USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 826 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 111 ASN : amide:sc= 0.633 X(o=1.3,f=1.3) USER MOD Set 1.2: A 112 ASN : amide:sc= 0.703 X(o=1.3,f=1.3) USER MOD Set 2.1: A 51 HIS : no HE2:sc= 0.618 K(o=1.2,f=-3.2) USER MOD Set 2.2: A 108 ASN : amide:sc= 0.614 K(o=1.2,f=-0.99) USER MOD Set 3.1: A 80 THR OG1 : rot 79:sc= 0.0172 USER MOD Set 3.2: A 104 GLN : amide:sc= 0.596 K(o=0.61,f=-0.74) USER MOD Set 4.1: A 16 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00927) USER MOD Set 4.2: A 18 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 5 LYS NZ :NH3+ 154:sc= 0.699 (180deg=0) USER MOD Set 5.2: A 7 THR OG1 : rot -7:sc= 0.565 USER MOD Set 5.3: A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 152:sc= 0.0031 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 159:sc= 1.02 (180deg=0.281) USER MOD Single : A 14 SER OG : rot -170:sc= 0.118 USER MOD Single : A 15 GLN : amide:sc= -0.247 K(o=-0.25,f=-0.76) USER MOD Single : A 21 CYS SG : rot 23:sc= 0.633 USER MOD Single : A 25 THR OG1 : rot 103:sc= 1.24 USER MOD Single : A 31 GLN : amide:sc= 0.438 K(o=0.44,f=-1) USER MOD Single : A 33 HIS :FLIP no HD1:sc= -0.602 F(o=-1.8,f=-0.6) USER MOD Single : A 34 ASN : amide:sc= -0.154 X(o=-0.15,f=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 100:sc= 0.108 USER MOD Single : A 45 CYS SG : rot -172:sc= 0.321 USER MOD Single : A 48 SER OG : rot 180:sc= 0.293 USER MOD Single : A 49 THR OG1 : rot 170:sc= 0.259 USER MOD Single : A 58 TYR OH : rot -25:sc= 0.281 USER MOD Single : A 59 TYR OH : rot 26:sc= 0.363 USER MOD Single : A 70 ASN : amide:sc= -0.416 K(o=-0.42,f=-4.5!) USER MOD Single : A 72 MET CE :methyl -159:sc= -0.074 (180deg=-1.31) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 134:sc= 1.2 USER MOD Single : A 83 SER OG : rot -110:sc= -0.518 USER MOD Single : A 88 GLN : amide:sc= 1.77 K(o=1.8,f=-8.3!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 159:sc= -1.14 (180deg=-3.32!) USER MOD Single : A 92 SER OG : rot 180:sc= -0.0063 USER MOD Single : A 93 LYS NZ :NH3+ 164:sc= 1.26 (180deg=1.14) USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -0.0517 X(o=-0.052,f=-0.084) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 49.521 20.632 21.543 1.00 0.00 N ATOM 2 CA GLY A 1 48.307 20.613 22.376 1.00 0.00 C ATOM 3 C GLY A 1 47.200 19.831 21.696 1.00 0.00 C ATOM 4 O GLY A 1 46.984 19.977 20.492 1.00 0.00 O ATOM 0 H1 GLY A 1 50.066 21.495 21.743 1.00 0.00 H new ATOM 0 H2 GLY A 1 50.103 19.797 21.759 1.00 0.00 H new ATOM 0 H3 GLY A 1 49.253 20.617 20.538 1.00 0.00 H new ATOM 0 HA2 GLY A 1 48.532 20.166 23.345 1.00 0.00 H new ATOM 0 HA3 GLY A 1 47.974 21.634 22.565 1.00 0.00 H new ATOM 10 N GLU A 2 46.502 18.979 22.446 1.00 0.00 N ATOM 11 CA GLU A 2 45.509 18.035 21.907 1.00 0.00 C ATOM 12 C GLU A 2 44.217 18.743 21.453 1.00 0.00 C ATOM 13 O GLU A 2 43.663 19.570 22.180 1.00 0.00 O ATOM 14 CB GLU A 2 45.213 16.939 22.947 1.00 0.00 C ATOM 15 CG GLU A 2 46.413 16.032 23.269 1.00 0.00 C ATOM 16 CD GLU A 2 46.892 15.204 22.067 1.00 0.00 C ATOM 17 OE1 GLU A 2 46.102 14.389 21.534 1.00 0.00 O ATOM 18 OE2 GLU A 2 48.060 15.359 21.636 1.00 0.00 O ATOM 0 H GLU A 2 46.608 18.920 23.459 1.00 0.00 H new ATOM 0 HA GLU A 2 45.933 17.572 21.016 1.00 0.00 H new ATOM 0 HB2 GLU A 2 44.872 17.411 23.868 1.00 0.00 H new ATOM 0 HB3 GLU A 2 44.392 16.321 22.583 1.00 0.00 H new ATOM 0 HG2 GLU A 2 47.238 16.647 23.629 1.00 0.00 H new ATOM 0 HG3 GLU A 2 46.141 15.357 24.081 1.00 0.00 H new ATOM 25 N GLU A 3 43.736 18.436 20.244 1.00 0.00 N ATOM 26 CA GLU A 3 42.556 19.079 19.641 1.00 0.00 C ATOM 27 C GLU A 3 41.238 18.423 20.063 1.00 0.00 C ATOM 28 O GLU A 3 41.116 17.197 20.072 1.00 0.00 O ATOM 29 CB GLU A 3 42.624 19.061 18.109 1.00 0.00 C ATOM 30 CG GLU A 3 43.589 20.093 17.515 1.00 0.00 C ATOM 31 CD GLU A 3 43.222 20.362 16.052 1.00 0.00 C ATOM 32 OE1 GLU A 3 42.136 20.953 15.809 1.00 0.00 O ATOM 33 OE2 GLU A 3 43.968 19.920 15.143 1.00 0.00 O ATOM 0 H GLU A 3 44.158 17.725 19.646 1.00 0.00 H new ATOM 0 HA GLU A 3 42.574 20.105 20.009 1.00 0.00 H new ATOM 0 HB2 GLU A 3 42.925 18.066 17.781 1.00 0.00 H new ATOM 0 HB3 GLU A 3 41.626 19.240 17.709 1.00 0.00 H new ATOM 0 HG2 GLU A 3 43.543 21.019 18.088 1.00 0.00 H new ATOM 0 HG3 GLU A 3 44.614 19.727 17.582 1.00 0.00 H new ATOM 40 N LEU A 4 40.233 19.246 20.368 1.00 0.00 N ATOM 41 CA LEU A 4 38.896 18.856 20.829 1.00 0.00 C ATOM 42 C LEU A 4 37.843 19.831 20.245 1.00 0.00 C ATOM 43 O LEU A 4 38.190 20.723 19.463 1.00 0.00 O ATOM 44 CB LEU A 4 38.901 18.869 22.371 1.00 0.00 C ATOM 45 CG LEU A 4 39.963 17.983 23.066 1.00 0.00 C ATOM 46 CD1 LEU A 4 40.130 18.419 24.515 1.00 0.00 C ATOM 47 CD2 LEU A 4 39.602 16.497 23.048 1.00 0.00 C ATOM 0 H LEU A 4 40.334 20.258 20.297 1.00 0.00 H new ATOM 0 HA LEU A 4 38.636 17.854 20.487 1.00 0.00 H new ATOM 0 HB2 LEU A 4 39.044 19.897 22.703 1.00 0.00 H new ATOM 0 HB3 LEU A 4 37.916 18.557 22.718 1.00 0.00 H new ATOM 0 HG LEU A 4 40.889 18.112 22.506 1.00 0.00 H new ATOM 0 HD11 LEU A 4 40.879 17.792 25.000 1.00 0.00 H new ATOM 0 HD12 LEU A 4 40.452 19.460 24.547 1.00 0.00 H new ATOM 0 HD13 LEU A 4 39.179 18.318 25.037 1.00 0.00 H new ATOM 0 HD21 LEU A 4 40.384 15.927 23.550 1.00 0.00 H new ATOM 0 HD22 LEU A 4 38.654 16.346 23.565 1.00 0.00 H new ATOM 0 HD23 LEU A 4 39.510 16.157 22.016 1.00 0.00 H new ATOM 59 N LYS A 5 36.561 19.692 20.603 1.00 0.00 N ATOM 60 CA LYS A 5 35.485 20.626 20.212 1.00 0.00 C ATOM 61 C LYS A 5 34.495 20.877 21.345 1.00 0.00 C ATOM 62 O LYS A 5 34.334 20.033 22.219 1.00 0.00 O ATOM 63 CB LYS A 5 34.787 20.137 18.926 1.00 0.00 C ATOM 64 CG LYS A 5 33.723 19.038 19.106 1.00 0.00 C ATOM 65 CD LYS A 5 32.312 19.551 19.467 1.00 0.00 C ATOM 66 CE LYS A 5 31.242 18.753 18.712 1.00 0.00 C ATOM 67 NZ LYS A 5 29.877 19.236 19.014 1.00 0.00 N ATOM 0 H LYS A 5 36.232 18.918 21.181 1.00 0.00 H new ATOM 0 HA LYS A 5 35.944 21.591 19.998 1.00 0.00 H new ATOM 0 HB2 LYS A 5 34.316 20.994 18.445 1.00 0.00 H new ATOM 0 HB3 LYS A 5 35.550 19.766 18.242 1.00 0.00 H new ATOM 0 HG2 LYS A 5 33.659 18.461 18.184 1.00 0.00 H new ATOM 0 HG3 LYS A 5 34.056 18.355 19.887 1.00 0.00 H new ATOM 0 HD2 LYS A 5 32.150 19.462 20.541 1.00 0.00 H new ATOM 0 HD3 LYS A 5 32.228 20.609 19.218 1.00 0.00 H new ATOM 0 HE2 LYS A 5 31.424 18.826 17.640 1.00 0.00 H new ATOM 0 HE3 LYS A 5 31.321 17.699 18.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 29.247 19.016 18.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 29.525 18.768 19.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 29.898 20.265 19.165 1.00 0.00 H new ATOM 81 N ILE A 6 33.810 22.013 21.283 1.00 0.00 N ATOM 82 CA ILE A 6 32.794 22.482 22.234 1.00 0.00 C ATOM 83 C ILE A 6 31.600 23.046 21.450 1.00 0.00 C ATOM 84 O ILE A 6 31.778 23.878 20.561 1.00 0.00 O ATOM 85 CB ILE A 6 33.418 23.511 23.223 1.00 0.00 C ATOM 86 CG1 ILE A 6 32.373 24.209 24.135 1.00 0.00 C ATOM 87 CG2 ILE A 6 34.231 24.585 22.484 1.00 0.00 C ATOM 88 CD1 ILE A 6 32.935 24.904 25.379 1.00 0.00 C ATOM 0 H ILE A 6 33.954 22.677 20.522 1.00 0.00 H new ATOM 0 HA ILE A 6 32.427 21.656 22.844 1.00 0.00 H new ATOM 0 HB ILE A 6 34.076 22.921 23.862 1.00 0.00 H new ATOM 0 HG12 ILE A 6 31.835 24.948 23.541 1.00 0.00 H new ATOM 0 HG13 ILE A 6 31.643 23.465 24.455 1.00 0.00 H new ATOM 0 HG21 ILE A 6 34.651 25.285 23.207 1.00 0.00 H new ATOM 0 HG22 ILE A 6 35.039 24.111 21.927 1.00 0.00 H new ATOM 0 HG23 ILE A 6 33.581 25.123 21.794 1.00 0.00 H new ATOM 0 HD11 ILE A 6 32.119 25.357 25.942 1.00 0.00 H new ATOM 0 HD12 ILE A 6 33.446 24.172 26.005 1.00 0.00 H new ATOM 0 HD13 ILE A 6 33.640 25.678 25.076 1.00 0.00 H new ATOM 100 N THR A 7 30.383 22.610 21.781 1.00 0.00 N ATOM 101 CA THR A 7 29.140 23.239 21.311 1.00 0.00 C ATOM 102 C THR A 7 28.509 24.084 22.398 1.00 0.00 C ATOM 103 O THR A 7 28.373 23.648 23.538 1.00 0.00 O ATOM 104 CB THR A 7 28.117 22.232 20.756 1.00 0.00 C ATOM 105 OG1 THR A 7 28.627 21.641 19.592 1.00 0.00 O ATOM 106 CG2 THR A 7 26.795 22.872 20.316 1.00 0.00 C ATOM 0 H THR A 7 30.228 21.805 22.387 1.00 0.00 H new ATOM 0 HA THR A 7 29.430 23.882 20.480 1.00 0.00 H new ATOM 0 HB THR A 7 27.938 21.532 21.572 1.00 0.00 H new ATOM 0 HG1 THR A 7 29.463 22.085 19.339 1.00 0.00 H new ATOM 0 HG21 THR A 7 26.126 22.100 19.937 1.00 0.00 H new ATOM 0 HG22 THR A 7 26.330 23.369 21.168 1.00 0.00 H new ATOM 0 HG23 THR A 7 26.988 23.603 19.531 1.00 0.00 H new ATOM 114 N PHE A 8 28.060 25.271 22.008 1.00 0.00 N ATOM 115 CA PHE A 8 27.285 26.187 22.826 1.00 0.00 C ATOM 116 C PHE A 8 25.965 26.562 22.135 1.00 0.00 C ATOM 117 O PHE A 8 25.932 26.819 20.927 1.00 0.00 O ATOM 118 CB PHE A 8 28.109 27.442 23.171 1.00 0.00 C ATOM 119 CG PHE A 8 29.625 27.326 23.285 1.00 0.00 C ATOM 120 CD1 PHE A 8 30.383 27.162 22.104 1.00 0.00 C ATOM 121 CD2 PHE A 8 30.306 27.561 24.507 1.00 0.00 C ATOM 122 CE1 PHE A 8 31.777 27.192 22.142 1.00 0.00 C ATOM 123 CE2 PHE A 8 31.704 27.655 24.528 1.00 0.00 C ATOM 124 CZ PHE A 8 32.431 27.455 23.348 1.00 0.00 C ATOM 0 H PHE A 8 28.236 25.634 21.071 1.00 0.00 H new ATOM 0 HA PHE A 8 27.037 25.681 23.759 1.00 0.00 H new ATOM 0 HB2 PHE A 8 27.893 28.195 22.413 1.00 0.00 H new ATOM 0 HB3 PHE A 8 27.737 27.829 24.120 1.00 0.00 H new ATOM 0 HD1 PHE A 8 29.878 27.012 21.161 1.00 0.00 H new ATOM 0 HD2 PHE A 8 29.745 27.668 25.424 1.00 0.00 H new ATOM 0 HE1 PHE A 8 32.348 27.013 21.243 1.00 0.00 H new ATOM 0 HE2 PHE A 8 32.219 27.881 25.450 1.00 0.00 H new ATOM 0 HZ PHE A 8 33.510 27.505 23.371 1.00 0.00 H new ATOM 134 N ILE A 9 24.892 26.638 22.924 1.00 0.00 N ATOM 135 CA ILE A 9 23.620 27.279 22.541 1.00 0.00 C ATOM 136 C ILE A 9 23.648 28.750 22.953 1.00 0.00 C ATOM 137 O ILE A 9 24.141 29.090 24.028 1.00 0.00 O ATOM 138 CB ILE A 9 22.392 26.566 23.140 1.00 0.00 C ATOM 139 CG1 ILE A 9 22.473 25.053 22.839 1.00 0.00 C ATOM 140 CG2 ILE A 9 21.077 27.229 22.664 1.00 0.00 C ATOM 141 CD1 ILE A 9 21.200 24.245 23.090 1.00 0.00 C ATOM 0 H ILE A 9 24.876 26.250 23.867 1.00 0.00 H new ATOM 0 HA ILE A 9 23.521 27.202 21.458 1.00 0.00 H new ATOM 0 HB ILE A 9 22.392 26.674 24.225 1.00 0.00 H new ATOM 0 HG12 ILE A 9 22.759 24.926 21.795 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.274 24.626 23.443 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.227 26.706 23.102 1.00 0.00 H new ATOM 0 HG22 ILE A 9 21.062 28.273 22.978 1.00 0.00 H new ATOM 0 HG23 ILE A 9 21.015 27.176 21.577 1.00 0.00 H new ATOM 0 HD11 ILE A 9 21.379 23.198 22.843 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.918 24.327 24.140 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.394 24.632 22.466 1.00 0.00 H new ATOM 153 N LEU A 10 23.118 29.611 22.092 1.00 0.00 N ATOM 154 CA LEU A 10 23.209 31.065 22.167 1.00 0.00 C ATOM 155 C LEU A 10 21.961 31.683 22.801 1.00 0.00 C ATOM 156 O LEU A 10 20.879 31.104 22.753 1.00 0.00 O ATOM 157 CB LEU A 10 23.381 31.592 20.734 1.00 0.00 C ATOM 158 CG LEU A 10 24.646 31.174 19.950 1.00 0.00 C ATOM 159 CD1 LEU A 10 25.244 32.438 19.319 1.00 0.00 C ATOM 160 CD2 LEU A 10 25.785 30.553 20.762 1.00 0.00 C ATOM 0 H LEU A 10 22.585 29.298 21.280 1.00 0.00 H new ATOM 0 HA LEU A 10 24.055 31.341 22.796 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.512 31.277 20.157 1.00 0.00 H new ATOM 0 HB3 LEU A 10 23.359 32.681 20.775 1.00 0.00 H new ATOM 0 HG LEU A 10 24.296 30.410 19.255 1.00 0.00 H new ATOM 0 HD11 LEU A 10 26.140 32.175 18.757 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.514 32.889 18.647 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.503 33.149 20.104 1.00 0.00 H new ATOM 0 HD21 LEU A 10 26.612 30.304 20.097 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.125 31.264 21.514 1.00 0.00 H new ATOM 0 HD23 LEU A 10 25.430 29.647 21.254 1.00 0.00 H new ATOM 172 N LYS A 11 22.071 32.926 23.286 1.00 0.00 N ATOM 173 CA LYS A 11 20.931 33.709 23.803 1.00 0.00 C ATOM 174 C LYS A 11 19.857 34.073 22.765 1.00 0.00 C ATOM 175 O LYS A 11 18.793 34.559 23.131 1.00 0.00 O ATOM 176 CB LYS A 11 21.432 34.937 24.579 1.00 0.00 C ATOM 177 CG LYS A 11 22.483 35.828 23.903 1.00 0.00 C ATOM 178 CD LYS A 11 22.024 36.448 22.574 1.00 0.00 C ATOM 179 CE LYS A 11 22.863 37.683 22.250 1.00 0.00 C ATOM 180 NZ LYS A 11 22.504 38.262 20.935 1.00 0.00 N ATOM 0 H LYS A 11 22.959 33.425 23.333 1.00 0.00 H new ATOM 0 HA LYS A 11 20.405 33.044 24.488 1.00 0.00 H new ATOM 0 HB2 LYS A 11 20.569 35.558 24.817 1.00 0.00 H new ATOM 0 HB3 LYS A 11 21.846 34.590 25.526 1.00 0.00 H new ATOM 0 HG2 LYS A 11 22.759 36.629 24.589 1.00 0.00 H new ATOM 0 HG3 LYS A 11 23.382 35.238 23.724 1.00 0.00 H new ATOM 0 HD2 LYS A 11 22.116 35.716 21.772 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.971 36.721 22.636 1.00 0.00 H new ATOM 0 HE2 LYS A 11 22.722 38.433 23.028 1.00 0.00 H new ATOM 0 HE3 LYS A 11 23.920 37.416 22.