.252 1.00 0.00 N ATOM 835 NH2 ARG A 51 15.329 26.873 31.738 1.00 0.00 N ATOM 0 H ARG A 51 20.037 28.370 26.661 1.00 0.00 H new ATOM 0 HA ARG A 51 21.268 27.431 29.055 1.00 0.00 H new ATOM 0 HB2 ARG A 51 18.994 27.675 29.978 1.00 0.00 H new ATOM 0 HB3 ARG A 51 19.645 29.109 29.209 1.00 0.00 H new ATOM 0 HG2 ARG A 51 17.556 29.218 28.308 1.00 0.00 H new ATOM 0 HG3 ARG A 51 18.257 28.152 27.107 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.137 27.205 27.727 1.00 0.00 H new ATOM 0 HD3 ARG A 51 17.369 26.178 28.432 1.00 0.00 H new ATOM 0 HE ARG A 51 16.399 28.354 30.172 1.00 0.00 H new ATOM 0 HH11 ARG A 51 16.029 24.927 29.353 1.00 0.00 H new ATOM 0 HH12 ARG A 51 15.226 24.593 30.890 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.409 27.847 32.029 1.00 0.00 H new ATOM 0 HH22 ARG A 51 14.887 26.191 32.355 1.00 0.00 H new ATOM 849 N ASP A 52 19.523 25.164 27.464 1.00 0.00 N ATOM 850 CA ASP A 52 19.293 23.715 27.434 1.00 0.00 C ATOM 851 C ASP A 52 20.575 22.899 27.249 1.00 0.00 C ATOM 852 O ASP A 52 20.635 21.772 27.739 1.00 0.00 O ATOM 853 CB ASP A 52 18.245 23.342 26.375 1.00 0.00 C ATOM 854 CG ASP A 52 16.812 23.694 26.786 1.00 0.00 C ATOM 855 OD1 ASP A 52 16.553 23.896 27.996 1.00 0.00 O ATOM 856 OD2 ASP A 52 15.922 23.689 25.901 1.00 0.00 O ATOM 0 H ASP A 52 19.141 25.665 26.662 1.00 0.00 H new ATOM 0 HA ASP A 52 18.905 23.452 28.418 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.484 23.854 25.443 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.305 22.272 26.176 1.00 0.00 H new ATOM 861 N ALA A 53 21.614 23.459 26.626 1.00 0.00 N ATOM 862 CA ALA A 53 22.952 22.879 26.608 1.00 0.00 C ATOM 863 C ALA A 53 23.645 22.980 27.984 1.00 0.00 C ATOM 864 O ALA A 53 24.035 21.959 28.559 1.00 0.00 O ATOM 865 CB ALA A 53 23.748 23.561 25.486 1.00 0.00 C ATOM 0 H ALA A 53 21.546 24.339 26.114 1.00 0.00 H new ATOM 0 HA ALA A 53 22.893 21.810 26.404 1.00 0.00 H new ATOM 0 HB1 ALA A 53 24.755 23.145 25.450 1.00 0.00 H new ATOM 0 HB2 ALA A 53 23.250 23.390 24.531 1.00 0.00 H new ATOM 0 HB3 ALA A 53 23.804 24.632 25.679 1.00 0.00 H new ATOM 871 N ILE A 54 23.795 24.191 28.542 1.00 0.00 N ATOM 872 CA ILE A 54 24.647 24.389 29.731 1.00 0.00 C ATOM 873 C ILE A 54 23.976 23.914 31.028 1.00 0.00 C ATOM 874 O ILE A 54 24.659 23.396 31.911 1.00 0.00 O ATOM 875 CB ILE A 54 25.122 25.849 29.928 1.00 0.00 C ATOM 876 CG1 ILE A 54 25.406 26.703 28.673 1.00 0.00 C ATOM 877 CG2 ILE A 54 26.437 25.800 30.726 1.00 0.00 C ATOM 878 CD1 ILE A 54 25.004 28.167 28.915 1.00 0.00 C ATOM 0 H ILE A 54 23.345 25.039 28.197 1.00 0.00 H new ATOM 0 HA ILE A 54 25.521 23.771 29.525 1.00 0.00 H new ATOM 0 HB ILE A 54 24.277 26.336 30.415 1.00 0.00 H new ATOM 0 HG12 ILE A 54 26.465 26.648 28.420 1.00 0.00 H new ATOM 0 HG13 ILE A 54 24.854 26.304 27.822 1.00 0.00 H new ATOM 0 HG21 ILE A 54 26.804 26.814 30.885 1.00 0.00 H new ATOM 0 HG22 ILE A 54 26.260 25.323 