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 22.810 39.255 20.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 22.976 37.726 20.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 21.474 38.212 20.803 1.00 0.00 H new ATOM 194 N ASP A 12 20.128 33.838 21.482 1.00 0.00 N ATOM 195 CA ASP A 12 19.152 33.932 20.381 1.00 0.00 C ATOM 196 C ASP A 12 18.607 32.557 19.929 1.00 0.00 C ATOM 197 O ASP A 12 17.815 32.482 18.992 1.00 0.00 O ATOM 198 CB ASP A 12 19.768 34.723 19.210 1.00 0.00 C ATOM 199 CG ASP A 12 18.707 35.420 18.347 1.00 0.00 C ATOM 200 OD1 ASP A 12 18.120 36.420 18.829 1.00 0.00 O ATOM 201 OD2 ASP A 12 18.486 35.024 17.179 1.00 0.00 O ATOM 0 H ASP A 12 21.059 33.568 21.163 1.00 0.00 H new ATOM 0 HA ASP A 12 18.282 34.471 20.755 1.00 0.00 H new ATOM 0 HB2 ASP A 12 20.459 35.469 19.603 1.00 0.00 H new ATOM 0 HB3 ASP A 12 20.352 34.046 18.586 1.00 0.00 H new ATOM 206 N GLY A 13 19.025 31.461 20.573 1.00 0.00 N ATOM 207 CA GLY A 13 18.711 30.077 20.192 1.00 0.00 C ATOM 208 C GLY A 13 19.501 29.542 18.988 1.00 0.00 C ATOM 209 O GLY A 13 19.132 28.512 18.424 1.00 0.00 O ATOM 0 H GLY A 13 19.613 31.515 21.405 1.00 0.00 H new ATOM 0 HA2 GLY A 13 18.898 29.429 21.048 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.646 30.010 19.968 1.00 0.00 H new ATOM 213 N SER A 14 20.582 30.215 18.586 1.00 0.00 N ATOM 214 CA SER A 14 21.613 29.724 17.653 1.00 0.00 C ATOM 215 C SER A 14 22.488 28.638 18.293 1.00 0.00 C ATOM 216 O SER A 14 22.631 28.583 19.512 1.00 0.00 O ATOM 217 CB SER A 14 22.498 30.880 17.119 1.00 0.00 C ATOM 218 OG SER A 14 22.203 32.114 17.756 1.00 0.00 O ATOM 0 H SER A 14 20.776 31.161 18.914 1.00 0.00 H new ATOM 0 HA SER A 14 21.085 29.281 16.809 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.548 30.634 17.274 1.00 0.00 H new ATOM 0 HB3 SER A 14 22.350 30.983 16.044 1.00 0.00 H new ATOM 0 HG SER A 14 22.663 32.842 17.288 1.00 0.00 H new ATOM 224 N GLN A 15 23.098 27.776 17.480 1.00 0.00 N ATOM 225 CA GLN A 15 24.052 26.757 17.910 1.00 0.00 C ATOM 226 C GLN A 15 25.342 26.894 17.155 1.00 0.00 C ATOM 227 O GLN A 15 25.345 27.011 15.928 1.00 0.00 O ATOM 228 CB GLN A 15 23.549 25.327 17.636 1.00 0.00 C ATOM 229 CG GLN A 15 22.418 24.701 18.466 1.00 0.00 C ATOM 230 CD GLN A 15 21.166 25.535 18.716 1.00 0.00 C ATOM 231 OE1 GLN A 15 20.575 25.494 19.786 1.00 0.00 O ATOM 232 NE2 GLN A 15 20.658 26.257 17.750 1.00 0.00 N ATOM 0 H GLN A 15 22.936 27.768 16.473 1.00 0.00 H new ATOM 0 HA GLN A 15 24.184 26.910 18.981 1.00 0.00 H new ATOM 0 HB2 GLN A 15 23.231 25.297 16.594 1.00 0.00 H new ATOM 0 HB3 GLN A 15 24.411 24.666 17.725 1.00 0.00 H new ATOM 0 HG2 GLN A 15 22.112 23.779 17.971 1.00 0.00 H new ATOM 0 HG3 GLN A 15 22.831 24.420 19.435 1.00 0.00 H new ATOM 0 HE21 GLN A 15 21.132 26.308 16.848 1.00 0.00 H new ATOM 0 HE22 GLN A 15 19.788 26.769 17.899 1.00 0.00 H new ATOM 241 N LYS A 16 26.427 26.823 17.923 1.00 0.00 N ATOM 242 CA LYS A 16 27.780 26.960 17.447 1.00 0.00 C ATOM 243 C LYS A 16 28.621 25.899 18.075 1.00 0.00 C ATOM 244 O LYS A 16 28.749 25.792 19.289 1.00 0.00 O ATOM 245 CB LYS A 16 28.308 28.331 17.733 1.00 0.00 C ATOM 246 CG LYS A 16 27.754 29.191 16.587 1.00 0.00 C ATOM 247 CD LYS A 16 27.211 30.412 17.213 1.00 0.00 C ATOM 248 CE LYS A 16 26.720 31.479 16.233 1.00 0.00 C ATOM 249 NZ LYS A 16 27.784 32.020 15.356 1.00 0.00 N ATOM 0 H LYS A 16 26.374 26.662 18.929 1.00 0.00 H new ATOM 0 HA LYS A 16 27.806 26.834 16.365 1.00 0.00 H new ATOM 0 HB2 LYS A 16 27.970 28.694 18.704 1.00 0.00 H new ATOM 0 HB3 LYS A 16 29.398 28.343 17.750 1.00 0.00 H new ATOM 0 HG2 LYS A 16 28.538 29.437 15.871 1.00 0.00 H new ATOM 0 HG3 LYS A 16 26.978 28.656 16.039 1.00 0.00 H new ATOM 0 HD2 LYS A 16 26.384 30.131 17.865 1.00 0.00 H new ATOM 0 HD3 LYS A 16 27.982 30.850 17.847 1.00 0.00 H new ATOM 0 HE2 LYS A 16 25.932 31.053 15.612 1.00 0.00 H new ATOM 0 HE3 LYS A 16 26.274 32.299 16.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 27.386 32.760 14.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 28.543 32.425 15.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 28.171 31.255 14.767 1.00 0.00 H new ATOM 263 N THR A 17 29.156 25.145 17.158 1.00 0.00 N ATOM 264 CA THR A 17 30.171 24.113 17.408 1.00 0.00 C ATOM 265 C THR A 17 31.542 24.626 16.971 1.00 0.00 C ATOM 266 O THR A 17 31.690 25.114 15.850 1.00 0.00 O ATOM 267 CB THR A 17 29.807 22.755 16.785 1.00 0.00 C ATOM 268 OG1 THR A 17 30.718 21.761 17.202 1.00 0.00 O ATOM 269 CG2 THR A 17 29.830 22.763 15.264 1.00 0.00 C ATOM 0 H THR A 17 28.901 25.220 16.173 1.00 0.00 H new ATOM 0 HA THR A 17 30.209 23.920 18.480 1.00 0.00 H new ATOM 0 HB THR A 17 28.792 22.547 17.124 1.00 0.00 H new ATOM 0 HG1 THR A 17 30.472 20.902 16.799 1.00 0.00 H new ATOM 0 HG21 THR A 17 29.564 21.774 14.891 1.00 0.00 H new ATOM 0 HG22 THR A 17 29.113 23.496 14.893 1.00 0.00 H new ATOM 0 HG23 THR A 17 30.829 23.025 14.917 1.00 0.00 H new ATOM 277 N TYR A 18 32.525 24.577 17.867 1.00 0.00 N ATOM 278 CA TYR A 18 33.831 25.235 17.727 1.00 0.00 C ATOM 279 C TYR A 18 34.989 24.314 18.127 1.00 0.00 C ATOM 280 O TYR A 18 34.905 23.566 19.101 1.00 0.00 O ATOM 281 CB TYR A 18 33.868 26.535 18.559 1.00 0.00 C ATOM 282 CG TYR A 18 33.030 27.724 18.068 1.00 0.00 C ATOM 283 CD1 TYR A 18 32.675 27.863 16.707 1.00 0.00 C ATOM 284 CD2 TYR A 18 32.664 28.754 18.966 1.00 0.00 C ATOM 285 CE1 TYR A 18 31.903 28.950 16.265 1.00 0.00 C ATOM 286 CE2 TYR A 18 31.946 29.880 18.510 1.00 0.00 C ATOM 287 CZ TYR A 18 31.545 29.969 17.162 1.00 0.00 C ATOM 288 OH TYR A 18 30.828 31.037 16.724 1.00 0.00 O ATOM 0 H TYR A 18 32.436 24.061 18.742 1.00 0.00 H new ATOM 0 HA TYR A 18 33.960 25.479 16.672 1.00 0.00 H new ATOM 0 HB2 TYR A 18 33.545 26.294 19.572 1.00 0.00 H new ATOM 0 HB3 TYR A 18 34.906 26.861 18.624 1.00 0.00 H new ATOM 0 HD1 TYR A 18 33.003 27.121 15.995 1.00 0.00 H new ATOM 0 HD2 TYR A 18 32.936 28.678 20.008 1.00 0.00 H new ATOM 0 HE1 TYR A 18 31.585 29.002 15.234 1.00 0.00 H new ATOM 0 HE2 TYR A 18 31.703 30.677 19.197 1.00 0.00 H new ATOM 0 HH TYR A 18 30.663 31.649 17.471 1.00 0.00 H new ATOM 298 N GLU A 19 36.095 24.399 17.388 1.00 0.00 N ATOM 299 CA GLU A 19 37.317 23.609 17.593 1.00 0.00 C ATOM 300 C GLU A 19 38.243 24.302 18.612 1.00 0.00 C ATOM 301 O GLU A 19 38.527 25.496 18.487 1.00 0.00 O ATOM 302 CB GLU A 19 38.022 23.410 16.235 1.00 0.00 C ATOM 303 CG GLU A 19 37.232 22.528 15.251 1.00 0.00 C ATOM 304 CD GLU A 19 37.708 22.724 13.803 1.00 0.00 C ATOM 305 OE1 GLU A 19 38.789 22.210 13.421 1.00 0.00 O ATOM 306 OE2 GLU A 19 37.006 23.408 13.019 1.00 0.00 O ATOM 0 H GLU A 19 36.171 25.042 16.600 1.00 0.00 H new ATOM 0 HA GLU A 19 37.060 22.632 18.001 1.00 0.00 H new ATOM 0 HB2 GLU A 19 38.193 24.385 15.778 1.00 0.00 H new ATOM 0 HB3 GLU A 19 39.001 22.962 16.406 1.00 0.00 H new ATOM 0 HG2 GLU A 19 37.343 21.481 15.532 1.00 0.00 H new ATOM 0 HG3 GLU A 19 36.171 22.766 15.320 1.00 0.00 H new ATOM 313 N VAL A 20 38.724 23.576 19.629 1.00 0.00 N ATOM 314 CA VAL A 20 39.521 24.096 20.756 1.00 0.00 C ATOM 315 C VAL A 20 40.636 23.128 21.174 1.00 0.00 C ATOM 316 O VAL A 20 40.826 22.082 20.545 1.00 0.00 O ATOM 317 CB VAL A 20 38.589 24.386 21.950 1.00 0.00 C ATOM 318 CG1 VAL A 20 37.645 25.549 21.661 1.00 0.00 C ATOM 319 CG2 VAL A 20 37.757 23.165 22.368 1.00 0.00 C ATOM 0 H VAL A 20 38.564 22.571 19.695 1.00 0.00 H new ATOM 0 HA VAL A 20 40.005 25.016 20.429 1.00 0.00 H new ATOM 0 HB VAL A 20 39.252 24.649 22.774 1.00 0.00 H new ATOM 0 HG11 VAL A 20 37.005 25.722 22.526 1.00 0.00 H new ATOM 0 HG12 VAL A 20 38.227 26.447 21.455 1.00 0.00 H new ATOM 0 HG13 VAL A 20 37.028 25.310 20.795 1.00 0.00 H new ATOM 0 HG21 VAL A 20 37.121 23.430 23.212 1.00 0.00 H new ATOM 0 HG22 VAL A 20 37.135 22.845 21.532 1.00 0.00 H new ATOM 0 HG23 VAL A 20 38.423 22.352 22.657 1.00 0.00 H new ATOM 329 N CYS A 21 41.367 23.468 22.240 1.00 0.00 N ATOM 330 CA CYS A 21 42.394 22.629 22.856 1.00 0.00 C ATOM 331 C CYS A 21 42.083 22.265 24.320 1.00 0.00 C ATOM 332 O CYS A 21 41.312 22.926 25.016 1.00 0.00 O ATOM 333 CB CYS A 21 43.739 23.344 22.716 1.00 0.00 C ATOM 334 SG CYS A 21 45.138 22.201 22.852 1.00 0.00 S ATOM 0 H CYS A 21 41.255 24.365 22.712 1.00 0.00 H new ATOM 0 HA CYS A 21 42.424 21.672 22.335 1.00 0.00 H new ATOM 0 HB2 CYS A 21 43.780 23.853 21.753 1.00 0.00 H new ATOM 0 HB3 CYS A 21 43.823 24.111 23.486 1.00 0.00 H new ATOM 0 HG CYS A 21 44.744 20.997 22.562 1.00 0.00 H new ATOM 340 N GLU A 22 42.720 21.197 24.785 1.00 0.00 N ATOM 341 CA GLU A 22 42.672 20.663 26.139 1.00 0.00 C ATOM 342 C GLU A 22 43.086 21.685 27.222 1.00 0.00 C ATOM 343 O GLU A 22 44.161 22.287 27.151 1.00 0.00 O ATOM 344 CB GLU A 22 43.614 19.449 26.109 1.00 0.00 C ATOM 345 CG GLU A 22 43.600 18.647 27.400 1.00 0.00 C ATOM 346 CD GLU A 22 44.626 17.499 27.396 1.00 0.00 C ATOM 347 OE1 GLU A 22 45.847 17.747 27.577 1.00 0.00 O ATOM 348 OE2 GLU A 22 44.212 16.324 27.272 1.00 0.00 O ATOM 0 H GLU A 22 43.327 20.642 24.181 1.00 0.00 H new ATOM 0 HA GLU A 22 41.652 20.397 26.416 1.00 0.00 H new ATOM 0 HB2 GLU A 22 43.331 18.798 25.282 1.00 0.00 H new ATOM 0 HB3 GLU A 22 44.630 19.791 25.912 1.00 0.00 H new ATOM 0 HG2 GLU A 22 43.808 19.312 28.238 1.00 0.00 H new ATOM 0 HG3 GLU A 22 42.602 18.237 27.558 1.00 0.00 H new ATOM 355 N GLY A 23 42.256 21.842 28.260 1.00 0.00 N ATOM 356 CA GLY A 23 42.495 22.677 29.435 1.00 0.00 C ATOM 357 C GLY A 23 41.849 24.061 29.368 1.00 0.00 C ATOM 358 O GLY A 23 41.944 24.798 30.347 1.00 0.00 O ATOM 0 H GLY A 23 41.356 21.365 28.302 1.00 0.00 H new ATOM 0 HA2 GLY A 23 42.121 22.157 30.317 1.00 0.00 H new ATOM 0 HA3 GLY A 23 43.570 22.797 29.568 1.00 0.00 H new ATOM 362 N GLU A 24 41.179 24.440 28.279 1.00 0.00 N ATOM 363 CA GLU A 24 40.424 25.698 28.212 1.00 0.00 C ATOM 364 C GLU A 24 39.046 25.611 28.891 1.00 0.00 C ATOM 365 O GLU A 24 38.327 24.623 28.737 1.00 0.00 O ATOM 366 CB GLU A 24 40.328 26.153 26.754 1.00 0.00 C ATOM 367 CG GLU A 24 41.701 26.539 26.196 1.00 0.00 C ATOM 368 CD GLU A 24 42.175 27.892 26.745 1.00 0.00 C ATOM 369 OE1 GLU A 24 41.871 28.944 26.135 1.00 0.00 O ATOM 370 OE2 GLU A 24 42.828 27.940 27.817 1.00 0.00 O ATOM 0 H GLU A 24 41.142 23.889 27.421 1.00 0.00 H new ATOM 0 HA GLU A 24 40.968 26.451 28.782 1.00 0.00 H new ATOM 0 HB2 GLU A 24 39.900 25.353 26.149 1.00 0.00 H new ATOM 0 HB3 GLU A 24 39.652 27.005 26.681 1.00 0.00 H new ATOM 0 HG2 GLU A 24 42.428 25.768 26.451 1.00 0.00 H new ATOM 0 HG3 GLU A 24 41.652 26.584 25.108 1.00 0.00 H new ATOM 377 N THR A 25 38.700 26.649 29.657 1.00 0.00 N ATOM 378 CA THR A 25 37.517 26.760 30.535 1.00 0.00 C ATOM 379 C THR A 25 36.292 27.176 29.715 1.00 0.00 C ATOM 380 O THR A 25 36.407 27.945 28.767 1.00 0.00 O ATOM 381 CB THR A 25 37.844 27.705 31.704 1.00 0.00 C ATOM 382 OG1 THR A 25 39.234 27.894 31.894 1.00 0.00 O ATOM 383 CG2 THR A 25 37.409 27.082 33.023 1.00 0.00 C ATOM 0 H THR A 25 39.272 27.493 29.687 1.00 0.00 H new ATOM 0 HA THR A 25 37.263 25.796 30.975 1.00 0.00 H new ATOM 0 HB THR A 25 37.338 28.637 31.452 1.00 0.00 H new ATOM 0 HG1 THR A 25 39.498 28.765 31.530 1.00 0.00 H new ATOM 0 HG21 THR A 25 37.646 27.761 33.842 1.00 0.00 H new ATOM 0 HG22 THR A 25 36.335 26.900 33.002 1.00 0.00 H new ATOM 0 HG23 THR A 25 37.934 26.138 33.170 1.00 0.00 H new ATOM 391 N ILE A 26 35.096 26.691 30.047 1.00 0.00 N ATOM 392 CA ILE A 26 33.874 26.958 29.247 1.00 0.00 C ATOM 393 C ILE A 26 33.609 28.455 29.022 1.00 0.00 C ATOM 394 O ILE A 26 33.363 28.857 27.882 1.00 0.00 O ATOM 395 CB ILE A 26 32.664 26.192 29.827 1.00 0.00 C ATOM 396 CG1 ILE A 26 32.573 24.721 29.359 1.00 0.00 C ATOM 397 CG2 ILE A 26 31.322 26.846 29.490 1.00 0.00 C ATOM 398 CD1 ILE A 26 33.861 23.905 29.371 1.00 0.00 C ATOM 0 H ILE A 26 34.934 26.107 30.867 1.00 0.00 H new ATOM 0 HA ILE A 26 34.047 26.568 28.244 1.00 0.00 H new ATOM 0 HB ILE A 26 32.846 26.226 30.901 1.00 0.00 H new ATOM 0 HG12 ILE A 26 31.844 24.211 29.988 1.00 0.00 H new