31.690 1.00 0.00 H new ATOM 0 HG23 ILE A 54 27.180 25.229 30.169 1.00 0.00 H new ATOM 0 HD11 ILE A 54 25.211 28.754 28.020 1.00 0.00 H new ATOM 0 HD12 ILE A 54 23.940 28.219 29.145 1.00 0.00 H new ATOM 0 HD13 ILE A 54 25.576 28.568 29.752 1.00 0.00 H new ATOM 890 N GLU A 55 22.662 24.088 31.176 1.00 0.00 N ATOM 891 CA GLU A 55 21.918 23.646 32.366 1.00 0.00 C ATOM 892 C GLU A 55 21.796 22.109 32.381 1.00 0.00 C ATOM 893 O GLU A 55 21.919 21.494 33.439 1.00 0.00 O ATOM 894 CB GLU A 55 20.530 24.324 32.441 1.00 0.00 C ATOM 895 CG GLU A 55 20.499 25.872 32.380 1.00 0.00 C ATOM 896 CD GLU A 55 20.727 26.587 33.721 1.00 0.00 C ATOM 897 OE1 GLU A 55 21.778 26.369 34.370 1.00 0.00 O ATOM 898 OE2 GLU A 55 19.877 27.423 34.124 1.00 0.00 O ATOM 0 H GLU A 55 22.078 24.541 30.473 1.00 0.00 H new ATOM 0 HA GLU A 55 22.474 23.951 33.252 1.00 0.00 H new ATOM 0 HB2 GLU A 55 19.921 23.940 31.622 1.00 0.00 H new ATOM 0 HB3 GLU A 55 20.050 24.012 33.369 1.00 0.00 H new ATOM 0 HG2 GLU A 55 21.260 26.207 31.675 1.00 0.00 H new ATOM 0 HG3 GLU A 55 19.534 26.184 31.980 1.00 0.00 H new ATOM 905 N CYS A 56 21.616 21.462 31.220 1.00 0.00 N ATOM 906 CA CYS A 56 21.389 20.013 31.152 1.00 0.00 C ATOM 907 C CYS A 56 22.674 19.163 31.123 1.00 0.00 C ATOM 908 O CYS A 56 22.674 18.046 31.650 1.00 0.00 O ATOM 909 CB CYS A 56 20.485 19.703 29.959 1.00 0.00 C ATOM 910 SG CYS A 56 19.829 18.016 30.101 1.00 0.00 S ATOM 0 H CYS A 56 21.624 21.924 30.311 1.00 0.00 H new ATOM 0 HA CYS A 56 20.898 19.726 32.082 1.00 0.00 H new ATOM 0 HB2 CYS A 56 19.664 20.419 29.918 1.00 0.00 H new ATOM 0 HB3 CYS A 56 21.046 19.807 29.030 1.00 0.00 H new ATOM 0 HG CYS A 56 20.673 17.276 30.756 1.00 0.00 H new ATOM 916 N GLU A 57 23.773 19.643 30.528 1.00 0.00 N ATOM 917 CA GLU A 57 24.995 18.837 30.341 1.00 0.00 C ATOM 918 C GLU A 57 26.202 19.326 31.149 1.00 0.00 C ATOM 919 O GLU A 57 26.880 18.523 31.794 1.00 0.00 O ATOM 920 CB GLU A 57 25.331 18.772 28.845 1.00 0.00 C ATOM 921 CG GLU A 57 26.471 17.794 28.525 1.00 0.00 C ATOM 922 CD GLU A 57 26.184 16.391 29.069 1.00 0.00 C ATOM 923 OE1 GLU A 57 25.058 15.889 28.866 1.00 0.00 O ATOM 924 OE2 GLU A 57 27.076 15.769 29.692 1.00 0.00 O ATOM 0 H GLU A 57 23.845 20.593 30.164 1.00 0.00 H new ATOM 0 HA GLU A 57 24.779 17.842 30.729 1.00 0.00 H new ATOM 0 HB2 GLU A 57 24.440 18.476 28.291 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.606 19.768 28.497 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.615 17.743 27.446 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.401 18.167 28.953 1.00 0.00 H new ATOM 931 N SER A 58 26.480 20.631 31.143 1.00 0.00 N ATOM 932 CA SER A 58 27.592 21.219 31.910 1.00 0.00 C ATOM 933 C SER A 58 27.260 21.409 33.399 1.00 0.00 C ATOM 934 O SER A 58 28.142 21.727 34.196 1.00 0.00 O ATOM 935 CB SER A 58 28.018 22.542 31.275 1.00 0.00 C ATOM 936 OG SER A 58 28.397 22.359 29.918 1.00 0.00 O ATOM 0 H SER A 58 