ATOM 0 HG13 ILE A 26 32.178 24.713 28.343 1.00 0.00 H new ATOM 0 HG21 ILE A 26 30.512 26.261 29.926 1.00 0.00 H new ATOM 0 HG22 ILE A 26 31.298 27.857 29.896 1.00 0.00 H new ATOM 0 HG23 ILE A 26 31.199 26.887 28.408 1.00 0.00 H new ATOM 0 HD11 ILE A 26 33.654 22.894 29.020 1.00 0.00 H new ATOM 0 HD12 ILE A 26 34.595 24.374 28.715 1.00 0.00 H new ATOM 0 HD13 ILE A 26 34.256 23.863 30.386 1.00 0.00 H new ATOM 410 N LEU A 27 33.720 29.295 30.057 1.00 0.00 N ATOM 411 CA LEU A 27 33.554 30.744 29.882 1.00 0.00 C ATOM 412 C LEU A 27 34.740 31.370 29.123 1.00 0.00 C ATOM 413 O LEU A 27 34.558 32.271 28.309 1.00 0.00 O ATOM 414 CB LEU A 27 33.305 31.394 31.248 1.00 0.00 C ATOM 415 CG LEU A 27 32.873 32.870 31.169 1.00 0.00 C ATOM 416 CD1 LEU A 27 31.554 33.075 30.414 1.00 0.00 C ATOM 417 CD2 LEU A 27 32.664 33.384 32.585 1.00 0.00 C ATOM 0 H LEU A 27 33.921 29.003 31.013 1.00 0.00 H new ATOM 0 HA LEU A 27 32.682 30.933 29.256 1.00 0.00 H new ATOM 0 HB2 LEU A 27 32.535 30.828 31.773 1.00 0.00 H new ATOM 0 HB3 LEU A 27 34.215 31.324 31.844 1.00 0.00 H new ATOM 0 HG LEU A 27 33.658 33.403 30.632 1.00 0.00 H new ATOM 0 HD11 LEU A 27 31.307 34.136 30.395 1.00 0.00 H new ATOM 0 HD12 LEU A 27 31.658 32.708 29.393 1.00 0.00 H new ATOM 0 HD13 LEU A 27 30.758 32.526 30.917 1.00 0.00 H new ATOM 0 HD21 LEU A 27 32.357 34.429 32.551 1.00 0.00 H new ATOM 0 HD22 LEU A 27 31.890 32.794 33.076 1.00 0.00 H new ATOM 0 HD23 LEU A 27 33.595 33.297 33.145 1.00 0.00 H new ATOM 429 N ASP A 28 35.941 30.823 29.303 1.00 0.00 N ATOM 430 CA ASP A 28 37.161 31.224 28.594 1.00 0.00 C ATOM 431 C ASP A 28 37.144 30.890 27.092 1.00 0.00 C ATOM 432 O ASP A 28 37.832 31.566 26.320 1.00 0.00 O ATOM 433 CB ASP A 28 38.359 30.553 29.277 1.00 0.00 C ATOM 434 CG ASP A 28 38.744 31.209 30.613 1.00 0.00 C ATOM 435 OD1 ASP A 28 38.606 32.449 30.758 1.00 0.00 O ATOM 436 OD2 ASP A 28 39.263 30.512 31.517 1.00 0.00 O ATOM 0 H ASP A 28 36.100 30.065 29.966 1.00 0.00 H new ATOM 0 HA ASP A 28 37.233 32.310 28.650 1.00 0.00 H new ATOM 0 HB2 ASP A 28 38.128 29.502 29.450 1.00 0.00 H new ATOM 0 HB3 ASP A 28 39.216 30.585 28.604 1.00 0.00 H new ATOM 441 N ILE A 29 36.344 29.906 26.655 1.00 0.00 N ATOM 442 CA ILE A 29 36.040 29.662 25.234 1.00 0.00 C ATOM 443 C ILE A 29 34.896 30.555 24.776 1.00 0.00 C ATOM 444 O ILE A 29 34.999 31.140 23.704 1.00 0.00 O ATOM 445 CB ILE A 29 35.792 28.171 24.871 1.00 0.00 C ATOM 446 CG1 ILE A 29 36.888 27.241 25.452 1.00 0.00 C ATOM 447 CG2 ILE A 29 35.898 28.111 23.331 1.00 0.00 C ATOM 448 CD1 ILE A 29 36.462 25.787 25.641 1.00 0.00 C ATOM 0 H ILE A 29 35.884 29.249 27.285 1.00 0.00 H new ATOM 0 HA ILE A 29 36.943 29.927 24.683 1.00 0.00 H new ATOM 0 HB ILE A 29 34.832 27.842 25.270 1.00 0.00 H new ATOM 0 HG12 ILE A 29 37.755 27.268 24.791 1.00 0.00 H new ATOM 0 HG13 ILE A 29 37.209 27.639 26.415 1.00 0.00 H new ATOM 0 HG21 ILE A 29 35.734 27.087 22.995 1.00 0.00 H new ATOM 0 HG22 ILE A 29 35.145 28.763 22.889 1.00 0.00 H new ATOM 0 HG23 ILE A 29 36.890 28.440 23.021 1.00 0.00 H new ATOM 0 HD11 ILE A 29 37.294 25.215 26.051 1.00 0.00 H new ATOM 0 HD12 ILE A 29 35.617 25.742 26.328 1.00 0.00 H new ATOM 0 HD13 ILE A 29 36.171 25.365 24.679 1.00 0.00 H new ATOM 460 N ALA A 30 33.852 30.760 25.580 1.00 0.00 N ATOM 461 CA ALA A 30 32.777 31.660 25.179 1.00 0.00 C ATOM 462 C ALA A 30 33.308 33.080 24.873 1.00 0.00 C ATOM 463 O ALA A 30 32.961 33.671 23.851 1.00 0.00 O ATOM 464 CB ALA A 30 31.709 31.667 26.277 1.00 0.00 C ATOM 0 H ALA A 30 33.731 30.324 26.494 1.00 0.00 H new ATOM 0 HA ALA A 30 32.329 31.303 24.252 1.00 0.00 H new ATOM 0 HB1 ALA A 30 30.898 32.336 25.991 1.00 0.00 H new ATOM 0 HB2 ALA A 30 31.318 30.658 26.410 1.00 0.00 H new ATOM 0 HB3 ALA A 30 32.151 32.011 27.212 1.00 0.00 H new ATOM 470 N GLN A 31 34.243 33.564 25.694 1.00 0.00 N ATOM 471 CA GLN A 31 35.027 34.776 25.451 1.00 0.00 C ATOM 472 C GLN A 31 36.067 34.601 24.344 1.00 0.00 C ATOM 473 O GLN A 31 36.089 35.415 23.428 1.00 0.00 O ATOM 474 CB GLN A 31 35.728 35.181 26.747 1.00 0.00 C ATOM 475 CG GLN A 31 34.749 35.570 27.856 1.00 0.00 C ATOM 476 CD GLN A 31 35.545 36.034 29.056 1.00 0.00 C ATOM 477 OE1 GLN A 31 36.062 35.249 29.846 1.00 0.00 O ATOM 478 NE2 GLN A 31 35.768 37.320 29.163 1.00 0.00 N ATOM 0 H GLN A 31 34.482 33.108 26.574 1.00 0.00 H new ATOM 0 HA GLN A 31 34.336 35.551 25.119 1.00 0.00 H new ATOM 0 HB2 GLN A 31 36.350 34.355 27.091 1.00 0.00 H new ATOM 0 HB3 GLN A 31 36.395 36.020 26.547 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.083 36.362 27.513 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.121 34.720 28.123 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.337 37.969 28.505 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.373 37.673 29.905 1.00 0.00 H new ATOM 487 N GLY A 32 36.923 33.578 24.379 1.00 0.00 N ATOM 488 CA GLY A 32 38.018 33.441 23.407 1.00 0.00 C ATOM 489 C GLY A 32 37.565 33.188 21.964 1.00 0.00 C ATOM 490 O GLY A 32 38.298 33.505 21.024 1.00 0.00 O ATOM 0 H GLY A 32 36.882 32.829 25.070 1.00 0.00 H new ATOM 0 HA2 GLY A 32 38.622 34.348 23.430 1.00 0.00 H new ATOM 0 HA3 GLY A 32 38.663 32.620 23.720 1.00 0.00 H new ATOM 494 N HIS A 33 36.340 32.688 21.773 1.00 0.00 N ATOM 495 CA HIS A 33 35.700 32.483 20.480 1.00 0.00 C ATOM 496 C HIS A 33 34.650 33.558 20.157 1.00 0.00 C ATOM 497 O HIS A 33 33.991 33.489 19.119 1.00 0.00 O ATOM 498 CB HIS A 33 35.132 31.058 20.487 1.00 0.00 C ATOM 499 CG HIS A 33 35.618 30.246 19.304 1.00 0.00 C ATOM 500 ND1 HIS A 33 35.177 30.324 18.009 1.00 0.00 N flip ATOM 501 CD2 HIS A 33 36.712 29.407 19.295 1.00 0.00 C flip ATOM 502 CE1 HIS A 33 35.987 29.499 17.209 1.00 0.00 C flip ATOM 503 NE2 HIS A 33 36.916 28.989 18.038 1.00 0.00 N flip ATOM 0 H HIS A 33 35.746 32.404 22.552 1.00 0.00 H new ATOM 0 HA HIS A 33 36.426 32.588 19.674 1.00 0.00 H new ATOM 0 HB2 HIS A 33 35.419 30.558 21.412 1.00 0.00 H new ATOM 0 HB3 HIS A 33 34.043 31.102 20.473 1.00 0.00 H new ATOM 0 HD2 HIS A 33 37.304 29.133 20.155 1.00 0.00 H new ATOM 0 HE1 HIS A 33 35.885 29.313 16.150 1.00 0.00 H new ATOM 0 HE2 HIS A 33 37.672 28.369 17.749 1.00 0.00 H new ATOM 511 N ASN A 34 34.497 34.557 21.039 1.00 0.00 N ATOM 512 CA ASN A 34 33.570 35.686 20.916 1.00 0.00 C ATOM 513 C ASN A 34 32.148 35.250 20.561 1.00 0.00 C ATOM 514 O ASN A 34 31.523 35.736 19.618 1.00 0.00 O ATOM 515 CB ASN A 34 34.174 36.771 20.016 1.00 0.00 C ATOM 516 CG ASN A 34 35.082 37.661 20.836 1.00 0.00 C ATOM 517 OD1 ASN A 34 34.705 38.748 21.242 1.00 0.00 O ATOM 518 ND2 ASN A 34 36.235 37.169 21.211 1.00 0.00 N ATOM 0 H ASN A 34 35.044 34.599 21.899 1.00 0.00 H new ATOM 0 HA ASN A 34 33.442 36.149 21.894 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.736 36.312 19.202 1.00 0.00 H new ATOM 0 HB3 ASN A 34 33.381 37.364 19.561 1.00 0.00 H new ATOM 0 HD21 ASN A 34 36.831 37.695 21.850 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.538 36.259 20.864 1.00 0.00 H new ATOM 525 N LEU A 35 31.641 34.325 21.368 1.00 0.00 N ATOM 526 CA LEU A 35 30.215 33.973 21.318 1.00 0.00 C ATOM 527 C LEU A 35 29.324 35.198 21.587 1.00 0.00 C ATOM 528 O LEU A 35 29.568 35.984 22.507 1.00 0.00 O ATOM 529 CB LEU A 35 29.883 32.875 22.345 1.00 0.00 C ATOM 530 CG LEU A 35 30.359 31.480 21.903 1.00 0.00 C ATOM 531 CD1 LEU A 35 30.224 30.458 23.031 1.00 0.00 C ATOM 532 CD2 LEU A 35 29.544 30.944 20.727 1.00 0.00 C ATOM 0 H LEU A 35 32.183 33.807 22.059 1.00 0.00 H new ATOM 0 HA LEU A 35 30.014 33.603 20.313 1.00 0.00 H new ATOM 0 HB2 LEU A 35 30.345 33.126 23.300 1.00 0.00 H new ATOM 0 HB3 LEU A 35 28.806 32.851 22.509 1.00 0.00 H new ATOM 0 HG LEU A 35 31.403 31.607 21.616 1.00 0.00 H new ATOM 0 HD11 LEU A 35 30.569 29.484 22.683 1.00 0.00 H new ATOM 0 HD12 LEU A 35 30.827 30.774 23.882 1.00 0.00 H new ATOM 0 HD13 LEU A 35 29.179 30.386 23.333 1.00 0.00 H new ATOM 0 HD21 LEU A 35 29.914 29.957 20.448 1.00 0.00 H new ATOM 0 HD22 LEU A 35 28.495 30.870 21.015 1.00 0.00 H new ATOM 0 HD23 LEU A 35 29.641 31.621 19.878 1.00 0.00 H new ATOM 544 N ASP A 36 28.252 35.317 20.807 1.00 0.00 N ATOM 545 CA ASP A 36 27.185 36.309 20.967 1.00 0.00 C ATOM 546 C ASP A 36 26.273 35.942 22.126 1.00 0.00 C ATOM 547 O ASP A 36 25.189 35.369 21.979 1.00 0.00 O ATOM 548 CB ASP A 36 26.455 36.469 19.634 1.00 0.00 C ATOM 549 CG ASP A 36 25.373 37.546 19.695 1.00 0.00 C ATOM 550 OD1 ASP A 36 25.530 38.551 20.429 1.00 0.00 O ATOM 551 OD2 ASP A 36 24.314 37.378 19.043 1.00 0.00 O ATOM 0 H ASP A 36 28.094 34.699 20.011 1.00 0.00 H new ATOM 0 HA ASP A 36 27.603 37.281 21.228 1.00 0.00 H new ATOM 0 HB2 ASP A 36 27.175 36.723 18.856 1.00 0.00 H new ATOM 0 HB3 ASP A 36 26.003 35.518 19.352 1.00 0.00 H new ATOM 556 N MET A 37 26.799 36.223 23.313 1.00 0.00 N ATOM 557 CA MET A 37 26.327 35.650 24.552 1.00 0.00 C ATOM 558 C MET A 37 26.399 36.652 25.705 1.00 0.00 C ATOM 559 O MET A 37 27.426 37.277 25.972 1.00 0.00 O ATOM 560 CB MET A 37 27.072 34.322 24.767 1.00 0.00 C ATOM 561 CG MET A 37 28.494 34.432 25.340 1.00 0.00 C ATOM 562 SD MET A 37 28.620 34.563 27.143 1.00 0.00 S ATOM 563 CE MET A 37 30.291 35.253 27.289 1.00 0.00 C ATOM 0 H MET A 37 27.580 36.868 23.435 1.00 0.00 H new ATOM 0 HA MET A 37 25.263 35.417 24.507 1.00 0.00 H new ATOM 0 HB2 MET A 37 26.479 33.700 25.437 1.00 0.00 H new ATOM 0 HB3 MET A 37 27.126 33.800 23.812 1.00 0.00 H new ATOM 0 HG2 MET A 37 29.062 33.558 25.019 1.00 0.00 H new ATOM 0 HG3 MET A 37 28.975 35.305 24.898 1.00 0.00 H new ATOM 0 HE1 MET A 37 30.534 35.399 28.342 1.00 0.00 H new ATOM 0 HE2 MET A 37 31.009 34.565 26.843 1.00 0.00 H new ATOM 0 HE3 MET A 37 30.336 36.211 26.770 1.00 0.00 H new ATOM 573 N GLU A 38 25.272 36.814 26.380 1.00 0.00 N ATOM 574 CA GLU A 38 25.197 37.389 27.729 1.00 0.00 C ATOM 575 C GLU A 38 25.660 36.356 28.777 1.00 0.00 C ATOM 576 O GLU A 38 24.984 35.346 28.998 1.00 0.00 O ATOM 577 CB GLU A 38 23.766 37.828 28.058 1.00 0.00 C ATOM 578 CG GLU A 38 23.203 38.964 27.203 1.00 0.00 C ATOM 579 CD GLU A 38 21.854 39.427 27.760 1.00 0.00 C ATOM 580 OE1 GLU A 38 20.921 38.599 27.933 1.00 0.00 O ATOM 581 OE2 GLU A 38 21.695 40.632 28.065 1.00 0.00 O ATOM 0 H GLU A 38 24.362 36.547 26.005 1.00 0.00 H new ATOM 0 HA GLU A 38 25.852 38.260 27.757 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.109 36.964 27.958 1.00 0.00 H new ATOM 0 HB3 GLU A 38 23.732 38.135 29.103 1.00 0.00 H new ATOM 0 HG2 GLU A 38 23.904 39.799 27.187 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.083 38.629 26.173 1.00 0.00 H new ATOM 588 N GLY A 39 26.791 36.620 29.434 1.00 0.00 N ATOM 589 CA GLY A 39 27.433 35.756 30.429 1.00 0.00 C ATOM 590 C GLY A 39 28.536 36.532 31.148 1.00 0.00 C ATOM 591 O GLY A 39 29.660 36.619 30.655 1.00 0.00 O ATOM 0 H GLY A 39 27.310 37.484 29.280 1.00 0.00 H new ATOM 0 HA2 GLY A 39 26.695 35.403 31.149 1.00 0.00 H new ATOM 0 HA3 GLY A 39 27.852 34.875 29.944 1.00 0.00 H new ATOM 595 N ALA A 40 28.209 37.161 32.276 1.00 0.00 N ATOM 596 CA ALA A 40 28.900 38.371 32.736 1.00 0.00 C ATOM 597 C ALA A 40 30.311 38.192 33.343 1.00 0.00 C ATOM 598 O ALA A 40 31.059 39.170 33.390 1.00 0.00 O ATOM 599 CB ALA A 40 27.958 39.092 33.707 1.00 0.00 C ATOM 0 H ALA A 40 27.461 36.850 32.896 1.00 0.00 H new ATOM 0 HA ALA A 40 29.116 38.959 31.844 1.00 0.00 H new ATOM 0 HB1 ALA A 40 28.438 40.000 34.072 1.00 0.00 H new ATOM 0 HB2 ALA A 40 27.034 39.352 33.191 1.00 0.00 H new ATOM 0 HB3 ALA A 40 27.732 38.437 34.549 1.00 0.00 H new ATOM 605 N CYS A 41 30.703 36.993 33.801 1.00 0.00 N ATOM 606 CA CYS A 41 32.033 36.785 34.398 1.00 0.00 C ATOM 607 C CYS A 41 33.169 36.767 33.353 1.00 0.00 C ATOM 608 O CYS A 41 32.962 37.043 32.168 1.00 0.00 O ATOM 609 CB CYS A 41 32.044 35.556 35.324 1.00 0.00 C ATOM 610 SG CYS A 41 33.353 35.504 36.570 1.00 0.00 S ATOM 0 H CYS A 41 30.121 36.156 33.770 1.00 0.00 H new ATOM 0 HA CYS A 41 32.241 37.654 35.022 1.00 0.00 H new ATOM 0 HB2 CYS A 41 31.083 35.504 35.835 1.00 0.00 H new ATOM 0 HB3 CYS A 41 32.125 34.662 34.705 1.00 0.00 H new ATOM 615 N GLY A 42 34.393 36.469 33.792 1.00 0.00 N ATOM 616 CA GLY A 42 35.595 36.567 32.964 1.00 0.00 C ATOM 617 C GLY A 42 36.079 38.007 32.752 1.00 0.00 C ATOM 618 O GLY A 42 36.684 38.305 31.720 1.00 0.00 O ATOM 0 H GLY A 42 34.579 36.149 34.743 1.00 0.00 H new ATOM 0 HA2 GLY A 42 36.394 35.989 33.428 1.00 0.00 H new ATOM 0 HA3 GLY A 42 35.395 36.113 31.993 1.00 0.00 H new ATOM 622 N GLY A 43 35.825 