25.944 21.314 30.608 1.00 0.00 H new ATOM 0 HA SER A 58 28.421 20.512 31.871 1.00 0.00 H new ATOM 0 HB2 SER A 58 27.198 23.258 31.334 1.00 0.00 H new ATOM 0 HB3 SER A 58 28.852 22.966 31.835 1.00 0.00 H new ATOM 0 HG SER A 58 28.664 23.220 29.534 1.00 0.00 H new ATOM 942 N GLN A 59 25.997 21.200 33.778 1.00 0.00 N ATOM 943 CA GLN A 59 25.450 21.282 35.134 1.00 0.00 C ATOM 944 C GLN A 59 24.455 20.131 35.374 1.00 0.00 C ATOM 945 O GLN A 59 24.061 19.426 34.440 1.00 0.00 O ATOM 946 CB GLN A 59 24.760 22.639 35.315 1.00 0.00 C ATOM 947 CG GLN A 59 25.726 23.832 35.270 1.00 0.00 C ATOM 948 CD GLN A 59 24.931 25.120 35.220 1.00 0.00 C ATOM 949 OE1 GLN A 59 24.734 25.802 36.216 1.00 0.00 O ATOM 950 NE2 GLN A 59 24.398 25.447 34.067 1.00 0.00 N ATOM 0 H GLN A 59 25.279 20.952 33.097 1.00 0.00 H new ATOM 0 HA GLN A 59 26.256 21.191 35.862 1.00 0.00 H new ATOM 0 HB2 GLN A 59 24.008 22.762 34.535 1.00 0.00 H new ATOM 0 HB3 GLN A 59 24.233 22.645 36.269 1.00 0.00 H new ATOM 0 HG2 GLN A 59 26.372 23.824 36.148 1.00 0.00 H new ATOM 0 HG3 GLN A 59 26.374 23.757 34.397 1.00 0.00 H new ATOM 0 HE21 GLN A 59 24.570 24.870 33.244 1.00 0.00 H new ATOM 0 HE22 GLN A 59 23.812 26.278 33.994 1.00 0.00 H new ATOM 959 N GLU A 60 24.049 19.918 36.625 1.00 0.00 N ATOM 960 CA GLU A 60 23.226 18.775 37.054 1.00 0.00 C ATOM 961 C GLU A 60 21.843 19.184 37.599 1.00 0.00 C ATOM 962 O GLU A 60 20.897 18.392 37.526 1.00 0.00 O ATOM 963 CB GLU A 60 24.044 17.975 38.080 1.00 0.00 C ATOM 964 CG GLU A 60 23.452 16.597 38.387 1.00 0.00 C ATOM 965 CD GLU A 60 24.427 15.764 39.217 1.00 0.00 C ATOM 966 OE1 GLU A 60 24.488 15.952 40.456 1.00 0.00 O ATOM 967 OE2 GLU A 60 25.192 14.944 38.651 1.00 0.00 O ATOM 0 H GLU A 60 24.286 20.548 37.391 1.00 0.00 H new ATOM 0 HA GLU A 60 22.995 18.156 36.187 1.00 0.00 H new ATOM 0 HB2 GLU A 60 25.060 17.851 37.706 1.00 0.00 H new ATOM 0 HB3 GLU A 60 24.112 18.547 39.005 1.00 0.00 H new ATOM 0 HG2 GLU A 60 22.512 16.711 38.927 1.00 0.00 H new ATOM 0 HG3 GLU A 60 23.223 16.078 37.456 1.00 0.00 H new ATOM 974 N MET A 61 21.705 20.405 38.129 1.00 0.00 N ATOM 975 CA MET A 61 20.478 20.885 38.770 1.00 0.00 C ATOM 976 C MET A 61 20.301 22.407 38.650 1.00 0.00 C ATOM 977 O MET A 61 21.199 23.168 39.013 1.00 0.00 O ATOM 978 CB MET A 61 20.534 20.471 40.250 1.00 0.00 C ATOM 979 CG MET A 61 19.265 20.828 41.028 1.00 0.00 C ATOM 980 SD MET A 61 17.710 20.193 40.342 1.00 0.00 S ATOM 981 CE MET A 61 18.011 18.405 40.448 1.00 0.00 C ATOM 0 H MET A 61 22.455 21.097 38.124 1.00 0.00 H new ATOM 0 HA MET A 61 19.621 20.440 38.265 1.00 0.00 H new ATOM 0 HB2 MET A 61 20.700 19.396 40.313 1.00 0.00 H new ATOM 0 HB3 MET A 61 21.389 20.954 40.723 1.00 0.00 H new ATOM 0 HG2 MET A 61 19.369 20.455 42.047 1.00 0.00 H new ATOM 0 HG3 MET A 61 19.195 21.914 41.092 1.00 0.00 H new ATOM 0 HE1 MET A 61 17.102 17.867 40.181 1.00 0.00 H new ATOM 0 HE2 MET A 61 18.811 18.129 39.761 