38.904 33.713 1.00 0.00 N ATOM 623 CA GLY A 43 36.169 40.333 33.635 1.00 0.00 C ATOM 624 C GLY A 43 35.056 41.337 33.956 1.00 0.00 C ATOM 625 O GLY A 43 35.242 42.522 33.684 1.00 0.00 O ATOM 0 H GLY A 43 35.364 38.652 34.587 1.00 0.00 H new ATOM 0 HA2 GLY A 43 36.999 40.519 34.316 1.00 0.00 H new ATOM 0 HA3 GLY A 43 36.531 40.539 32.628 1.00 0.00 H new ATOM 629 N SER A 44 33.943 40.906 34.562 1.00 0.00 N ATOM 630 CA SER A 44 33.031 41.803 35.297 1.00 0.00 C ATOM 631 C SER A 44 32.863 41.320 36.739 1.00 0.00 C ATOM 632 O SER A 44 32.669 40.121 36.974 1.00 0.00 O ATOM 633 CB SER A 44 31.658 41.969 34.633 1.00 0.00 C ATOM 634 OG SER A 44 31.764 42.109 33.226 1.00 0.00 O ATOM 0 H SER A 44 33.646 39.930 34.559 1.00 0.00 H new ATOM 0 HA SER A 44 33.498 42.788 35.283 1.00 0.00 H new ATOM 0 HB2 SER A 44 31.035 41.105 34.866 1.00 0.00 H new ATOM 0 HB3 SER A 44 31.157 42.844 35.048 1.00 0.00 H new ATOM 0 HG SER A 44 31.568 41.250 32.796 1.00 0.00 H new ATOM 640 N CYS A 45 32.951 42.245 37.701 1.00 0.00 N ATOM 641 CA CYS A 45 33.145 41.958 39.127 1.00 0.00 C ATOM 642 C CYS A 45 34.397 41.080 39.411 1.00 0.00 C ATOM 643 O CYS A 45 35.150 40.708 38.505 1.00 0.00 O ATOM 644 CB CYS A 45 31.824 41.386 39.678 1.00 0.00 C ATOM 645 SG CYS A 45 31.688 41.656 41.467 1.00 0.00 S ATOM 0 H CYS A 45 32.887 43.244 37.503 1.00 0.00 H new ATOM 0 HA CYS A 45 33.374 42.878 39.664 1.00 0.00 H new ATOM 0 HB2 CYS A 45 30.981 41.857 39.171 1.00 0.00 H new ATOM 0 HB3 CYS A 45 31.769 40.319 39.463 1.00 0.00 H new ATOM 0 HG CYS A 45 30.649 41.022 41.924 1.00 0.00 H new ATOM 651 N ALA A 46 34.631 40.715 40.676 1.00 0.00 N ATOM 652 CA ALA A 46 35.677 39.749 41.041 1.00 0.00 C ATOM 653 C ALA A 46 35.372 38.350 40.462 1.00 0.00 C ATOM 654 O ALA A 46 36.257 37.684 39.919 1.00 0.00 O ATOM 655 CB ALA A 46 35.802 39.725 42.570 1.00 0.00 C ATOM 0 H ALA A 46 34.106 41.077 41.472 1.00 0.00 H new ATOM 0 HA ALA A 46 36.631 40.054 40.611 1.00 0.00 H new ATOM 0 HB1 ALA A 46 36.574 39.013 42.861 1.00 0.00 H new ATOM 0 HB2 ALA A 46 36.071 40.719 42.929 1.00 0.00 H new ATOM 0 HB3 ALA A 46 34.850 39.426 43.008 1.00 0.00 H new ATOM 661 N CYS A 47 34.103 37.943 40.532 1.00 0.00 N ATOM 662 CA CYS A 47 33.475 36.882 39.743 1.00 0.00 C ATOM 663 C CYS A 47 31.974 37.198 39.553 1.00 0.00 C ATOM 664 O CYS A 47 31.396 37.912 40.379 1.00 0.00 O ATOM 665 CB CYS A 47 33.704 35.518 40.413 1.00 0.00 C ATOM 666 SG CYS A 47 34.791 34.395 39.508 1.00 0.00 S ATOM 0 H CYS A 47 33.445 38.373 41.182 1.00 0.00 H new ATOM 0 HA CYS A 47 33.931 36.834 38.754 1.00 0.00 H new ATOM 0 HB2 CYS A 47 34.123 35.684 41.406 1.00 0.00 H new ATOM 0 HB3 CYS A 47 32.738 35.032 40.552 1.00 0.00 H new ATOM 671 N SER A 48 31.337 36.690 38.491 1.00 0.00 N ATOM 672 CA SER A 48 29.912 36.928 38.169 1.00 0.00 C ATOM 673 C SER A 48 29.222 35.675 37.574 1.00 0.00 C ATOM 674 O SER A 48 29.732 34.571 37.714 1.00 0.00 O ATOM 675 CB SER A 48 29.793 38.186 37.291 1.00 0.00 C ATOM 676 OG SER A 48 28.440 38.588 37.203 1.00 0.00 O ATOM 0 H SER A 48 31.803 36.088 37.812 1.00 0.00 H new ATOM 0 HA SER A 48 29.362 37.118 39.091 1.00 0.00 H new ATOM 0 HB2 SER A 48 30.394 38.992 37.713 1.00 0.00 H new ATOM 0 HB3 SER A 48 30.186 37.983 36.295 1.00 0.00 H new ATOM 0 HG SER A 48 28.373 39.390 36.644 1.00 0.00 H new ATOM 682 N THR A 49 28.048 35.814 36.955 1.00 0.00 N ATOM 683 CA THR A 49 27.042 34.762 36.667 1.00 0.00 C ATOM 684 C THR A 49 27.533 33.403 36.128 1.00 0.00 C ATOM 685 O THR A 49 27.108 32.366 36.628 1.00 0.00 O ATOM 686 CB THR A 49 26.006 35.298 35.671 1.00 0.00 C ATOM 687 OG1 THR A 49 26.659 35.725 34.495 1.00 0.00 O ATOM 688 CG2 THR A 49 25.208 36.482 36.217 1.00 0.00 C ATOM 0 H THR A 49 27.743 36.725 36.613 1.00 0.00 H new ATOM 0 HA THR A 49 26.646 34.544 37.659 1.00 0.00 H new ATOM 0 HB THR A 49 25.313 34.480 35.476 1.00 0.00 H new ATOM 0 HG1 THR A 49 25.993 35.915 33.802 1.00 0.00 H new ATOM 0 HG21 THR A 49 24.492 36.816 35.466 1.00 0.00 H new ATOM 0 HG22 THR A 49 24.674 36.177 37.117 1.00 0.00 H new ATOM 0 HG23 THR A 49 25.888 37.299 36.458 1.00 0.00 H new ATOM 696 N CYS A 50 28.405 33.374 35.114 1.00 0.00 N ATOM 697 CA CYS A 50 29.120 32.162 34.671 1.00 0.00 C ATOM 698 C CYS A 50 28.253 30.915 34.362 1.00 0.00 C ATOM 699 O CYS A 50 28.659 29.769 34.583 1.00 0.00 O ATOM 700 CB CYS A 50 30.181 31.877 35.721 1.00 0.00 C ATOM 701 SG CYS A 50 31.506 30.735 35.317 1.00 0.00 S ATOM 0 H CYS A 50 28.640 34.202 34.567 1.00 0.00 H new ATOM 0 HA CYS A 50 29.548 32.373 33.691 1.00 0.00 H new ATOM 0 HB2 CYS A 50 30.637 32.828 35.998 1.00 0.00 H new ATOM 0 HB3 CYS A 50 29.675 31.496 36.608 1.00 0.00 H new ATOM 706 N HIS A 51 27.044 31.118 33.831 1.00 0.00 N ATOM 707 CA HIS A 51 26.018 30.076 33.831 1.00 0.00 C ATOM 708 C HIS A 51 26.047 29.231 32.547 1.00 0.00 C ATOM 709 O HIS A 51 26.091 29.741 31.427 1.00 0.00 O ATOM 710 CB HIS A 51 24.638 30.701 34.117 1.00 0.00 C ATOM 711 CG HIS A 51 24.267 31.878 33.243 1.00 0.00 C ATOM 712 ND1 HIS A 51 24.334 31.935 31.872 1.00 0.00 N ATOM 713 CD2 HIS A 51 23.811 33.099 33.666 1.00 0.00 C ATOM 714 CE1 HIS A 51 23.960 33.162 31.482 1.00 0.00 C ATOM 715 NE2 HIS A 51 23.627 33.921 32.545 1.00 0.00 N ATOM 0 H HIS A 51 26.754 31.994 33.396 1.00 0.00 H new ATOM 0 HA HIS A 51 26.234 29.373 34.635 1.00 0.00 H new ATOM 0 HB2 HIS A 51 23.877 29.929 34.001 1.00 0.00 H new ATOM 0 HB3 HIS A 51 24.611 31.021 35.159 1.00 0.00 H new ATOM 0 HD1 HIS A 51 24.620 31.174 31.256 1.00 0.00 H new ATOM 0 HD2 HIS A 51 23.624 33.381 34.692 1.00 0.00 H new ATOM 0 HE1 HIS A 51 23.930 33.497 30.456 1.00 0.00 H new ATOM 723 N VAL A 52 26.026 27.912 32.737 1.00 0.00 N ATOM 724 CA VAL A 52 25.841 26.880 31.708 1.00 0.00 C ATOM 725 C VAL A 52 24.962 25.743 32.207 1.00 0.00 C ATOM 726 O VAL A 52 24.743 25.551 33.402 1.00 0.00 O ATOM 727 CB VAL A 52 27.166 26.294 31.151 1.00 0.00 C ATOM 728 CG1 VAL A 52 27.508 26.885 29.794 1.00 0.00 C ATOM 729 CG2 VAL A 52 28.402 26.496 32.037 1.00 0.00 C ATOM 0 H VAL A 52 26.144 27.508 33.666 1.00 0.00 H new ATOM 0 HA VAL A 52 25.348 27.399 30.886 1.00 0.00 H new ATOM 0 HB VAL A 52 26.955 25.226 31.100 1.00 0.00 H new ATOM 0 HG11 VAL A 52 28.441 26.453 29.434 1.00 0.00 H new ATOM 0 HG12 VAL A 52 26.708 26.662 29.088 1.00 0.00 H new ATOM 0 HG13 VAL A 52 27.620 27.965 29.885 1.00 0.00 H new ATOM 0 HG21 VAL A 52 29.272 26.049 31.555 1.00 0.00 H new ATOM 0 HG22 VAL A 52 28.575 27.562 32.182 1.00 0.00 H new ATOM 0 HG23 VAL A 52 28.238 26.020 33.004 1.00 0.00 H new ATOM 739 N ILE A 53 24.506 24.929 31.270 1.00 0.00 N ATOM 740 CA ILE A 53 23.982 23.593 31.470 1.00 0.00 C ATOM 741 C ILE A 53 24.559 22.678 30.381 1.00 0.00 C ATOM 742 O ILE A 53 24.834 23.126 29.282 1.00 0.00 O ATOM 743 CB ILE A 53 22.448 23.684 31.516 1.00 0.00 C ATOM 744 CG1 ILE A 53 21.906 22.271 31.778 1.00 0.00 C ATOM 745 CG2 ILE A 53 21.868 24.390 30.275 1.00 0.00 C ATOM 746 CD1 ILE A 53 20.684 21.895 30.990 1.00 0.00 C ATOM 0 H ILE A 53 24.492 25.203 30.288 1.00 0.00 H new ATOM 0 HA ILE A 53 24.284 23.147 32.418 1.00 0.00 H new ATOM 0 HB ILE A 53 22.118 24.325 32.333 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.695 21.551 31.559 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.676 22.179 32.839 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.782 24.430 30.354 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.265 25.403 30.214 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.147 23.837 29.378 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.383 20.880 31.248 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.873 22.585 31.224 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.908 21.947 29.925 1.00 0.00 H new ATOM 758 N VAL A 54 24.791 21.408 30.698 1.00 0.00 N ATOM 759 CA VAL A 54 25.423 20.390 29.860 1.00 0.00 C ATOM 760 C VAL A 54 24.463 19.368 29.250 1.00 0.00 C ATOM 761 O VAL A 54 23.372 19.102 29.768 1.00 0.00 O ATOM 762 CB VAL A 54 26.544 19.769 30.698 1.00 0.00 C ATOM 763 CG1 VAL A 54 26.049 18.722 31.633 1.00 0.00 C ATOM 764 CG2 VAL A 54 27.676 19.071 29.927 1.00 0.00 C ATOM 0 H VAL A 54 24.525 21.036 31.609 1.00 0.00 H new ATOM 0 HA VAL A 54 25.830 20.859 28.964 1.00 0.00 H new ATOM 0 HB VAL A 54 26.932 20.658 31.195 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.886 18.316 32.201 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.323 19.160 32.318 1.00 0.00 H new ATOM 0 HG13 VAL A 54 25.575 17.922 31.065 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.406 18.674 30.633 1.00 0.00 H new ATOM 0 HG22 VAL A 54 27.263 18.255 29.334 1.00 0.00 H new ATOM 0 HG23 VAL A 54 28.163 19.789 29.267 1.00 0.00 H new ATOM 774 N ASP A 55 24.931 18.735 28.177 1.00 0.00 N ATOM 775 CA ASP A 55 24.431 17.447 27.699 1.00 0.00 C ATOM 776 C ASP A 55 24.445 16.386 28.839 1.00 0.00 C ATOM 777 O ASP A 55 25.482 16.228 29.499 1.00 0.00 O ATOM 778 CB ASP A 55 25.437 17.006 26.623 1.00 0.00 C ATOM 779 CG ASP A 55 25.040 15.793 25.776 1.00 0.00 C ATOM 780 OD1 ASP A 55 24.135 15.027 26.179 1.00 0.00 O ATOM 781 OD2 ASP A 55 25.640 15.608 24.691 1.00 0.00 O ATOM 0 H ASP A 55 25.685 19.111 27.602 1.00 0.00 H new ATOM 0 HA ASP A 55 23.408 17.536 27.333 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.612 17.848 25.953 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.386 16.785 27.112 1.00 0.00 H new ATOM 786 N PRO A 56 23.398 15.552 29.001 1.00 0.00 N ATOM 787 CA PRO A 56 23.390 14.402 29.915 1.00 0.00 C ATOM 788 C PRO A 56 24.472 13.344 29.645 1.00 0.00 C ATOM 789 O PRO A 56 24.713 12.486 30.498 1.00 0.00 O ATOM 790 CB PRO A 56 21.984 13.800 29.801 1.00 0.00 C ATOM 791 CG PRO A 56 21.124 15.003 29.420 1.00 0.00 C ATOM 792 CD PRO A 56 22.054 15.784 28.494 1.00 0.00 C ATOM 0 HA PRO A 56 23.629 14.746 30.921 1.00 0.00 H new ATOM 0 HB2 PRO A 56 21.941 13.017 29.044 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.659 13.353 30.741 1.00 0.00 H new ATOM 0 HG2 PRO A 56 20.205 14.703 28.916 1.00 0.00 H new ATOM 0 HG3 PRO A 56 20.833 15.588 30.292 1.00 0.00 H new ATOM 0 HD2 PRO A 56 21.959 15.441 27.464 1.00 0.00 H new ATOM 0 HD3 PRO A 56 21.811 16.847 28.500 1.00 0.00 H new ATOM 800 N ASP A 57 25.138 13.396 28.488 1.00 0.00 N ATOM 801 CA ASP A 57 26.302 12.568 28.160 1.00 0.00 C ATOM 802 C ASP A 57 27.587 13.063 28.828 1.00 0.00 C ATOM 803 O ASP A 57 28.321 12.255 29.401 1.00 0.00 O ATOM 804 CB ASP A 57 26.502 12.529 26.637 1.00 0.00 C ATOM 805 CG ASP A 57 26.012 11.215 26.043 1.00 0.00 C ATOM 806 OD1 ASP A 57 24.786 10.946 26.068 1.00 0.00 O ATOM 807 OD2 ASP A 57 26.864 10.445 25.542 1.00 0.00 O ATOM 0 H ASP A 57 24.876 14.031 27.734 1.00 0.00 H new ATOM 0 HA ASP A 57 26.099 11.568 28.543 1.00 0.00 H new ATOM 0 HB2 ASP A 57 25.966 13.359 26.177 1.00 0.00 H new ATOM 0 HB3 ASP A 57 27.558 12.663 26.404 1.00 0.00 H new ATOM 812 N TYR A 58 27.878 14.370 28.788 1.00 0.00 N ATOM 813 CA TYR A 58 29.164 14.883 29.239 1.00 0.00 C ATOM 814 C TYR A 58 29.147 15.399 30.670 1.00 0.00 C ATOM 815 O TYR A 58 30.214 15.487 31.265 1.00 0.00 O ATOM 816 CB TYR A 58 29.578 15.957 28.249 1.00 0.00 C ATOM 817 CG TYR A 58 29.876 15.410 26.872 1.00 0.00 C ATOM 818 CD1 TYR A 58 31.137 14.864 26.573 1.00 0.00 C ATOM 819 CD2 TYR A 58 28.864 15.417 25.901 1.00 0.00 C ATOM 820 CE1 TYR A 58 31.381 14.328 25.293 1.00 0.00 C ATOM 821 CE2 TYR A 58 29.109 14.916 24.613 1.00 0.00 C ATOM 822 CZ TYR A 58 30.367 14.349 24.310 1.00 0.00 C ATOM 823 OH TYR A 58 30.608 13.825 23.080 1.00 0.00 O ATOM 0 H TYR A 58 27.236 15.085 28.447 1.00 0.00 H new ATOM 0 HA TYR A 58 29.891 14.071 29.264 1.00 0.00 H new ATOM 0 HB2 TYR A 58 28.784 16.700 28.174 1.00 0.00 H new ATOM 0 HB3 TYR A 58 30.461 16.471 28.628 1.00 0.00 H new ATOM 0 HD1 TYR A 58 31.915 14.856 27.322 1.00 0.00 H new ATOM 0 HD2 TYR A 58 27.889 15.811 26.146 1.00 0.00 H new ATOM 0 HE1 TYR A 58 32.346 13.900 25.063 1.00 0.00 H new ATOM 0 HE2 TYR A 58 28.339 14.964 23.857 1.00 0.00 H new ATOM 0 HH TYR A 58 31.571 13.845 22.899 1.00 0.00 H new ATOM 833 N TYR A 59 27.968 15.654 31.256 1.00 0.00 N ATOM 834 CA TYR A 59 27.836 15.809 32.722 1.00 0.00 C ATOM 835 C TYR A 59 28.254 14.576 33.485 1.00 0.00 C ATOM 836 O TYR A 59 28.526 14.655 34.681 1.00 0.00 O ATOM 837 CB TYR A 59 26.372 15.931 33.166 1.00 0.00 C ATOM 838 CG TYR A 59 26.118 16.763 34.428 1.00 0.00 C ATOM 839 CD1 TYR A 59 26.729 18.018 34.593 1.00 0.00 C ATOM 840 CD2 TYR A 59 25.269 16.298 35.452 1.00 0.00 C ATOM 841 CE1 TYR A 59 26.483 18.815 35.715 1.00 0.00 C ATOM 842 CE2 TYR A 59 25.029 17.083 36.603 1.00 0.00 C ATOM 843 CZ TYR A 59 25.615 18.362 36.727 1.00 0.00 C ATOM 844 OH TYR A 59 25.273 19.196 37.746 1.00 0.00 O ATOM 0 H TYR A 59 27.092 15.758 30.744 1.00 0.00 H new ATOM 0 HA TYR A 59 28.449 16.687 32.926 1.00 0.00 H new ATOM 0 HB2 TYR A 59 25.800 16.367 32.347 1.00 0.00 H new ATOM 0 HB3 TYR A 59 25.979 14.928 33.331 1.00 0.00 H new ATOM 0 HD1 TYR A 59 27.407 18.376 33.832 1.00 0.00 H new ATOM 0 HD2 TYR A 59 24.797 15.332 35.357 1.00 0.00 H new ATOM 0 HE1 TYR A 59 26.960 19.780 35.806 1.00 0.00 H new ATOM 0 HE2 TYR A 59 24.395 16.703 37.391 1.00 0.00 H new ATOM 0 HH TYR A 59 25.344 20.126 37.445 1.00 0.00 H new ATOM 854 N ASP A 60 28.153 13.412 32.848 1.00 0.00 N ATOM 855 CA ASP A 60 27.942 12.183 33.607 1.00 0.00 C ATOM 856 C ASP A 60 29.235 11.666 34.280 1.00 0.00 C ATOM 857 O ASP A 60 29.296 10.605 34.911 1.00 0.00 O ATOM 858 CB ASP A 60 27.320 11.151 32.678 1.00 0.00 C ATOM 859 CG ASP A 60 26.392 10.197 33.425 1.00 0.00 C ATOM 860 OD1 ASP A 60 25.419 10.689 34.042 1.00 0.00 O ATOM 861 OD2 ASP A 60 26.614 8.965 33.391 1.00 0.00 O ATOM 0 H ASP A 60 28.212 13.294 31.837 1.00 0.00 H new ATOM 0 HA ASP A 60 27.262 12.386 34.434 1.00 0.00 H new ATOM 0 HB2 ASP A 60 26.761 11.660 31.893 1.00 0.00 H new ATOM 0 HB3 ASP A 60 28.110 10.580 32.189 1.00 0.00 H new ATOM 866 N ALA A 61 30.280 12.467 34.096 1.00 0.00 N ATOM 867 CA ALA A 61 31.647 12.356 34.579 1.00 0.00 C ATOM 868 C ALA A 61 32.028 13.510 35.540 1.00 0.00 C ATOM 869 O ALA A 61 33.132 13.518 36.093 1.00 0.00 O ATOM 870 CB ALA A 61 32.508 12.353 33.308 1.00 0.00 C ATOM 0 H ALA A 61 30.171 13.312 33.535 1.00 0.00 H new ATOM 0 HA ALA A 61 31.794 11.454 35.173 1.00 0.00 H new ATOM 0 HB1 ALA A 61 33.560 12.272 33.581 1.00 0.00 H new ATOM 0 HB2 ALA A 61 32.229 11.505 32.682 1.00 0.00 H new ATOM 0 HB3 ALA A 61 32.347 13.280 32.757 1.00 0.00 H new ATOM 876 N LEU A 62 31.137 14.501 35.707 1.00 0.00 N ATOM 877 CA LEU A 62 31.443 15.842 36.249 1.00 0.00 C ATOM 878 C LEU A 62 31.049 16.052 37.735 1.00 0.00 C ATOM 879 O LEU A 62 30.030 15.504 38.178 1.00 0.00 O ATOM 880 CB LEU A 62 30.792 16.923 35.363 1.00 0.00 C ATOM 881 CG LEU A 62 31.293 16.908 33.913 1.00 0.00 C ATOM 882 CD1 LEU A 62 30.866 18.192 33.195 1.00 0.00 C ATOM 883 CD2 LEU A 62 32.808 16.763 33.772 1.00 0.00 C ATOM 0 H LEU A 62 30.153 14.391 35.462 1.00 0.00 H new ATOM 0 HA LEU A 62 32.529 15.929 36.229 1.00 0.00 H new ATOM 0 HB2 LEU A 62 29.711 16.783 35.367 1.00 0.00 H new ATOM 0 HB3 LEU A 62 30.988 17.904 35.797 1.00 0.00 H new ATOM 0 HG LEU A 62 30.840 16.025 33.462 1.00 0.00 H new ATOM 0 HD11 LEU A 62 31.227 18.171 32.167 1.00 0.00 H new ATOM 0 HD12 LEU A 62 29.778 18.265 33.197 1.00 0.00 H new ATOM 0 HD13 LEU A 62 31.289 19.055 33.710 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.077 16.761 32.716 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.301 17.597 34.271 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.128 15.827 34.229 1.00 0.00 H new ATOM 895 N PRO A 63 31.807 16.882 38.483 1.00 0.00 N ATOM 896 CA PRO A 63 31.531 17.335 39.849 1.00 0.00 C ATOM 897 C PRO A 63 30.591 18.552 39.884 1.00 0.00 C ATOM 898 O PRO A 63 30.265 19.143 38.854 1.00 0.00 O ATOM 899 CB PRO A 63 32.908 17.702 40.412 1.00 0.00 C ATOM 900 CG PRO A 63 33.573 18.348 39.199 1.00 0.00 C ATOM 901 CD PRO A 63 33.056 17.493 38.043 1.00 0.00 C ATOM 0 HA PRO A 63 31.023 16.564 40.428 1.00 0.00 H new ATOM 0 HB2 PRO A 63 32.836 18.390 41.255 1.00 0.00 H new ATOM 0 HB3 PRO A 63 33.455 16.826 40.761 1.00 0.00 H new ATOM 0 HG2 PRO A 63 33.288 19.394 39.089 1.00 0.00 H new ATOM 0 HG3 PRO A 63 34.660 18.320 39.270 1.00 0.00 H new ATOM 0 HD2 PRO A 63 32.893 18.104 37.155 1.00 0.00 H new ATOM 0 HD3 PRO A 63 33.785 16.728 37.774 1.00 0.00 H new ATOM 909 N GLU A 64 30.187 18.954 41.089 1.00 0.00 N ATOM 910 CA GLU A 64 29.490 20.213 41.373 1.00 0.00 C ATOM 911 C GLU A 64 30.331 21.181 42.245 1.00 0.00 C ATOM 912 O GLU A 64 31.356 20.776 42.810 1.00 0.00 O ATOM 913 CB GLU A 64 28.116 19.912 41.990 1.00 0.00 C ATOM 914 CG GLU A 64 27.175 19.287 40.951 1.00 0.00 C ATOM 915 CD GLU A 64 25.745 19.230 41.480 1.00 0.00 C ATOM 916 OE1 GLU A 64 25.053 20.278 41.476 1.00 0.00 O ATOM 917 OE2 GLU A 64 25.279 18.150 41.914 1.00 0.00 O ATOM 0 H GLU A 64 30.341 18.393 41.927 1.00 0.00 H new ATOM 0 HA GLU A 64 29.340 20.739 40.430 1.00 0.00 H new ATOM 0 HB2 GLU A 64 28.233 19.234 42.835 1.00 0.00 H new ATOM 0 HB3 GLU A 64 27.677 20.832 42.377 1.00 0.00 H new ATOM 0 HG2 GLU A 64 27.204 19.870 40.030 1.00 0.00 H new ATOM 0 HG3 GLU A 64 27.516 18.282 40.703 1.00 0.00 H new ATOM 924 N PRO A 65 29.967 22.481 42.325 1.00 0.00 N ATOM 925 CA PRO A 65 30.785 23.518 42.959 1.00 0.00 C ATOM 926 C PRO A 65 30.500 23.749 44.455 1.00 0.00 C ATOM 927 O PRO A 65 29.580 23.166 45.037 1.00 0.00 O ATOM 928 CB PRO A 65 30.547 24.779 42.120 1.00 0.00 C ATOM 929 CG PRO A 65 29.807 24.311 40.873 1.00 0.00 C ATOM 930 CD PRO A 65 29.008 23.178 41.474 1.00 0.00 C ATOM 0 HA PRO A 65 31.831 23.210 42.969 1.00 0.00 H new ATOM 0 HB2 PRO A 65 29.959 25.512 42.673 1.00 0.00 H new ATOM 0 HB3 PRO A 65 31.490 25.259 41.859 1.00 0.00 H new ATOM 0 HG2 PRO A 65 29.175 25.088 40.443 1.00 0.00 H new ATOM 0 HG3 PRO A 65 30.482 23.977 40.085 1.00 0.00 H new ATOM 0 HD2 PRO A 65 28.160 23.549 42.049 1.00 0.00 H new ATOM 0 HD3 PRO A 65 28.607 22.520 40.703 1.00 0.00 H new ATOM 938 N GLU A 66 31.300 24.610 45.086 1.00 0.00 N ATOM 939 CA GLU A 66 31.020 25.191 46.410 1.00 0.00 C ATOM 940 C GLU A 66 29.735 26.047 46.456 1.00 0.00 C ATOM 941 O GLU A 66 29.236 26.524 45.441 1.00 0.00 O ATOM 942 CB GLU A 66 32.219 26.047 46.867 1.00 0.00 C ATOM 943 CG GLU A 66 33.316 25.194 47.508 1.00 0.00 C ATOM 944 CD GLU A 66 34.436 26.046 48.119 1.00 0.00 C ATOM 945 OE1 GLU A 66 34.203 26.728 49.149 1.00 0.00 O ATOM 946 OE2 GLU A 66 35.573 26.012 47.592 1.00 0.00 O ATOM 0 H GLU A 66 32.181 24.933 44.686 1.00 0.00 H new ATOM 0 HA GLU A 66 30.860 24.350 47.084 1.00 0.00 H new ATOM 0 HB2 GLU A 66 32.629 26.584 46.012 1.00 0.00 H new ATOM 0 HB3 GLU A 66 31.879 26.797 47.581 1.00 0.00 H new ATOM 0 HG2 GLU A 66 32.878 24.565 48.283 1.00 0.00 H new ATOM 0 HG3 GLU A 66 33.739 24.527 46.757 1.00 0.00 H new ATOM 953 N ASP A 67 29.242 26.323 47.665 1.00 0.00 N ATOM 954 CA ASP A 67 28.062 27.156 47.959 1.00 0.00 C ATOM 955 C ASP A 67 28.206 28.639 47.526 1.00 0.00 C ATOM 956 O ASP A 67 27.210 29.342 47.379 1.00 0.00 O ATOM 957 CB ASP A 67 27.816 26.998 49.472 1.00 0.00 C ATOM 958 CG ASP A 67 26.579 27.706 50.028 1.00 0.00 C ATOM 959 OD1 ASP A 67 25.435 27.265 49.748 1.00 0.00 O ATOM 960 OD2 ASP A 67 26.760 28.640 50.846 1.00 0.00 O ATOM 0 H ASP A 67 29.673 25.955 48.513 1.00 0.00 H new ATOM 0 HA ASP A 67 27.207 26.820 47.372 1.00 0.00 H new ATOM 0 HB2 ASP A 67 27.734 25.935 49.697 1.00 0.00 H new ATOM 0 HB3 ASP A 67 28.692 27.370 50.003 1.00 0.00 H new ATOM 965 N ASP A 68 29.429 29.143 47.323 1.00 0.00 N ATOM 966 CA ASP A 68 29.745 30.444 46.689 1.00 0.00 C ATOM 967 C ASP A 68 29.931 30.371 45.170 1.00 0.00 C ATOM 968 O ASP A 68 29.896 31.388 44.480 1.00 0.00 O ATOM 969 CB ASP A 68 30.986 31.008 47.396 1.00 0.00 C ATOM 970 CG ASP A 68 31.343 32.443 47.000 1.00 0.00 C ATOM 971 OD1 ASP A 68 30.503 33.360 47.186 1.00 0.00 O ATOM 972 OD2 ASP A 68 32.494 32.670 46.555 1.00 0.00 O ATOM 0 H ASP A 68 30.269 28.638 47.606 1.00 0.00 H new ATOM 0 HA ASP A 68 28.891 31.110 46.812 1.00 0.00 H new ATOM 0 HB2 ASP A 68 30.823 30.971 48.473 1.00 0.00 H new ATOM 0 HB3 ASP A 68 31.837 30.362 47.180 1.00 0.00 H new ATOM 977 N GLU A 69 30.156 29.178 44.641 1.00 0.00 N ATOM 978 CA GLU A 69 30.326 28.910 43.211 1.00 0.00 C ATOM 979 C GLU A 69 28.988 28.541 42.521 1.00 0.00 C ATOM 980 O GLU A 69 28.670 29.067 41.460 1.00 0.00 O ATOM 981 CB GLU A 69 31.383 27.813 43.110 1.00 0.00 C ATOM 982 CG GLU A 69 32.781 28.239 43.566 1.00 0.00 C ATOM 983 CD GLU A 69 33.786 27.084 43.505 1.00 0.00 C ATOM 984 OE1 GLU A 69 33.400 25.896 43.597 1.00 0.00 O ATOM 985 OE2 GLU A 69 35.002 27.370 43.410 1.00 0.00 O ATOM 0 H GLU A 69 30.229 28.336 45.212 1.00 0.00 H new ATOM 0 HA GLU A 69 30.656 29.800 42.676 1.00 0.00 H new ATOM 0 HB2 GLU A 69 31.063 26.960 43.709 1.00 0.00 H new ATOM 0 HB3 GLU A 69 31.439 27.473 42.076 1.00 0.00 H new ATOM 0 HG2 GLU A 69 33.132 29.058 42.938 1.00 0.00 H new ATOM 0 HG3 GLU A 69 32.729 28.619 44.586 1.00 0.00 H new ATOM 992 N ASN A 70 28.138 27.702 43.132 1.00 0.00 N ATOM 993 CA ASN A 70 26.803 27.343 42.612 1.00 0.00 C ATOM 994 C ASN A 70 25.763 28.489 42.697 1.00 0.00 C ATOM 995 O ASN A 70 24.764 28.496 41.976 1.00 0.00 O ATOM 996 CB ASN A 70 26.340 26.019 43.259 1.00 0.00 C ATOM 997 CG ASN A 70 25.884 26.099 44.711 1.00 0.00 C ATOM 998 OD1 ASN A 70 25.392 27.105 45.201 1.00 0.00 O ATOM 999 ND2 ASN A 70 25.973 25.010 45.434 1.00 0.00 N ATOM 0 H ASN A 70 28.359 27.244 44.016 1.00 0.00 H new ATOM 0 HA ASN A 70 26.890 27.180 41.538 1.00 0.00 H new ATOM 0 HB2 ASN A 70 25.520 25.617 42.665 1.00 0.00 H new ATOM 0 HB3 ASN A 70 27.160 25.303 43.197 1.00 0.00 H new ATOM 0 HD21 ASN A 70 25.633 25.007 46.396 1.00 0.00 H new ATOM 0 HD22 ASN A 70 26.382 24.165 45.035 1.00 0.00 H new ATOM 1006 N ASP A 71 26.041 29.486 43.538 1.00 0.00 N ATOM 1007 CA ASP A 71 25.288 30.740 43.705 1.00 0.00 C ATOM 1008 C ASP A 71 25.637 31.774 42.634 1.00 0.00 C ATOM 1009 O ASP A 71 25.061 32.854 42.626 1.00 0.00 O ATOM 1010 CB ASP A 71 25.506 31.359 45.091 1.00 0.00 C ATOM 1011 CG ASP A 71 24.293 32.149 45.598 1.00 0.00 C ATOM 1012 OD1 ASP A 71 23.187 31.559 45.647 1.00 0.00 O ATOM 1013 OD2 ASP A 71 24.457 33.306 46.061 1.00 0.00 O ATOM 0 H ASP A 71 26.847 29.441 44.162 1.00 0.00 H new ATOM 0 HA ASP A 71 24.238 30.468 43.598 1.00 0.00 H new ATOM 0 HB2 ASP A 71 25.739 30.567 45.803 1.00 0.00 H new ATOM 0 HB3 ASP A 71 26.372 32.020 45.054 1.00 0.00 H new ATOM 1018 N MET A 72 26.664 31.521 41.821 1.00 0.00 N ATOM 1019 CA MET A 72 26.927 32.279 40.592 1.00 0.00 C ATOM 1020 C MET A 72 25.847 31.913 39.542 1.00 0.00 C ATOM 1021 O MET A 72 25.338 32.772 38.826 1.00 0.00 O ATOM 1022 CB MET A 72 28.377 32.020 40.155 1.00 0.00 C ATOM 1023 CG MET A 72 29.382 32.159 41.326 1.00 0.00 C ATOM 1024 SD MET A 72 29.447 33.738 42.215 1.00 0.00 S ATOM 1025 CE MET A 72 29.825 34.850 40.855 1.00 0.00 C ATOM 0 H MET A 72 27.342 30.780 41.996 1.00 0.00 H new ATOM 0 HA MET A 72 26.848 33.356 40.738 1.00 0.00 H new ATOM 0 HB2 MET A 72 28.452 31.018 39.732 1.00 0.00 H new ATOM 0 HB3 MET A 72 28.646 32.721 39.364 1.00 0.00 H new ATOM 0 HG2 MET A 72 29.158 31.377 42.052 1.00 0.00 H new ATOM 0 HG3 MET A 72 30.379 31.955 40.935 1.00 0.00 H new ATOM 0 HE1 MET A 72 30.261 35.769 41.247 1.00 0.00 H new ATOM 0 HE2 MET A 72 30.534 34.371 40.180 1.00 0.00 H new ATOM 0 HE3 MET A 72 28.910 35.085 40.312 1.00 0.00 H new ATOM 1035 N LEU A 73 25.390 30.651 39.561 1.00 0.00 N ATOM 1036 CA LEU A 73 24.520 29.994 38.582 1.00 0.00 C ATOM 1037 C LEU A 73 23.037 30.284 38.828 1.00 0.00 C ATOM 1038 O LEU A 73 22.330 30.724 37.931 1.00 0.00 O ATOM 1039 CB LEU A 73 24.756 28.471 38.644 1.00 0.00 C ATOM 1040 CG LEU A 73 26.207 28.005 38.784 1.00 0.00 C ATOM 1041 CD1 LEU A 73 26.235 26.474 38.812 1.00 0.00 C ATOM 1042 CD2 LEU A 73 27.004 28.512 37.591 1.00 0.00 C ATOM 0 H LEU A 73 25.640 30.018 40.321 1.00 0.00 H new ATOM 0 HA LEU A 73 24.771 30.390 37.598 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.188 28.073 39.485 1.00 0.00 H new ATOM 0 HB3 LEU A 73 24.341 28.025 37.740 1.00 0.00 H new ATOM 0 HG LEU A 73 26.643 28.394 39.704 1.00 0.00 H new ATOM 0 HD11 LEU A 73 27.265 26.131 38.912 1.00 0.00 H new ATOM 0 HD12 LEU A 73 25.649 26.115 39.658 1.00 0.00 H new ATOM 0 HD13 LEU A 73 25.811 26.085 37.886 1.00 0.00 H new ATOM 0 HD21 LEU A 73 28.040 28.186 37.680 1.00 0.00 H new ATOM 0 HD22 LEU A 73 26.576 28.113 36.671 1.00 0.00 H new ATOM 0 HD23 LEU A 73 26.968 29.601 37.565 1.00 0.00 H new ATOM 1054 N ASP A 74 22.589 30.068 40.070 1.00 0.00 N ATOM 1055 CA ASP A 74 21.279 30.441 40.634 1.00 0.00 C ATOM 1056 C ASP A 74 20.829 31.893 40.381 1.00 0.00 C ATOM 1057 O ASP A 74 19.686 32.240 40.677 1.00 0.00 O ATOM 1058 CB ASP A 74 21.321 30.222 42.159 1.00 0.00 C ATOM 1059 CG ASP A 74 20.193 29.310 42.635 1.00 0.00 C ATOM 1060 OD1 ASP A 74 20.335 28.070 42.507 1.00 0.00 O ATOM 1061 OD2 ASP A 74 19.163 29.811 43.145 1.00 0.00 O ATOM 0 H ASP A 74 23.172 29.594 40.760 