1.00 0.00 H new ATOM 0 HE3 MET A 61 18.301 18.145 41.466 1.00 0.00 H new ATOM 991 N ASN A 62 19.103 22.873 38.273 1.00 0.00 N ATOM 992 CA ASN A 62 18.751 24.296 38.080 1.00 0.00 C ATOM 993 C ASN A 62 18.823 25.165 39.361 1.00 0.00 C ATOM 994 O ASN A 62 18.598 26.375 39.318 1.00 0.00 O ATOM 995 CB ASN A 62 17.341 24.363 37.457 1.00 0.00 C ATOM 996 CG ASN A 62 17.223 23.557 36.178 1.00 0.00 C ATOM 997 OD1 ASN A 62 16.977 22.359 36.211 1.00 0.00 O ATOM 998 ND2 ASN A 62 17.412 24.163 35.031 1.00 0.00 N ATOM 0 H ASN A 62 18.318 22.249 38.085 1.00 0.00 H new ATOM 0 HA ASN A 62 19.504 24.724 37.418 1.00 0.00 H new ATOM 0 HB2 ASN A 62 16.612 23.997 38.180 1.00 0.00 H new ATOM 0 HB3 ASN A 62 17.090 25.403 37.250 1.00 0.00 H new ATOM 0 HD21 ASN A 62 17.354 23.636 34.160 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.617 25.162 35.010 1.00 0.00 H new ATOM 1005 N PHE A 63 19.122 24.548 40.506 1.00 0.00 N ATOM 1006 CA PHE A 63 19.200 25.160 41.837 1.00 0.00 C ATOM 1007 C PHE A 63 20.481 24.770 42.603 1.00 0.00 C ATOM 1008 O PHE A 63 20.574 25.015 43.805 1.00 0.00 O ATOM 1009 CB PHE A 63 17.920 24.805 42.612 1.00 0.00 C ATOM 1010 CG PHE A 63 16.640 25.202 41.897 1.00 0.00 C ATOM 1011 CD1 PHE A 63 16.156 26.521 41.994 1.00 0.00 C ATOM 1012 CD2 PHE A 63 15.954 24.265 41.098 1.00 0.00 C ATOM 1013 CE1 PHE A 63 14.993 26.900 41.300 1.00 0.00 C ATOM 1014 CE2 PHE A 63 14.805 24.652 40.387 1.00 0.00 C ATOM 1015 CZ PHE A 63 14.324 25.968 40.489 1.00 0.00 C ATOM 0 H PHE A 63 19.328 23.549 40.532 1.00 0.00 H new ATOM 0 HA PHE A 63 19.266 26.242 41.725 1.00 0.00 H new ATOM 0 HB2 PHE A 63 17.904 23.731 42.796 1.00 0.00 H new ATOM 0 HB3 PHE A 63 17.948 25.295 43.585 1.00 0.00 H new ATOM 0 HD1 PHE A 63 16.679 27.243 42.603 1.00 0.00 H new ATOM 0 HD2 PHE A 63 16.312 23.248 41.032 1.00 0.00 H new ATOM 0 HE1 PHE A 63 14.614 27.907 41.390 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.291 23.937 39.762 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.440 26.263 39.944 1.00 0.00 H new ATOM 1025 N GLY A 64 21.458 24.139 41.935 1.00 0.00 N ATOM 1026 CA GLY A 64 22.705 23.655 42.538 1.00 0.00 C ATOM 1027 C GLY A 64 23.956 24.050 41.745 1.00 0.00 C ATOM 1028 O GLY A 64 23.989 23.936 40.515 1.00 0.00 O ATOM 0 H GLY A 64 21.400 23.947 40.935 1.00 0.00 H new ATOM 0 HA2 GLY A 64 22.787 24.048 43.551 1.00 0.00 H new ATOM 0 HA3 GLY A 64 22.663 22.569 42.620 1.00 0.00 H new ATOM 1032 N LYS A 65 24.992 24.530 42.439 1.00 0.00 N ATOM 1033 CA LYS A 65 26.265 24.959 41.845 1.00 0.00 C ATOM 1034 C LYS A 65 27.130 23.756 41.473 1.00 0.00 C ATOM 1035 O LYS A 65 27.408 22.893 42.306 1.00 0.00 O ATOM 1036 CB LYS A 65 26.992 25.919 42.804 1.00 0.00 C ATOM 1037 CG LYS A 65 28.296 26.490 42.220 1.00 0.00 C ATOM 1038 CD LYS A 65 28.817 27.636 43.103 1.00 0.00 C ATOM 1039 CE LYS A 65 30.159 28.228 42.654 1.00 0.00 C ATOM 1040 NZ LYS A 65 30.139 28.718 41.254 1.00 0.00 N ATOM 