1.00 0.00 H new ATOM 0 HA ASP A 74 20.556 29.807 40.121 1.00 0.00 H new ATOM 0 HB2 ASP A 74 22.281 29.787 42.437 1.00 0.00 H new ATOM 0 HB3 ASP A 74 21.248 31.184 42.666 1.00 0.00 H new ATOM 1066 N LEU A 75 21.711 32.762 39.885 1.00 0.00 N ATOM 1067 CA LEU A 75 21.374 34.115 39.448 1.00 0.00 C ATOM 1068 C LEU A 75 20.642 34.115 38.087 1.00 0.00 C ATOM 1069 O LEU A 75 19.964 35.089 37.749 1.00 0.00 O ATOM 1070 CB LEU A 75 22.667 34.948 39.428 1.00 0.00 C ATOM 1071 CG LEU A 75 23.509 34.886 40.724 1.00 0.00 C ATOM 1072 CD1 LEU A 75 24.627 35.921 40.641 1.00 0.00 C ATOM 1073 CD2 LEU A 75 22.700 35.113 42.003 1.00 0.00 C ATOM 0 H LEU A 75 22.700 32.539 39.774 1.00 0.00 H new ATOM 0 HA LEU A 75 20.671 34.567 40.148 1.00 0.00 H new ATOM 0 HB2 LEU A 75 23.285 34.611 38.596 1.00 0.00 H new ATOM 0 HB3 LEU A 75 22.407 35.988 39.232 1.00 0.00 H new ATOM 0 HG LEU A 75 23.907 33.873 40.790 1.00 0.00 H new ATOM 0 HD11 LEU A 75 25.226 35.884 41.551 1.00 0.00 H new ATOM 0 HD12 LEU A 75 25.261 35.704 39.781 1.00 0.00 H new ATOM 0 HD13 LEU A 75 24.195 36.916 40.531 1.00 0.00 H new ATOM 0 HD21 LEU A 75 23.362 35.054 42.867 1.00 0.00 H new ATOM 0 HD22 LEU A 75 22.234 36.098 41.969 1.00 0.00 H new ATOM 0 HD23 LEU A 75 21.927 34.349 42.085 1.00 0.00 H new ATOM 1085 N ALA A 76 20.728 33.012 37.335 1.00 0.00 N ATOM 1086 CA ALA A 76 19.811 32.673 36.243 1.00 0.00 C ATOM 1087 C ALA A 76 18.519 32.004 36.755 1.00 0.00 C ATOM 1088 O ALA A 76 18.466 31.482 37.871 1.00 0.00 O ATOM 1089 CB ALA A 76 20.546 31.790 35.227 1.00 0.00 C ATOM 0 H ALA A 76 21.457 32.312 37.474 1.00 0.00 H new ATOM 0 HA ALA A 76 19.495 33.594 35.753 1.00 0.00 H new ATOM 0 HB1 ALA A 76 19.870 31.534 34.411 1.00 0.00 H new ATOM 0 HB2 ALA A 76 21.405 32.330 34.830 1.00 0.00 H new ATOM 0 HB3 ALA A 76 20.886 30.878 35.717 1.00 0.00 H new ATOM 1095 N TYR A 77 17.461 32.009 35.939 1.00 0.00 N ATOM 1096 CA TYR A 77 16.184 31.362 36.262 1.00 0.00 C ATOM 1097 C TYR A 77 16.192 29.870 35.925 1.00 0.00 C ATOM 1098 O TYR A 77 16.781 29.453 34.926 1.00 0.00 O ATOM 1099 CB TYR A 77 15.050 32.065 35.502 1.00 0.00 C ATOM 1100 CG TYR A 77 13.649 31.605 35.860 1.00 0.00 C ATOM 1101 CD1 TYR A 77 12.985 32.158 36.971 1.00 0.00 C ATOM 1102 CD2 TYR A 77 13.005 30.626 35.080 1.00 0.00 C ATOM 1103 CE1 TYR A 77 11.686 31.724 37.303 1.00 0.00 C ATOM 1104 CE2 TYR A 77 11.708 30.189 35.409 1.00 0.00 C ATOM 1105 CZ TYR A 77 11.046 30.733 36.529 1.00 0.00 C ATOM 1106 OH TYR A 77 9.789 30.330 36.844 1.00 0.00 O ATOM 0 H TYR A 77 17.466 32.466 35.027 1.00 0.00 H new ATOM 0 HA TYR A 77 16.027 31.450 37.337 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.121 33.137 35.686 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.203 31.914 34.433 1.00 0.00 H new ATOM 0 HD1 TYR A 77 13.471 32.915 37.569 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.510 30.207 34.222 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.178 32.152 38.154 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.221 29.438 34.805 1.00 0.00 H new ATOM 0 HH TYR A 77 9.497 29.643 36.209 1.00 0.00 H new ATOM 1116 N GLY A 78 15.443 29.080 36.697 1.00 0.00 N ATOM 1117 CA GLY A 78 14.957 27.788 36.217 1.00 0.00 C ATOM 1118 C GLY A 78 16.046 26.727 36.008 1.00 0.00 C ATOM 1119 O GLY A 78 16.000 25.962 35.044 1.00 0.00 O ATOM 0 H GLY A 78 15.162 29.311 37.650 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.227 27.403 36.929 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.433 27.941 35.274 1.00 0.00 H new ATOM 1123 N LEU A 79 17.044 26.714 36.893 1.00 0.00 N ATOM 1124 CA LEU A 79 18.287 25.948 36.779 1.00 0.00 C ATOM 1125 C LEU A 79 18.100 24.427 36.982 1.00 0.00 C ATOM 1126 O LEU A 79 17.298 23.974 37.801 1.00 0.00 O ATOM 1127 CB LEU A 79 19.340 26.683 37.625 1.00 0.00 C ATOM 1128 CG LEU A 79 20.754 26.086 37.587 1.00 0.00 C ATOM 1129 CD1 LEU A 79 21.770 27.159 37.937 1.00 0.00 C ATOM 1130 CD2 LEU A 79 20.900 24.997 38.626 1.00 0.00 C ATOM 0 H LEU A 79 17.006 27.264 37.751 1.00 0.00 H new ATOM 0 HA LEU A 79 18.670 25.925 35.759 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.393 27.718 37.288 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.000 26.701 38.661 1.00 0.00 H new ATOM 0 HG LEU A 79 20.919 25.687 36.586 1.00 0.00 H new ATOM 0 HD11 LEU A 79 22.773 26.733 37.909 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.702 27.974 37.216 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.566 27.541 38.937 1.00 0.00 H new ATOM 0 HD21 LEU A 79 21.909 24.586 38.583 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.719 25.413 39.617 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.177 24.205 38.427 1.00 0.00 H new ATOM 1142 N THR A 80 18.837 23.653 36.178 1.00 0.00 N ATOM 1143 CA THR A 80 18.557 22.268 35.753 1.00 0.00 C ATOM 1144 C THR A 80 19.383 21.188 36.462 1.00 0.00 C ATOM 1145 O THR A 80 20.406 21.480 37.087 1.00 0.00 O ATOM 1146 CB THR A 80 18.804 22.144 34.226 1.00 0.00 C ATOM 1147 OG1 THR A 80 19.286 23.346 33.653 1.00 0.00 O ATOM 1148 CG2 THR A 80 17.534 21.760 33.481 1.00 0.00 C ATOM 0 H THR A 80 19.708 23.998 35.776 1.00 0.00 H new ATOM 0 HA THR A 80 17.518 22.087 36.027 1.00 0.00 H new ATOM 0 HB THR A 80 19.558 21.364 34.122 1.00 0.00 H new ATOM 0 HG1 THR A 80 20.244 23.436 33.839 1.00 0.00 H new ATOM 0 HG21 THR A 80 17.747 21.683 32.415 1.00 0.00 H new ATOM 0 HG22 THR A 80 17.172 20.800 33.849 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.772 22.522 33.645 1.00 0.00 H new ATOM 1156 N GLU A 81 19.002 19.915 36.294 1.00 0.00 N ATOM 1157 CA GLU A 81 19.734 18.753 36.835 1.00 0.00 C ATOM 1158 C GLU A 81 21.190 18.664 36.342 1.00 0.00 C ATOM 1159 O GLU A 81 22.041 18.187 37.090 1.00 0.00 O ATOM 1160 CB GLU A 81 19.010 17.439 36.472 1.00 0.00 C ATOM 1161 CG GLU A 81 17.765 17.168 37.325 1.00 0.00 C ATOM 1162 CD GLU A 81 17.104 15.835 36.943 1.00 0.00 C ATOM 1163 OE1 GLU A 81 16.283 15.819 35.995 1.00 0.00 O ATOM 1164 OE2 GLU A 81 17.372 14.790 37.585 1.00 0.00 O ATOM 0 H GLU A 81 18.165 19.655 35.772 1.00 0.00 H new ATOM 0 HA GLU A 81 19.757 18.896 37.915 1.00 0.00 H new ATOM 0 HB2 GLU A 81 18.720 17.472 35.422 1.00 0.00 H new ATOM 0 HB3 GLU A 81 19.706 16.607 36.585 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.041 17.150 38.379 1.00 0.00 H new ATOM 0 HG3 GLU A 81 17.050 17.981 37.197 1.00 0.00 H new ATOM 1171 N THR A 82 21.500 19.152 35.132 1.00 0.00 N ATOM 1172 CA THR A 82 22.851 19.127 34.545 1.00 0.00 C ATOM 1173 C THR A 82 23.471 20.516 34.448 1.00 0.00 C ATOM 1174 O THR A 82 24.288 20.805 33.568 1.00 0.00 O ATOM 1175 CB THR A 82 22.933 18.405 33.203 1.00 0.00 C ATOM 1176 OG1 THR A 82 22.127 19.032 32.228 1.00 0.00 O ATOM 1177 CG2 THR A 82 22.502 16.945 33.232 1.00 0.00 C ATOM 0 H THR A 82 20.807 19.584 34.521 1.00 0.00 H new ATOM 0 HA THR A 82 23.441 18.539 35.248 1.00 0.00 H new ATOM 0 HB THR A 82 23.994 18.454 32.960 1.00 0.00 H new ATOM 0 HG1 THR A 82 22.635 19.127 31.395 1.00 0.00 H new ATOM 0 HG21 THR A 82 22.595 16.518 32.233 1.00 0.00 H new ATOM 0 HG22 THR A 82 23.137 16.392 33.924 1.00 0.00 H new ATOM 0 HG23 THR A 82 21.465 16.878 33.560 1.00 0.00 H new ATOM 1185 N SER A 83 23.073 21.437 35.323 1.00 0.00 N ATOM 1186 CA SER A 83 23.670 22.744 35.373 1.00 0.00 C ATOM 1187 C SER A 83 25.177 22.703 35.636 1.00 0.00 C ATOM 1188 O SER A 83 25.711 21.800 36.295 1.00 0.00 O ATOM 1189 CB SER A 83 22.976 23.540 36.466 1.00 0.00 C ATOM 1190 OG SER A 83 23.394 23.044 37.726 1.00 0.00 O ATOM 0 H SER A 83 22.332 21.287 36.008 1.00 0.00 H new ATOM 0 HA SER A 83 23.541 23.213 34.398 1.00 0.00 H new ATOM 0 HB2 SER A 83 23.222 24.598 36.376 1.00 0.00 H new ATOM 0 HB3 SER A 83 21.894 23.454 36.366 1.00 0.00 H new ATOM 0 HG SER A 83 22.648 22.577 38.157 1.00 0.00 H new ATOM 1196 N ARG A 84 25.883 23.700 35.116 1.00 0.00 N ATOM 1197 CA ARG A 84 27.338 23.791 35.120 1.00 0.00 C ATOM 1198 C ARG A 84 27.820 25.219 35.353 1.00 0.00 C ATOM 1199 O ARG A 84 27.055 26.174 35.273 1.00 0.00 O ATOM 1200 CB ARG A 84 27.877 23.151 33.820 1.00 0.00 C ATOM 1201 CG ARG A 84 28.049 21.620 33.858 1.00 0.00 C ATOM 1202 CD ARG A 84 29.144 21.008 34.762 1.00 0.00 C ATOM 1203 NE ARG A 84 29.061 21.373 36.184 1.00 0.00 N ATOM 1204 CZ ARG A 84 30.061 21.563 37.027 1.00 0.00 C ATOM 1205 NH1 ARG A 84 31.306 21.268 36.796 1.00 0.00 N ATOM 1206 NH2 ARG A 84 29.822 22.125 38.165 1.00 0.00 N ATOM 0 H ARG A 84 25.440 24.499 34.662 1.00 0.00 H new ATOM 0 HA ARG A 84 27.744 23.230 35.962 1.00 0.00 H new ATOM 0 HB2 ARG A 84 27.200 23.403 33.003 1.00 0.00 H new ATOM 0 HB3 ARG A 84 28.841 23.602 33.586 1.00 0.00 H new ATOM 0 HG2 ARG A 84 27.094 21.190 34.161 1.00 0.00 H new ATOM 0 HG3 ARG A 84 28.240 21.286 32.838 1.00 0.00 H new ATOM 0 HD2 ARG A 84 29.096 19.922 34.679 1.00 0.00 H new ATOM 0 HD3 ARG A 84 30.119 21.314 34.382 1.00 0.00 H new ATOM 0 HE ARG A 84 28.122 21.494 36.564 1.00 0.00 H new ATOM 0 HH11 ARG A 84 31.575 20.854 35.903 1.00 0.00 H new ATOM 0 HH12 ARG A 84 32.014 21.450 37.508 1.00 0.00 H new ATOM 0 HH21 ARG A 84 28.873 22.415 38.401 1.00 0.00 H new ATOM 0 HH22 ARG A 84 30.582 22.279 38.827 1.00 0.00 H new ATOM 1220 N LEU A 85 29.113 25.321 35.645 1.00 0.00 N ATOM 1221 CA LEU A 85 29.810 26.537 36.046 1.00 0.00 C ATOM 1222 C LEU A 85 31.009 26.770 35.126 1.00 0.00 C ATOM 1223 O LEU A 85 31.872 25.898 35.007 1.00 0.00 O ATOM 1224 CB LEU A 85 30.207 26.335 37.517 1.00 0.00 C ATOM 1225 CG LEU A 85 31.079 27.429 38.140 1.00 0.00 C ATOM 1226 CD1 LEU A 85 30.459 28.823 38.161 1.00 0.00 C ATOM 1227 CD2 LEU A 85 31.317 27.038 39.590 1.00 0.00 C ATOM 0 H LEU A 85 29.735 24.514 35.606 1.00 0.00 H new ATOM 0 HA LEU A 85 29.191 27.430 35.958 1.00 0.00 H new ATOM 0 HB2 LEU A 85 29.296 26.246 38.108 1.00 0.00 H new ATOM 0 HB3 LEU A 85 30.736 25.386 37.601 1.00 0.00 H new ATOM 0 HG LEU A 85 31.977 27.492 37.525 1.00 0.00 H new ATOM 0 HD11 LEU A 85 31.155 29.524 38.622 1.00 0.00 H new ATOM 0 HD12 LEU A 85 30.245 29.141 37.141 1.00 0.00 H new ATOM 0 HD13 LEU A 85 29.533 28.801 38.736 1.00 0.00 H new ATOM 0 HD21 LEU A 85 31.937 27.793 40.074 1.00 0.00 H new ATOM 0 HD22 LEU A 85 30.361 26.966 40.109 1.00 0.00 H new ATOM 0 HD23 LEU A 85 31.824 26.074 39.628 1.00 0.00 H new ATOM 1239 N GLY A 86 31.053 27.931 34.477 1.00 0.00 N ATOM 1240 CA GLY A 86 31.980 28.256 33.392 1.00 0.00 C ATOM 1241 C GLY A 86 33.474 28.256 33.745 1.00 0.00 C ATOM 1242 O GLY A 86 34.281 28.202 32.817 1.00 0.00 O ATOM 0 H GLY A 86 30.422 28.701 34.699 1.00 0.00 H new ATOM 0 HA2 GLY A 86 31.821 27.544 32.582 1.00 0.00 H new ATOM 0 HA3 GLY A 86 31.721 29.242 33.005 1.00 0.00 H new ATOM 1246 N CYS A 87 33.836 28.255 35.035 1.00 0.00 N ATOM 1247 CA CYS A 87 35.199 28.116 35.559 1.00 0.00 C ATOM 1248 C CYS A 87 35.565 26.720 36.100 1.00 0.00 C ATOM 1249 O CYS A 87 36.751 26.414 36.259 1.00 0.00 O ATOM 1250 CB CYS A 87 35.371 29.121 36.690 1.00 0.00 C ATOM 1251 SG CYS A 87 33.929 29.356 37.746 1.00 0.00 S ATOM 0 H CYS A 87 33.147 28.357 35.780 1.00 0.00 H new ATOM 0 HA CYS A 87 35.864 28.289 34.713 1.00 0.00 H new ATOM 0 HB2 CYS A 87 36.207 28.802 37.312 1.00 0.00 H new ATOM 0 HB3 CYS A 87 35.644 30.084 36.258 1.00 0.00 H new ATOM 1256 N GLN A 88 34.584 25.870 36.425 1.00 0.00 N ATOM 1257 CA GLN A 88 34.827 24.605 37.146 1.00 0.00 C ATOM 1258 C GLN A 88 34.937 23.380 36.223 1.00 0.00 C ATOM 1259 O GLN A 88 35.205 22.276 36.697 1.00 0.00 O ATOM 1260 CB GLN A 88 33.751 24.406 38.224 1.00 0.00 C ATOM 1261 CG GLN A 88 34.261 23.566 39.419 1.00 0.00 C ATOM 1262 CD GLN A 88 33.267 22.551 39.982 1.00 0.00 C ATOM 1263 OE1 GLN A 88 32.324 22.115 39.334 1.00 0.00 O ATOM 1264 NE2 GLN A 88 33.452 22.121 41.205 1.00 0.00 N ATOM 0 H GLN A 88 33.603 26.034 36.199 1.00 0.00 H new ATOM 0 HA GLN A 88 35.804 24.690 37.622 1.00 0.00 H new ATOM 0 HB2 GLN A 88 33.417 25.379 38.584 1.00 0.00 H new ATOM 0 HB3 GLN A 88 32.884 23.915 37.782 1.00 0.00 H new ATOM 0 HG2 GLN A 88 35.160 23.034 39.109 1.00 0.00 H new ATOM 0 HG3 GLN A 88 34.553 24.245 40.220 1.00 0.00 H new ATOM 0 HE21 GLN A 88 34.233 22.475 41.757 1.00 0.00 H new ATOM 0 HE22 GLN A 88 32.815 21.432 41.605 1.00 0.00 H new ATOM 1273 N ILE A 89 34.718 23.567 34.918 1.00 0.00 N ATOM 1274 CA ILE A 89 34.886 22.569 33.856 1.00 0.00 C ATOM 1275 C ILE A 89 35.679 23.183 32.691 1.00 0.00 C ATOM 1276 O ILE A 89 35.555 24.374 32.389 1.00 0.00 O ATOM 1277 CB ILE A 89 33.514 21.976 33.424 1.00 0.00 C ATOM 1278 CG1 ILE A 89 33.598 20.893 32.325 1.00 0.00 C ATOM 1279 CG2 ILE A 89 32.525 23.056 32.968 1.00 0.00 C ATOM 1280 CD1 ILE A 89 34.398 19.651 32.736 1.00 0.00 C ATOM 0 H ILE A 89 34.402 24.466 34.554 1.00 0.00 H new ATOM 0 HA ILE A 89 35.466 21.726 34.232 1.00 0.00 H new ATOM 0 HB ILE A 89 33.151 21.497 34.334 1.00 0.00 H new ATOM 0 HG12 ILE A 89 32.588 20.588 32.051 1.00 0.00 H new ATOM 0 HG13 ILE A 89 34.052 21.327 31.435 1.00 0.00 H new ATOM 0 HG21 ILE A 89 31.584 22.589 32.678 1.00 0.00 H new ATOM 0 HG22 ILE A 89 32.346 23.754 33.786 1.00 0.00 H new ATOM 0 HG23 ILE A 89 32.941 23.594 32.116 1.00 0.00 H new ATOM 0 HD11 ILE A 89 34.411 18.938 31.912 1.00 0.00 H new ATOM 0 HD12 ILE A 89 35.420 19.941 32.981 1.00 0.00 H new ATOM 0 HD13 ILE A 89 33.933 19.190 33.607 1.00 0.00 H new ATOM 1292 N LYS A 90 36.488 22.351 32.034 1.00 0.00 N ATOM 1293 CA LYS A 90 37.365 22.646 30.905 1.00 0.00 C ATOM 1294 C LYS A 90 37.418 21.462 29.940 1.00 0.00 C ATOM 1295 O LYS A 90 36.875 20.395 30.215 1.00 0.00 O ATOM 1296 CB LYS A 90 38.782 22.975 31.421 1.00 0.00 C ATOM 1297 CG LYS A 90 39.236 22.219 32.676 1.00 0.00 C ATOM 1298 CD LYS A 90 39.372 20.707 32.430 1.00 0.00 C ATOM 1299 CE LYS A 90 40.267 20.099 33.505 1.00 0.00 C ATOM 1300 NZ LYS A 90 40.491 18.647 33.314 1.00 0.00 N ATOM 0 H LYS A 90 36.550 21.369 32.303 1.00 0.00 H new ATOM 0 HA LYS A 90 36.968 23.507 30.368 1.00 0.00 H new ATOM 0 HB2 LYS A 90 39.494 22.771 30.621 1.00 0.00 H new ATOM 0 HB3 LYS A 90 38.832 24.044 31.628 1.00 0.00 H new ATOM 0 HG2 LYS A 90 40.193 22.618 33.011 1.00 0.00 H new ATOM 0 HG3 LYS A 90 38.520 22.391 33.480 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.390 20.234 32.448 1.00 0.00 H new ATOM 0 HD3 LYS A 90 39.795 20.524 31.442 1.00 0.00 H new ATOM 0 HE2 LYS A 90 41.228 20.613 33.504 1.00 0.00 H new ATOM 0 HE3 LYS A 90 39.817 20.267 34.