0 H LYS A 65 24.970 24.634 43.453 1.00 0.00 H new ATOM 0 HA LYS A 65 26.062 25.497 40.919 1.00 0.00 H new ATOM 0 HB2 LYS A 65 26.325 26.742 43.058 1.00 0.00 H new ATOM 0 HB3 LYS A 65 27.217 25.393 43.732 1.00 0.00 H new ATOM 0 HG2 LYS A 65 29.047 25.703 42.152 1.00 0.00 H new ATOM 0 HG3 LYS A 65 28.121 26.852 41.207 1.00 0.00 H new ATOM 0 HD2 LYS A 65 28.072 28.431 43.121 1.00 0.00 H new ATOM 0 HD3 LYS A 65 28.919 27.272 44.125 1.00 0.00 H new ATOM 0 HE2 LYS A 65 30.426 29.051 43.317 1.00 0.00 H new ATOM 0 HE3 LYS A 65 30.936 27.471 42.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 31.072 29.106 41.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 29.912 27.930 40.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 29.419 29.462 41.157 1.00 0.00 H new ATOM 1054 N LYS A 66 27.598 23.745 40.226 1.00 0.00 N ATOM 1055 CA LYS A 66 28.572 22.786 39.677 1.00 0.00 C ATOM 1056 C LYS A 66 29.582 23.461 38.741 1.00 0.00 C ATOM 1057 O LYS A 66 30.750 23.062 38.712 1.00 0.00 O ATOM 1058 CB LYS A 66 27.785 21.663 38.977 1.00 0.00 C ATOM 1059 CG LYS A 66 28.687 20.529 38.471 1.00 0.00 C ATOM 1060 CD LYS A 66 27.857 19.342 37.962 1.00 0.00 C ATOM 1061 CE LYS A 66 28.757 18.180 37.537 1.00 0.00 C ATOM 1062 NZ LYS A 66 29.261 17.392 38.685 1.00 0.00 N ATOM 0 H LYS A 66 27.299 24.433 39.535 1.00 0.00 H new ATOM 0 HA LYS A 66 29.171 22.364 40.484 1.00 0.00 H new ATOM 0 HB2 LYS A 66 27.050 21.254 39.670 1.00 0.00 H new ATOM 0 HB3 LYS A 66 27.232 22.083 38.137 1.00 0.00 H new ATOM 0 HG2 LYS A 66 29.326 20.900 37.669 1.00 0.00 H new ATOM 0 HG3 LYS A 66 29.344 20.198 39.275 1.00 0.00 H new ATOM 0 HD2 LYS A 66 27.175 19.010 38.744 1.00 0.00 H new ATOM 0 HD3 LYS A 66 27.244 19.659 37.118 1.00 0.00 H new ATOM 0 HE2 LYS A 66 28.202 17.523 36.868 1.00 0.00 H new ATOM 0 HE3 LYS A 66 29.603 18.570 36.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 29.864 16.619 38.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 29.815 18.009 39.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 28.458 16.994 39.212 1.00 0.00 H new ATOM 1076 N LEU A 67 29.139 24.482 38.003 1.00 0.00 N ATOM 1077 CA LEU A 67 29.935 25.209 37.012 1.00 0.00 C ATOM 1078 C LEU A 67 29.507 26.683 36.846 1.00 0.00 C ATOM 1079 O LEU A 67 28.345 27.032 37.085 1.00 0.00 O ATOM 1080 CB LEU A 67 29.811 24.454 35.675 1.00 0.00 C ATOM 1081 CG LEU A 67 31.045 24.609 34.777 1.00 0.00 C ATOM 1082 CD1 LEU A 67 32.224 23.796 35.312 1.00 0.00 C ATOM 1083 CD2 LEU A 67 30.702 24.090 33.391 1.00 0.00 C ATOM 0 H LEU A 67 28.186 24.836 38.082 1.00 0.00 H new ATOM 0 HA LEU A 67 30.969 25.246 37.355 1.00 0.00 H new ATOM 0 HB2 LEU A 67 29.647 23.395 35.877 1.00 0.00 H new ATOM 0 HB3 LEU A 67 28.933 24.816 35.141 1.00 0.00 H new ATOM 0 HG LEU A 67 31.325 25.662 34.752 1.00 0.00 H new ATOM 0 HD11 LEU A 67 33.084 23.926 34.655 1.00 0.00 H new ATOM 0 HD12 LEU A 67 32.478 24.140 36.314 1.00 0.00 H new ATOM 