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 41.105 18.288 34.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 39.579 18.148 33.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 40.946 18.484 32.393 1.00 0.00 H new ATOM 1314 N MET A 91 38.110 21.637 28.820 1.00 0.00 N ATOM 1315 CA MET A 91 38.335 20.563 27.843 1.00 0.00 C ATOM 1316 C MET A 91 39.347 19.506 28.355 1.00 0.00 C ATOM 1317 O MET A 91 40.414 19.859 28.852 1.00 0.00 O ATOM 1318 CB MET A 91 38.744 21.165 26.488 1.00 0.00 C ATOM 1319 CG MET A 91 37.935 22.376 25.996 1.00 0.00 C ATOM 1320 SD MET A 91 36.178 22.194 25.582 1.00 0.00 S ATOM 1321 CE MET A 91 35.359 21.917 27.166 1.00 0.00 C ATOM 0 H MET A 91 38.534 22.527 28.558 1.00 0.00 H new ATOM 0 HA MET A 91 37.398 20.024 27.703 1.00 0.00 H new ATOM 0 HB2 MET A 91 39.792 21.458 26.549 1.00 0.00 H new ATOM 0 HB3 MET A 91 38.676 20.381 25.733 1.00 0.00 H new ATOM 0 HG2 MET A 91 38.008 23.146 26.764 1.00 0.00 H new ATOM 0 HG3 MET A 91 38.438 22.761 25.109 1.00 0.00 H new ATOM 0 HE1 MET A 91 34.301 22.164 27.077 1.00 0.00 H new ATOM 0 HE2 MET A 91 35.465 20.871 27.452 1.00 0.00 H new ATOM 0 HE3 MET A 91 35.816 22.549 27.927 1.00 0.00 H new ATOM 1331 N SER A 92 39.037 18.215 28.200 1.00 0.00 N ATOM 1332 CA SER A 92 39.862 17.026 28.497 1.00 0.00 C ATOM 1333 C SER A 92 39.608 15.935 27.437 1.00 0.00 C ATOM 1334 O SER A 92 38.680 16.070 26.639 1.00 0.00 O ATOM 1335 CB SER A 92 39.523 16.483 29.897 1.00 0.00 C ATOM 1336 OG SER A 92 38.289 15.784 29.865 1.00 0.00 O ATOM 0 H SER A 92 38.125 17.945 27.832 1.00 0.00 H new ATOM 0 HA SER A 92 40.914 17.311 28.473 1.00 0.00 H new ATOM 0 HB2 SER A 92 40.317 15.819 30.240 1.00 0.00 H new ATOM 0 HB3 SER A 92 39.465 17.305 30.610 1.00 0.00 H new ATOM 0 HG SER A 92 38.084 15.441 30.760 1.00 0.00 H new ATOM 1342 N LYS A 93 40.342 14.815 27.419 1.00 0.00 N ATOM 1343 CA LYS A 93 40.062 13.696 26.486 1.00 0.00 C ATOM 1344 C LYS A 93 38.658 13.088 26.625 1.00 0.00 C ATOM 1345 O LYS A 93 38.163 12.455 25.691 1.00 0.00 O ATOM 1346 CB LYS A 93 41.133 12.599 26.650 1.00 0.00 C ATOM 1347 CG LYS A 93 42.478 12.948 25.993 1.00 0.00 C ATOM 1348 CD LYS A 93 42.428 12.853 24.462 1.00 0.00 C ATOM 1349 CE LYS A 93 43.801 13.195 23.885 1.00 0.00 C ATOM 1350 NZ LYS A 93 43.804 13.071 22.413 1.00 0.00 N ATOM 0 H LYS A 93 41.137 14.652 28.037 1.00 0.00 H new ATOM 0 HA LYS A 93 40.099 14.124 25.484 1.00 0.00 H new ATOM 0 HB2 LYS A 93 41.294 12.416 27.712 1.00 0.00 H new ATOM 0 HB3 LYS A 93 40.758 11.670 26.220 1.00 0.00 H new ATOM 0 HG2 LYS A 93 42.768 13.958 26.282 1.00 0.00 H new ATOM 0 HG3 LYS A 93 43.248 12.275 26.370 1.00 0.00 H new ATOM 0 HD2 LYS A 93 42.134 11.848 24.159 1.00 0.00 H new ATOM 0 HD3 LYS A 93 41.676 13.537 24.069 1.00 0.00 H new ATOM 0 HE2 LYS A 93 44.075 14.211 24.168 1.00 0.00 H new ATOM 0 HE3 LYS A 93 44.554 12.531 24.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 44.638 13.557 22.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 43.836 12.065 22.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 42.940 13.503 22.026 1.00 0.00 H new ATOM 1364 N ASP A 94 37.978 13.300 27.750 1.00 0.00 N ATOM 1365 CA ASP A 94 36.619 12.804 27.994 1.00 0.00 C ATOM 1366 C ASP A 94 35.527 13.664 27.328 1.00 0.00 C ATOM 1367 O ASP A 94 34.382 13.224 27.180 1.00 0.00 O ATOM 1368 CB ASP A 94 36.396 12.771 29.504 1.00 0.00 C ATOM 1369 CG ASP A 94 35.147 11.981 29.881 1.00 0.00 C ATOM 1370 OD1 ASP A 94 35.009 10.805 29.465 1.00 0.00 O ATOM 1371 OD2 ASP A 94 34.282 12.549 30.587 1.00 0.00 O ATOM 0 H ASP A 94 38.360 13.830 28.533 1.00 0.00 H new ATOM 0 HA ASP A 94 36.538 11.812 27.551 1.00 0.00 H new ATOM 0 HB2 ASP A 94 37.265 12.327 29.989 1.00 0.00 H new ATOM 0 HB3 ASP A 94 36.307 13.790 29.880 1.00 0.00 H new ATOM 1376 N ILE A 95 35.869 14.885 26.909 1.00 0.00 N ATOM 1377 CA ILE A 95 34.926 15.865 26.358 1.00 0.00 C ATOM 1378 C ILE A 95 34.725 15.743 24.857 1.00 0.00 C ATOM 1379 O ILE A 95 34.034 16.589 24.317 1.00 0.00 O ATOM 1380 CB ILE A 95 35.329 17.317 26.698 1.00 0.00 C ATOM 1381 CG1 ILE A 95 36.486 17.819 25.798 1.00 0.00 C ATOM 1382 CG2 ILE A 95 35.616 17.496 28.196 1.00 0.00 C ATOM 1383 CD1 ILE A 95 36.102 18.916 24.814 1.00 0.00 C ATOM 0 H ILE A 95 36.829 15.228 26.944 1.00 0.00 H new ATOM 0 HA ILE A 95 33.978 15.629 26.841 1.00 0.00 H new ATOM 0 HB ILE A 95 34.472 17.953 26.476 1.00 0.00 H new ATOM 0 HG12 ILE A 95 37.289 18.188 26.436 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.886 16.973 25.239 1.00 0.00 H new ATOM 0 HG21 ILE A 95 35.896 18.531 28.392 1.00 0.00 H new ATOM 0 HG22 ILE A 95 34.723 17.247 28.770 1.00 0.00 H new ATOM 0 HG23 ILE A 95 36.433 16.837 28.491 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.976 19.202 24.229 1.00 0.00 H new ATOM 0 HD12 ILE A 95 35.322 18.549 24.146 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.732 19.783 25.362 1.00 0.00 H new ATOM 1395 N ASP A 96 35.358 14.793 24.165 1.00 0.00 N ATOM 1396 CA ASP A 96 35.404 14.734 22.698 1.00 0.00 C ATOM 1397 C ASP A 96 33.993 14.682 22.074 1.00 0.00 C ATOM 1398 O ASP A 96 33.396 13.622 21.866 1.00 0.00 O ATOM 1399 CB ASP A 96 36.310 13.569 22.288 1.00 0.00 C ATOM 1400 CG ASP A 96 36.339 13.352 20.774 1.00 0.00 C ATOM 1401 OD1 ASP A 96 36.782 14.263 20.034 1.00 0.00 O ATOM 1402 OD2 ASP A 96 35.908 12.267 20.317 1.00 0.00 O ATOM 0 H ASP A 96 35.863 14.029 24.614 1.00 0.00 H new ATOM 0 HA ASP A 96 35.835 15.653 22.300 1.00 0.00 H new ATOM 0 HB2 ASP A 96 37.323 13.758 22.644 1.00 0.00 H new ATOM 0 HB3 ASP A 96 35.966 12.657 22.776 1.00 0.00 H new ATOM 1407 N GLY A 97 33.463 15.881 21.841 1.00 0.00 N ATOM 1408 CA GLY A 97 32.131 16.174 21.292 1.00 0.00 C ATOM 1409 C GLY A 97 31.167 16.971 22.195 1.00 0.00 C ATOM 1410 O GLY A 97 30.003 17.112 21.832 1.00 0.00 O ATOM 0 H GLY A 97 33.984 16.734 22.043 1.00 0.00 H new ATOM 0 HA2 GLY A 97 32.261 16.727 20.362 1.00 0.00 H new ATOM 0 HA3 GLY A 97 31.653 15.228 21.036 1.00 0.00 H new ATOM 1414 N ILE A 98 31.608 17.490 23.347 1.00 0.00 N ATOM 1415 CA ILE A 98 30.791 18.121 24.400 1.00 0.00 C ATOM 1416 C ILE A 98 29.890 19.270 23.931 1.00 0.00 C ATOM 1417 O ILE A 98 30.278 20.103 23.110 1.00 0.00 O ATOM 1418 CB ILE A 98 31.702 18.543 25.580 1.00 0.00 C ATOM 1419 CG1 ILE A 98 30.963 18.866 26.898 1.00 0.00 C ATOM 1420 CG2 ILE A 98 32.680 19.662 25.192 1.00 0.00 C ATOM 1421 CD1 ILE A 98 30.706 20.346 27.220 1.00 0.00 C ATOM 0 H ILE A 98 32.599 17.482 23.586 1.00 0.00 H new ATOM 0 HA ILE A 98 30.082 17.362 24.730 1.00 0.00 H new ATOM 0 HB ILE A 98 32.281 17.646 25.798 1.00 0.00 H new ATOM 0 HG12 ILE A 98 30.001 18.353 26.879 1.00 0.00 H new ATOM 0 HG13 ILE A 98 31.537 18.437 27.720 1.00 0.00 H new ATOM 0 HG21 ILE A 98 33.296 19.922 26.053 1.00 0.00 H new ATOM 0 HG22 ILE A 98 33.320 19.320 24.378 1.00 0.00 H new ATOM 0 HG23 ILE A 98 32.120 20.539 24.869 1.00 0.00 H new ATOM 0 HD11 ILE A 98 30.181 20.425 28.172 1.00 0.00 H new ATOM 0 HD12 ILE A 98 31.657 20.875 27.285 1.00 0.00 H new ATOM 0 HD13 ILE A 98 30.098 20.790 26.432 1.00 0.00 H new ATOM 1433 N ARG A 99 28.702 19.351 24.542 1.00 0.00 N ATOM 1434 CA ARG A 99 27.760 20.474 24.445 1.00 0.00 C ATOM 1435 C ARG A 99 27.515 21.110 25.793 1.00 0.00 C ATOM 1436 O ARG A 99 27.460 20.424 26.816 1.00 0.00 O ATOM 1437 CB ARG A 99 26.368 19.975 24.009 1.00 0.00 C ATOM 1438 CG ARG A 99 25.532 20.951 23.163 1.00 0.00 C ATOM 1439 CD ARG A 99 24.047 20.558 23.151 1.00 0.00 C ATOM 1440 NE ARG A 99 23.824 19.223 22.566 1.00 0.00 N ATOM 1441 CZ ARG A 99 23.087 18.254 23.075 1.00 0.00 C ATOM 1442 NH1 ARG A 99 22.282 18.415 24.082 1.00 0.00 N ATOM 1443 NH2 ARG A 99 23.151 17.061 22.577 1.00 0.00 N ATOM 0 H ARG A 99 28.355 18.604 25.144 1.00 0.00 H new ATOM 0 HA ARG A 99 28.204 21.173 23.737 1.00 0.00 H new ATOM 0 HB2 ARG A 99 26.496 19.053 23.442 1.00 0.00 H new ATOM 0 HB3 ARG A 99 25.799 19.722 24.904 1.00 0.00 H new ATOM 0 HG2 ARG A 99 25.639 21.961 23.559 1.00 0.00 H new ATOM 0 HG3 ARG A 99 25.913 20.967 22.142 1.00 0.00 H new ATOM 0 HD2 ARG A 99 23.661 20.574 24.170 1.00 0.00 H new ATOM 0 HD3 ARG A 99 23.482 21.299 22.585 1.00 0.00 H new ATOM 0 HE ARG A 99 24.286 19.029 21.678 1.00 0.00 H new ATOM 0 HH11 ARG A 99 22.194 19.330 24.524 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.738 17.626 24.431 1.00 0.00 H new ATOM 0 HH21 ARG A 99 23.772 16.869 21.790 1.00 0.00 H new ATOM 0 HH22 ARG A 99 22.581 16.313 22.971 1.00 0.00 H new ATOM 1457 N VAL A 100 27.161 22.378 25.725 1.00 0.00 N ATOM 1458 CA VAL A 100 26.397 23.071 26.743 1.00 0.00 C ATOM 1459 C VAL A 100 25.352 23.990 26.120 1.00 0.00 C ATOM 1460 O VAL A 100 25.528 24.480 25.005 1.00 0.00 O ATOM 1461 CB VAL A 100 27.348 23.892 27.657 1.00 0.00 C ATOM 1462 CG1 VAL A 100 28.162 23.018 28.624 1.00 0.00 C ATOM 1463 CG2 VAL A 100 28.345 24.753 26.856 1.00 0.00 C ATOM 0 H VAL A 100 27.405 22.974 24.934 1.00 0.00 H new ATOM 0 HA VAL A 100 25.877 22.323 27.342 1.00 0.00 H new ATOM 0 HB VAL A 100 26.676 24.534 28.227 1.00 0.00 H new ATOM 0 HG11 VAL A 100 28.806 23.652 29.233 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.483 22.462 29.271 1.00 0.00 H new ATOM 0 HG13 VAL A 100 28.775 22.319 28.055 1.00 0.00 H new ATOM 0 HG21 VAL A 100 28.984 25.305 27.545 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.960 24.108 26.228 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.797 25.455 26.228 1.00 0.00 H new ATOM 1473 N ALA A 101 24.287 24.286 26.857 1.00 0.00 N ATOM 1474 CA ALA A 101 23.489 25.473 26.597 1.00 0.00 C ATOM 1475 C ALA A 101 23.950 26.599 27.533 1.00 0.00 C ATOM 1476 O ALA A 101 24.161 26.378 28.727 1.00 0.00 O ATOM 1477 CB ALA A 101 22.009 25.123 26.714 1.00 0.00 C ATOM 0 H ALA A 101 23.958 23.719 27.639 1.00 0.00 H new ATOM 0 HA ALA A 101 23.631 25.840 25.581 1.00 0.00 H new ATOM 0 HB1 ALA A 101 21.408 26.012 26.519 1.00 0.00 H new ATOM 0 HB2 ALA A 101 21.759 24.350 25.987 1.00 0.00 H new ATOM 0 HB3 ALA A 101 21.800 24.757 27.719 1.00 0.00 H new ATOM 1483 N LEU A 102 24.171 27.791 26.975 1.00 0.00 N ATOM 1484 CA LEU A 102 24.689 28.950 27.703 1.00 0.00 C ATOM 1485 C LEU A 102 23.551 29.737 28.395 1.00 0.00 C ATOM 1486 O LEU A 102 23.692 30.055 29.576 1.00 0.00 O ATOM 1487 CB LEU A 102 25.582 29.740 26.727 1.00 0.00 C ATOM 1488 CG LEU A 102 26.755 30.502 27.368 1.00 0.00 C ATOM 1489 CD1 LEU A 102 27.748 30.878 26.262 1.00 0.00 C ATOM 1490 CD2 LEU A 102 26.312 31.769 28.097 1.00 0.00 C ATOM 0 H LEU A 102 23.992 27.981 25.989 1.00 0.00 H new ATOM 0 HA LEU A 102 25.318 28.667 28.547 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.983 29.047 25.987 