0 HD13 LEU A 67 31.952 22.741 35.349 1.00 0.00 H new ATOM 0 HD21 LEU A 67 31.569 24.193 32.739 1.00 0.00 H new ATOM 0 HD22 LEU A 67 30.419 23.039 33.456 1.00 0.00 H new ATOM 0 HD23 LEU A 67 29.871 24.665 32.983 1.00 0.00 H new ATOM 1095 N ILE A 68 30.421 27.536 36.374 1.00 0.00 N ATOM 1096 CA ILE A 68 30.127 28.898 35.897 1.00 0.00 C ATOM 1097 C ILE A 68 29.822 28.942 34.393 1.00 0.00 C ATOM 1098 O ILE A 68 30.408 28.210 33.592 1.00 0.00 O ATOM 1099 CB ILE A 68 31.228 29.908 36.280 1.00 0.00 C ATOM 1100 CG1 ILE A 68 32.599 29.590 35.643 1.00 0.00 C ATOM 1101 CG2 ILE A 68 31.308 29.996 37.812 1.00 0.00 C ATOM 1102 CD1 ILE A 68 33.574 30.768 35.709 1.00 0.00 C ATOM 0 H ILE A 68 31.410 27.297 36.310 1.00 0.00 H new ATOM 0 HA ILE A 68 29.218 29.205 36.415 1.00 0.00 H new ATOM 0 HB ILE A 68 30.955 30.881 35.873 1.00 0.00 H new ATOM 0 HG12 ILE A 68 33.039 28.732 36.150 1.00 0.00 H new ATOM 0 HG13 ILE A 68 32.452 29.304 34.601 1.00 0.00 H new ATOM 0 HG21 ILE A 68 32.084 30.708 38.096 1.00 0.00 H new ATOM 0 HG22 ILE A 68 30.348 30.328 38.208 1.00 0.00 H new ATOM 0 HG23 ILE A 68 31.549 29.015 38.221 1.00 0.00 H new ATOM 0 HD11 ILE A 68 34.519 30.484 35.246 1.00 0.00 H new ATOM 0 HD12 ILE A 68 33.151 31.621 35.178 1.00 0.00 H new ATOM 0 HD13 ILE A 68 33.747 31.039 36.750 1.00 0.00 H new ATOM 1114 N LEU A 69 28.889 29.821 34.020 1.00 0.00 N ATOM 1115 CA LEU A 69 28.361 29.947 32.660 1.00 0.00 C ATOM 1116 C LEU A 69 27.724 31.312 32.379 1.00 0.00 C ATOM 1117 O LEU A 69 27.582 32.145 33.280 1.00 0.00 O ATOM 1118 CB LEU A 69 27.372 28.793 32.381 1.00 0.00 C ATOM 1119 CG LEU A 69 26.018 28.655 33.116 1.00 0.00 C ATOM 1120 CD1 LEU A 69 26.148 28.550 34.632 1.00 0.00 C ATOM 1121 CD2 LEU A 69 24.994 29.740 32.787 1.00 0.00 C ATOM 0 H LEU A 69 28.469 30.482 34.673 1.00 0.00 H new ATOM 0 HA LEU A 69 29.205 29.877 31.974 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.145 28.830 31.316 1.00 0.00 H new ATOM 0 HB3 LEU A 69 27.918 27.866 32.559 1.00 0.00 H new ATOM 0 HG LEU A 69 25.642 27.710 32.723 1.00 0.00 H new ATOM 0 HD11 LEU A 69 25.157 28.456 35.076 1.00 0.00 H new ATOM 0 HD12 LEU A 69 26.744 27.674 34.886 1.00 0.00 H new ATOM 0 HD13 LEU A 69 26.635 29.445 35.018 1.00 0.00 H new ATOM 0 HD21 LEU A 69 24.078 29.559 33.350 1.00 0.00 H new ATOM 0 HD22 LEU A 69 25.398 30.716 33.057 1.00 0.00 H new ATOM 0 HD23 LEU A 69 24.774 29.721 31.720 1.00 0.00 H new ATOM 1133 N GLU A 70 27.294 31.525 31.137 1.00 0.00 N ATOM 1134 CA GLU A 70 26.304 32.549 30.783 1.00 0.00 C ATOM 1135 C GLU A 70 25.452 32.100 29.586 1.00 0.00 C ATOM 1136 O GLU A 70 25.947 31.442 28.666 1.00 0.00 O ATOM 1137 CB GLU A 70 27.000 33.892 30.494 1.00 0.00 C ATOM 1138 CG GLU A 70 26.058 35.068 30.206 1.00 0.00 C ATOM 1139 CD GLU A 70 25.090 35.321 31.359 1.00 0.00 C ATOM 1140 OE1 GLU A 70 24.024 34.669 31.420 1.00 0.00 O ATOM 1141 OE2 GLU A 70 25.370 36.192 32.216 1.00 0.00 O ATOM 0 H GLU