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.959 30.454 26.189 1.00 0.00 H new ATOM 0 HG LEU A 102 27.211 29.849 28.112 1.00 0.00 H new ATOM 0 HD11 LEU A 102 28.588 31.420 26.696 1.00 0.00 H new ATOM 0 HD12 LEU A 102 28.112 29.972 25.777 1.00 0.00 H new ATOM 0 HD13 LEU A 102 27.251 31.509 25.526 1.00 0.00 H new ATOM 0 HD21 LEU A 102 27.182 32.264 28.528 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.824 32.442 27.392 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.613 31.506 28.891 1.00 0.00 H new ATOM 1502 N PRO A 103 22.381 29.962 27.757 1.00 0.00 N ATOM 1503 CA PRO A 103 21.133 30.168 28.485 1.00 0.00 C ATOM 1504 C PRO A 103 20.513 28.824 28.911 1.00 0.00 C ATOM 1505 O PRO A 103 20.660 27.799 28.239 1.00 0.00 O ATOM 1506 CB PRO A 103 20.226 30.918 27.508 1.00 0.00 C ATOM 1507 CG PRO A 103 20.618 30.300 26.166 1.00 0.00 C ATOM 1508 CD PRO A 103 22.116 30.017 26.321 1.00 0.00 C ATOM 0 HA PRO A 103 21.283 30.729 29.407 1.00 0.00 H new ATOM 0 HB2 PRO A 103 19.170 30.766 27.734 1.00 0.00 H new ATOM 0 HB3 PRO A 103 20.405 31.993 27.529 1.00 0.00 H new ATOM 0 HG2 PRO A 103 20.057 29.387 25.966 1.00 0.00 H new ATOM 0 HG3 PRO A 103 20.423 30.982 25.339 1.00 0.00 H new ATOM 0 HD2 PRO A 103 22.385 29.076 25.841 1.00 0.00 H new ATOM 0 HD3 PRO A 103 22.710 30.798 25.847 1.00 0.00 H new ATOM 1516 N GLN A 104 19.732 28.855 29.988 1.00 0.00 N ATOM 1517 CA GLN A 104 18.800 27.795 30.395 1.00 0.00 C ATOM 1518 C GLN A 104 17.350 28.280 30.224 1.00 0.00 C ATOM 1519 O GLN A 104 16.544 27.623 29.563 1.00 0.00 O ATOM 1520 CB GLN A 104 19.158 27.360 31.830 1.00 0.00 C ATOM 1521 CG GLN A 104 18.067 26.603 32.605 1.00 0.00 C ATOM 1522 CD GLN A 104 17.531 25.330 31.953 1.00 0.00 C ATOM 1523 OE1 GLN A 104 18.097 24.747 31.035 1.00 0.00 O ATOM 1524 NE2 GLN A 104 16.423 24.833 32.447 1.00 0.00 N ATOM 0 H GLN A 104 19.727 29.648 30.629 1.00 0.00 H new ATOM 0 HA GLN A 104 18.889 26.913 29.761 1.00 0.00 H new ATOM 0 HB2 GLN A 104 20.046 26.729 31.785 1.00 0.00 H new ATOM 0 HB3 GLN A 104 19.428 28.249 32.400 1.00 0.00 H new ATOM 0 HG2 GLN A 104 18.463 26.343 33.587 1.00 0.00 H new ATOM 0 HG3 GLN A 104 17.230 27.282 32.768 1.00 0.00 H new ATOM 0 HE21 GLN A 104 15.946 25.311 33.211 1.00 0.00 H new ATOM 0 HE22 GLN A 104 16.038 23.968 32.068 1.00 0.00 H new ATOM 1533 N MET A 105 17.030 29.461 30.753 1.00 0.00 N ATOM 1534 CA MET A 105 15.733 30.135 30.609 1.00 0.00 C ATOM 1535 C MET A 105 15.955 31.656 30.663 1.00 0.00 C ATOM 1536 O MET A 105 16.715 32.138 31.509 1.00 0.00 O ATOM 1537 CB MET A 105 14.793 29.632 31.718 1.00 0.00 C ATOM 1538 CG MET A 105 13.306 29.801 31.387 1.00 0.00 C ATOM 1539 SD MET A 105 12.647 31.487 31.456 1.00 0.00 S ATOM 1540 CE MET A 105 10.995 31.164 30.784 1.00 0.00 C ATOM 0 H MET A 105 17.690 29.998 31.316 1.00 0.00 H new ATOM 0 HA MET A 105 15.266 29.907 29.651 1.00 0.00 H new ATOM 0 HB2 MET A 105 14.997 28.578 31.905 1.00 0.00 H new ATOM 0 HB3 MET A 105 15.014 30.168 32.641 1.00 0.00 H new ATOM 0 HG2 MET A 105 13.133 29.408 30.385 1.00 0.00 H new ATOM 0 HG3 MET A 105 12.731 29.182 32.076 1.00 0.00 H new ATOM 0 HE1 MET A 105 10.429 32.095 30.747 1.00 0.00 H new ATOM 0 HE2 MET A 105 11.085 30.754 29.778 1.00 0.00 H new ATOM 0 HE3 MET A 105 10.476 30.449 31.422 1.00 0.00 H new ATOM 1550 N THR A 106 15.378 32.412 29.728 1.00 0.00 N ATOM 1551 CA THR A 106 15.740 33.828 29.513 1.00 0.00 C ATOM 1552 C THR A 106 15.221 34.769 30.610 1.00 0.00 C ATOM 1553 O THR A 106 14.261 34.453 31.318 1.00 0.00 O ATOM 1554 CB THR A 106 15.353 34.311 28.103 1.00 0.00 C ATOM 1555 OG1 THR A 106 14.005 34.017 27.812 1.00 0.00 O ATOM 1556 CG2 THR A 106 16.194 33.628 27.025 1.00 0.00 C ATOM 0 H THR A 106 14.651 32.071 29.099 1.00 0.00 H new ATOM 0 HA THR A 106 16.827 33.870 29.586 1.00 0.00 H new ATOM 0 HB THR A 106 15.525 35.387 28.099 1.00 0.00 H new ATOM 0 HG1 THR A 106 13.787 34.337 26.911 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.893 33.993 26.043 1.00 0.00 H new ATOM 0 HG22 THR A 106 17.248 33.853 27.189 1.00 0.00 H new ATOM 0 HG23 THR A 106 16.042 32.550 27.073 1.00 0.00 H new ATOM 1564 N ARG A 107 15.821 35.962 30.736 1.00 0.00 N ATOM 1565 CA ARG A 107 15.626 36.944 31.828 1.00 0.00 C ATOM 1566 C ARG A 107 16.050 36.424 33.217 1.00 0.00 C ATOM 1567 O ARG A 107 15.231 35.965 34.021 1.00 0.00 O ATOM 1568 CB ARG A 107 14.222 37.589 31.805 1.00 0.00 C ATOM 1569 CG ARG A 107 13.875 38.299 30.483 1.00 0.00 C ATOM 1570 CD ARG A 107 13.177 37.417 29.431 1.00 0.00 C ATOM 1571 NE ARG A 107 11.729 37.290 29.679 1.00 0.00 N ATOM 1572 CZ ARG A 107 11.063 36.301 30.246 1.00 0.00 C ATOM 1573 NH1 ARG A 107 11.606 35.217 30.710 1.00 0.00 N ATOM 1574 NH2 ARG A 107 9.775 36.375 30.375 1.00 0.00 N ATOM 0 H ARG A 107 16.494 36.291 30.044 1.00 0.00 H new ATOM 0 HA ARG A 107 16.325 37.755 31.621 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.477 36.817 31.996 1.00 0.00 H new ATOM 0 HB3 ARG A 107 14.152 38.309 32.620 1.00 0.00 H new ATOM 0 HG2 ARG A 107 13.232 39.151 30.704 1.00 0.00 H new ATOM 0 HG3 ARG A 107 14.793 38.696 30.050 1.00 0.00 H new ATOM 0 HD2 ARG A 107 13.338 37.841 28.440 1.00 0.00 H new ATOM 0 HD3 ARG A 107 13.632 36.426 29.431 1.00 0.00 H new ATOM 0 HE ARG A 107 11.161 38.078 29.368 1.00 0.00 H new ATOM 0 HH11 ARG A 107 12.616 35.086 30.649 1.00 0.00 H new ATOM 0 HH12 ARG A 107 11.023 34.496 31.135 1.00 0.00 H new ATOM 0 HH21 ARG A 107 9.275 37.198 30.038 1.00 0.00 H new ATOM 0 HH22 ARG A 107 9.262 35.610 30.813 1.00 0.00 H new ATOM 1588 N ASN A 108 17.352 36.533 33.491 1.00 0.00 N ATOM 1589 CA ASN A 108 18.012 36.259 34.775 1.00 0.00 C ATOM 1590 C ASN A 108 17.345 36.981 35.961 1.00 0.00 C ATOM 1591 O ASN A 108 16.750 38.049 35.806 1.00 0.00 O ATOM 1592 CB ASN A 108 19.498 36.683 34.681 1.00 0.00 C ATOM 1593 CG ASN A 108 20.401 35.709 33.945 1.00 0.00 C ATOM 1594 OD1 ASN A 108 19.996 34.646 33.505 1.00 0.00 O ATOM 1595 ND2 ASN A 108 21.666 36.028 33.805 1.00 0.00 N ATOM 0 H ASN A 108 18.018 36.834 32.779 1.00 0.00 H new ATOM 0 HA ASN A 108 17.923 35.189 34.964 1.00 0.00 H new ATOM 0 HB2 ASN A 108 19.553 37.651 34.184 1.00 0.00 H new ATOM 0 HB3 ASN A 108 19.885 36.821 35.691 1.00 0.00 H new ATOM 0 HD21 ASN A 108 22.304 35.389 33.331 1.00 0.00 H new ATOM 0 HD22 ASN A 108 22.012 36.915 34.170 1.00 0.00 H new ATOM 1602 N VAL A 109 17.507 36.423 37.164 1.00 0.00 N ATOM 1603 CA VAL A 109 17.025 37.001 38.433 1.00 0.00 C ATOM 1604 C VAL A 109 17.805 38.278 38.774 1.00 0.00 C ATOM 1605 O VAL A 109 17.228 39.263 39.238 1.00 0.00 O ATOM 1606 CB VAL A 109 17.159 35.966 39.577 1.00 0.00 C ATOM 1607 CG1 VAL A 109 16.553 36.473 40.892 1.00 0.00 C ATOM 1608 CG2 VAL A 109 16.479 34.629 39.239 1.00 0.00 C ATOM 0 H VAL A 109 17.989 35.533 37.291 1.00 0.00 H new ATOM 0 HA VAL A 109 15.973 37.261 38.318 1.00 0.00 H new ATOM 0 HB VAL A 109 18.232 35.816 39.695 1.00 0.00 H new ATOM 0 HG11 VAL A 109 16.671 35.713 41.664 1.00 0.00 H new ATOM 0 HG12 VAL A 109 17.064 37.385 41.200 1.00 0.00 H new ATOM 0 HG13 VAL A 109 15.493 36.682 40.748 1.00 0.00 H new ATOM 0 HG21 VAL A 109 16.601 33.938 40.073 1.00 0.00 H new ATOM 0 HG22 VAL A 109 15.417 34.796 39.059 1.00 0.00 H new ATOM 0 HG23 VAL A 109 16.936 34.204 38.345 1.00 0.00 H new ATOM 1618 N ASN A 110 19.112 38.274 38.495 1.00 0.00 N ATOM 1619 CA ASN A 110 20.046 39.379 38.728 1.00 0.00 C ATOM 1620 C ASN A 110 20.310 40.211 37.446 1.00 0.00 C ATOM 1621 O ASN A 110 20.192 39.699 36.326 1.00 0.00 O ATOM 1622 CB ASN A 110 21.327 38.759 39.319 1.00 0.00 C ATOM 1623 CG ASN A 110 22.334 39.808 39.740 1.00 0.00 C ATOM 1624 OD1 ASN A 110 23.155 40.237 38.947 1.00 0.00 O ATOM 1625 ND2 ASN A 110 22.271 40.287 40.956 1.00 0.00 N ATOM 0 H ASN A 110 19.569 37.461 38.081 1.00 0.00 H new ATOM 0 HA ASN A 110 19.623 40.100 39.428 1.00 0.00 H new ATOM 0 HB2 ASN A 110 21.066 38.144 40.180 1.00 0.00 H new ATOM 0 HB3 ASN A 110 21.782 38.098 38.581 1.00 0.00 H new ATOM 0 HD21 ASN A 110 22.912 41.025 41.247 1.00 0.00 H new ATOM 0 HD22 ASN A 110 21.581 39.922 41.613 1.00 0.00 H new ATOM 1632 N ASN A 111 20.710 41.478 37.602 1.00 0.00 N ATOM 1633 CA ASN A 111 21.208 42.356 36.530 1.00 0.00 C ATOM 1634 C ASN A 111 22.465 43.142 36.972 1.00 0.00 C ATOM 1635 O ASN A 111 22.698 43.314 38.171 1.00 0.00 O ATOM 1636 CB ASN A 111 20.077 43.292 36.056 1.00 0.00 C ATOM 1637 CG ASN A 111 19.708 44.346 37.085 1.00 0.00 C ATOM 1638 OD1 ASN A 111 20.238 45.449 37.093 1.00 0.00 O ATOM 1639 ND2 ASN A 111 18.829 44.029 38.005 1.00 0.00 N ATOM 0 H ASN A 111 20.696 41.940 38.511 1.00 0.00 H new ATOM 0 HA ASN A 111 21.517 41.737 35.687 1.00 0.00 H new ATOM 0 HB2 ASN A 111 20.384 43.785 35.133 1.00 0.00 H new ATOM 0 HB3 ASN A 111 19.195 42.697 35.821 1.00 0.00 H new ATOM 0 HD21 ASN A 111 18.585 44.703 38.731 1.00 0.00 H new ATOM 0 HD22 ASN A 111 18.389 43.109 37.995 1.00 0.00 H new ATOM 1646 N ASN A 112 23.252 43.645 36.013 1.00 0.00 N ATOM 1647 CA ASN A 112 24.519 44.368 36.216 1.00 0.00 C ATOM 1648 C ASN A 112 25.508 43.620 37.151 1.00 0.00 C ATOM 1649 O ASN A 112 25.643 42.396 37.063 1.00 0.00 O ATOM 1650 CB ASN A 112 24.219 45.843 36.580 1.00 0.00 C ATOM 1651 CG ASN A 112 23.565 46.608 35.440 1.00 0.00 C ATOM 1652 OD1 ASN A 112 24.228 47.091 34.527 1.00 0.00 O ATOM 1653 ND2 ASN A 112 22.260 46.736 35.437 1.00 0.00 N ATOM 0 H ASN A 112 23.013 43.556 35.025 1.00 0.00 H new ATOM 0 HA ASN A 112 25.077 44.395 35.280 1.00 0.00 H new ATOM 0 HB2 ASN A 112 23.567 45.872 37.453 1.00 0.00 H new ATOM 0 HB3 ASN A 112 25.148 46.340 36.860 1.00 0.00 H new ATOM 0 HD21 ASN A 112 21.798 47.236 34.677 1.00 0.00 H new ATOM 0 HD22 ASN A 112 21.707 46.336 36.194 1.00 0.00 H new ATOM 1660 N ASP A 113 26.244 44.347 37.999 1.00 0.00 N ATOM 1661 CA ASP A 113 27.311 43.867 38.888 1.00 0.00 C ATOM 1662 C ASP A 113 26.903 43.886 40.376 1.00 0.00 C ATOM 1663 O ASP A 113 25.822 44.364 40.724 1.00 0.00 O ATOM 1664 CB ASP A 113 28.566 44.720 38.632 1.00 0.00 C ATOM 1665 CG ASP A 113 28.427 46.166 39.124 1.00 0.00 C ATOM 1666 OD1 ASP A 113 27.456 46.862 38.749 1.00 0.00 O ATOM 1667 OD2 ASP A 113 29.308 46.613 39.891 1.00 0.00 O ATOM 0 H ASP A 113 26.102 45.353 38.089 1.00 0.00 H new ATOM 0 HA ASP A 113 27.516 42.821 38.662 1.00 0.00 H new ATOM 0 HB2 ASP A 113 29.419 44.256 39.126 1.00 0.00 H new ATOM 0 HB3 ASP A 113 28.781 44.726 37.563 1.00 0.00 H new ATOM 1672 N PHE A 114 27.756 43.384 41.276 1.00 0.00 N ATOM 1673 CA PHE A 114 27.472 43.290 42.725 1.00 0.00 C ATOM 1674 C PHE A 114 27.981 44.499 43.543 1.00 0.00 C ATOM 1675 O PHE A 114 28.114 44.416 44.773 1.00 0.00 O ATOM 1676 CB PHE A 114 27.969 41.942 43.283 1.00 0.00 C ATOM 1677 CG PHE A 114 27.634 40.705 42.463 1.00 0.00 C ATOM 1678 CD1 PHE A 114 26.411 40.590 41.768 1.00 0.00 C ATOM 1679 CD2 PHE A 114 28.569 39.654 42.389 1.00 0.00 C ATOM 1680 CE1 PHE A 114 26.156 39.467 40.961 1.00 0.00 C ATOM 1681 CE2 PHE A 114 28.307 38.528 41.592 1.00 0.00 C ATOM 1682 CZ PHE A 114 27.109 38.440 40.864 1.00 0.00 C ATOM 0 H PHE A 114 28.676 43.025 41.022 1.00 0.00 H new ATOM 0 HA PHE A 114 26.389 43.327 42.838 1.00 0.00 H new ATOM 0 HB2 PHE A 114 29.052 41.996 43.392 1.00 0.00 H new ATOM 0 HB3 PHE A 114 27.554 41.812 44.282 1.00 0.00 H new ATOM 0 HD1 PHE A 114 25.667 41.368 41.856 1.00 0.00 H new ATOM 0 HD2 PHE A 114 29.491 39.715 42.948 1.00 0.00 H new ATOM 0 HE1 PHE A 114 25.227 39.394 40.415 1.00 0.00 H new ATOM 0 HE2 PHE A 114 29.029 37.727 41.539 1.00 0.00 H new ATOM 0 HZ PHE A 114 26.921 37.585 40.231 1.00 0.00 H new ATOM 1692 N SER A 115 28.273 45.613 42.862 1.00 0.00 N ATOM 1693 CA SER A 115 28.729 46.896 43.425 1.00 0.00 C ATOM 1694 C SER A 115 27.926 48.070 42.855 1.00 0.00 C ATOM 1695 O SER A 115 26.727 47.885 42.536 1.00 0.00 O ATOM 1696 CB SER A 115 30.232 47.066 43.170 1.00 0.00 C ATOM 1697 OG SER A 115 30.952 45.932 43.615 1.00 0.00 O ATOM 1698 OXT SER A 115 28.466 49.195 42.766 1.00 0.00 O ATOM 0 H SER A 115 28.194 45.649 41.846 1.00 0.00 H new ATOM 0 HA SER A 115 28.558 46.889 44.501 1.00 0.00 H new ATOM 0 HB2 SER A 115 30.409 47.219 42.105 1.00 0.00 H new ATOM 0 HB3 SER A 115 30.594 47.956 43.685 1.00 0.00 H new ATOM 0 HG SER A 115 31.908 46.062 43.441 1.00 0.00 H new TER 1704 SER A 115 HETATM 1705 FE1 FES A 201 33.793 33.515 37.644 1.00 0.00 FE HETATM 1706 FE2 FES A 201 33.019 31.287 36.920 1.00 0.00 FE HETATM 1707 S1 FES A 201 32.030 32.501 38.438 1.00 0.00 S HETATM 1708 S2 FES A 201 34.704 32.371 36.030 1.00 0.00 S