A 70 27.625 30.987 30.336 1.00 0.00 H new ATOM 0 HA GLU A 70 25.635 32.687 31.632 1.00 0.00 H new ATOM 0 HB2 GLU A 70 27.626 34.150 31.348 1.00 0.00 H new ATOM 0 HB3 GLU A 70 27.664 33.762 29.640 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.646 35.967 30.023 1.00 0.00 H new ATOM 0 HG3 GLU A 70 25.493 34.866 29.296 1.00 0.00 H new ATOM 1148 N VAL A 71 24.179 32.505 29.597 1.00 0.00 N ATOM 1149 CA VAL A 71 23.239 32.422 28.475 1.00 0.00 C ATOM 1150 C VAL A 71 22.902 33.835 27.995 1.00 0.00 C ATOM 1151 O VAL A 71 22.389 34.660 28.756 1.00 0.00 O ATOM 1152 CB VAL A 71 21.992 31.577 28.829 1.00 0.00 C ATOM 1153 CG1 VAL A 71 21.353 31.911 30.183 1.00 0.00 C ATOM 1154 CG2 VAL A 71 20.916 31.689 27.742 1.00 0.00 C ATOM 0 H VAL A 71 23.756 32.919 30.427 1.00 0.00 H new ATOM 0 HA VAL A 71 23.708 31.893 27.646 1.00 0.00 H new ATOM 0 HB VAL A 71 22.372 30.558 28.896 1.00 0.00 H new ATOM 0 HG11 VAL A 71 20.487 31.269 30.345 1.00 0.00 H new ATOM 0 HG12 VAL A 71 22.080 31.747 30.979 1.00 0.00 H new ATOM 0 HG13 VAL A 71 21.038 32.954 30.189 1.00 0.00 H new ATOM 0 HG21 VAL A 71 20.053 31.084 28.020 1.00 0.00 H new ATOM 0 HG22 VAL A 71 20.611 32.730 27.638 1.00 0.00 H new ATOM 0 HG23 VAL A 71 21.318 31.332 26.794 1.00 0.00 H new ATOM 1164 N SER A 72 23.212 34.138 26.736 1.00 0.00 N ATOM 1165 CA SER A 72 23.136 35.487 26.167 1.00 0.00 C ATOM 1166 C SER A 72 22.638 35.477 24.715 1.00 0.00 C ATOM 1167 O SER A 72 22.682 34.456 24.034 1.00 0.00 O ATOM 1168 CB SER A 72 24.534 36.121 26.274 1.00 0.00 C ATOM 1169 OG SER A 72 24.568 37.418 25.713 1.00 0.00 O ATOM 0 H SER A 72 23.531 33.438 26.066 1.00 0.00 H new ATOM 0 HA SER A 72 22.408 36.076 26.726 1.00 0.00 H new ATOM 0 HB2 SER A 72 24.831 36.170 27.322 1.00 0.00 H new ATOM 0 HB3 SER A 72 25.260 35.486 25.766 1.00 0.00 H new ATOM 0 HG SER A 72 24.668 38.081 26.428 1.00 0.00 H new ATOM 1175 N SER A 73 22.210 36.637 24.217 1.00 0.00 N ATOM 1176 CA SER A 73 22.035 36.926 22.783 1.00 0.00 C ATOM 1177 C SER A 73 22.654 38.271 22.359 1.00 0.00 C ATOM 1178 O SER A 73 22.354 38.786 21.280 1.00 0.00 O ATOM 1179 CB SER A 73 20.558 36.820 22.398 1.00 0.00 C ATOM 1180 OG SER A 73 19.783 37.767 23.115 1.00 0.00 O ATOM 0 H SER A 73 21.967 37.428 24.813 1.00 0.00 H new ATOM 0 HA SER A 73 22.589 36.169 22.227 1.00 0.00 H new ATOM 0 HB2 SER A 73 20.444 36.986 21.327 1.00 0.00 H new ATOM 0 HB3 SER A 73 20.194 35.814 22.605 1.00 0.00 H new ATOM 0 HG SER A 73 18.842 37.685 22.854 1.00 0.00 H new ATOM 1186 N SER A 74 23.516 38.855 23.205 1.00 0.00 N ATOM 1187 CA SER A 74 24.083 40.204 23.015 1.00 0.00 C ATOM 1188 C SER A 74 25.498 40.430 23.567 1.00 0.00 C ATOM 1189 O SER A 74 26.065 41.495 23.325 1.00 0.00 O ATOM 1190 CB SER A 74 23.143 41.241 23.635 1.00 0.00 C ATOM 1191 OG SER A 74 23.052 41.088 25.043 1.00 0.00 O ATOM 0 H SER A 74 23.846 38.398 24.055 1.00 0.00 H new ATOM 0 HA SER A 74 24.176 40.312 21.934 1.00 0.00 H new ATOM 0 HB2 SER A 74 23.500 42.244 23.400 1.00 0.00 H new ATOM 0 HB3 SER A 74 22.151 41.144 23.193 1.00 0.00 H new ATOM 0 HG SER A 74 22.446 41.766 25.407 1.00 0.00 H new ATOM 1197 N ASN A 75 26.097 39.484 24.296 1.00 0.00 N ATOM 1198 CA ASN A 75 27.466 39.630 24.801 1.00 0.00 C ATOM 1199 C ASN A 75 28.506 39.662 23.657 1.00 0.00 C ATOM 1200 O ASN A 75 28.225 39.292 22.517 1.00 0.00 O ATOM 1201 CB ASN A 75 27.739 38.516 25.831 1.00 0.00 C ATOM 1202 CG ASN A 75 29.017 38.716 26.631 1.00 0.00 C ATOM 1203 OD1 ASN A 75 29.538 39.816 26.777 1.00 0.00 O ATOM 1204 ND2 ASN A 75 29.554 37.660 27.177 1.00 0.00 N ATOM 0 H ASN A 75 25.652 38.603 24.551 1.00 0.00 H new ATOM 0 HA ASN A 75 27.567 40.593 25.301 1.00 0.00 H new ATOM 0 HB2 ASN A 75 26.896 38.457 26.520 1.00 0.00 H new ATOM 0 HB3 ASN A 75 27.793 37.559 25.311 1.00 0.00 H new ATOM 0 HD21 ASN A 75 30.409 37.749 27.726 1.00 0.00 H new ATOM 0 HD22 ASN A 75 29.119 36.746 27.054 1.00 0.00 H new ATOM 1211 N ALA A 76 29.722 40.106 23.960 1.00 0.00 N ATOM 1212 CA ALA A 76 30.847 40.116 23.033 1.00 0.00 C ATOM 1213 C ALA A 76 31.278 38.698 22.595 1.00 0.00 C ATOM 1214 O ALA A 76 31.025 37.707 23.291 1.00 0.00 O ATOM 1215 CB ALA A 76 31.986 40.887 23.699 1.00 0.00 C ATOM 0 H ALA A 76 29.957 40.478 24.880 1.00 0.00 H new ATOM 0 HA ALA A 76 30.550 40.609 22.107 1.00 0.00 H new ATOM 0 HB1 ALA A 76 32.847 40.914 23.031 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.660 41.905 23.912 1.00 0.00 H new ATOM 0 HB3 ALA A 76 32.265 40.393 24.630 1.00 0.00 H new ATOM 1221 N ARG A 77 31.963 38.608 21.447 1.00 0.00 N ATOM 1222 CA ARG A 77 32.541 37.361 20.915 1.00 0.00 C ATOM 1223 C ARG A 77 33.508 36.724 21.901 1.00 0.00 C ATOM 1224 O ARG A 77 34.301 37.462 22.529 1.00 0.00 O ATOM 1225 CB ARG A 77 33.202 37.617 19.552 1.00 0.00 C ATOM 1226 CG ARG A 77 33.520 36.302 18.819 1.00 0.00 C ATOM 1227 CD ARG A 77 34.124 36.569 17.437 1.00 0.00 C ATOM 1228 NE ARG A 77 34.254 35.343 16.631 1.00 0.00 N ATOM 1229 CZ ARG A 77 35.238 34.467 16.665 1.00 0.00 C ATOM 1230 NH1 ARG A 77 36.195 34.477 17.544 1.00 0.00 N ATOM 1231 NH2 ARG A 77 35.309 33.520 15.780 1.00 0.00 N ATOM 0 H ARG A 77 32.136 39.415 20.848 1.00 0.00 H new ATOM 0 HA ARG A 77 31.731 36.647 20.768 1.00 0.00 H new ATOM 0 HB2 ARG A 77 32.541 38.227 18.936 1.00 0.00 H new ATOM 0 HB3 ARG A 77 34.121 38.186 19.694 1.00 0.00 H new ATOM 0 HG2 ARG A 77 34.215 35.710 19.414 1.00 0.00 H new ATOM 0 HG3 ARG A 77 32.609 35.713 18.713 1.00 0.00 H new ATOM 0 HD2 ARG A 77 33.500 37.286 16.904 1.00 0.00 H new ATOM 0 HD3 ARG A 77 35.106 37.028 17.556 1.00 0.00 H new ATOM 0 HE ARG A 77 33.498 35.151 15.973 1.00 0.00 H new ATOM 0 HH11 ARG A 77 36.215 35.196 18.268 1.00 0.00 H new ATOM 0 HH12 ARG A 77 36.926 33.766 17.510 1.00 0.00 H new ATOM 0 HH21 ARG A 77 34.600 33.449 15.050 1.00 0.00 H new ATOM 0 HH22 ARG A 77 36.074 32.846 15.814 1.00 0.00 H new TER 1245 ARG A 77