USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 743 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 23 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 44 GLN : amide:sc= 0.0373 K(o=-3.6,f=-7) USER MOD Set 2.2: A 48 HIS : no HD1:sc= -3.63! C(o=-3.6!,f=-8.5!) USER MOD Set 3.1: A 35 HIS : no HD1:sc= -1.76! C(o=-1.9!,f=-7.7!) USER MOD Set 3.2: A 36 ASN : amide:sc= -0.108 K(o=-1.9,f=-3.9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 159:sc= -0.157 (180deg=-0.89) USER MOD Single : A 5 THR OG1 : rot -36:sc= -1.23! USER MOD Single : A 10 LYS NZ :NH3+ 152:sc= -0.506 (180deg=-1.15) USER MOD Single : A 14 SER OG : rot -124:sc= 0.903 USER MOD Single : A 18 LYS NZ :NH3+ -160:sc= -0.0853 (180deg=-0.669) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -164:sc= -0.0145 (180deg=-0.273) USER MOD Single : A 30 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0289) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot -50:sc= 0.054 USER MOD Single : A 38 ASN : amide:sc= -0.0263 K(o=-0.026,f=-1.3!) USER MOD Single : A 47 MET CE :methyl 175:sc= 0 (180deg=-0.0448) USER MOD Single : A 51 MET CE :methyl 153:sc= -0.217 (180deg=-1.24) USER MOD Single : A 60 SER OG : rot -28:sc= 0.085 USER MOD Single : A 61 GLN : amide:sc= -1.46 K(o=-1.5,f=-6.4!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -3.79! C(o=-3.8!,f=-6.2!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.00549 USER MOD Single : A 76 GLN : amide:sc= -4.16! C(o=-4.2!,f=-6.9!) USER MOD Single : A 79 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.144) USER MOD Single : A 85 HIS : no HD1:sc= -0.0183 X(o=-0.018,f=-0.065) USER MOD Single : A 86 HIS : no HE2:sc= -1.04 K(o=-1,f=-2.4!) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 90 HIS : no HE2:sc= -0.362 K(o=-0.36,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.308 -16.912 19.389 1.00 0.00 N ATOM 2 CA MET A 1 -8.468 -16.348 18.018 1.00 0.00 C ATOM 3 C MET A 1 -7.330 -15.372 17.739 1.00 0.00 C ATOM 4 O MET A 1 -6.741 -14.810 18.661 1.00 0.00 O ATOM 5 CB MET A 1 -9.813 -15.622 17.918 1.00 0.00 C ATOM 6 CG MET A 1 -10.035 -14.783 19.178 1.00 0.00 C ATOM 7 SD MET A 1 -11.584 -13.858 19.021 1.00 0.00 S ATOM 8 CE MET A 1 -11.508 -13.018 20.622 1.00 0.00 C ATOM 0 H1 MET A 1 -9.222 -17.280 19.722 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.611 -17.684 19.368 1.00 0.00 H new ATOM 0 H3 MET A 1 -7.979 -16.166 20.035 1.00 0.00 H new ATOM 0 HA MET A 1 -8.441 -17.153 17.284 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.829 -14.983 17.035 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.621 -16.345 17.802 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.071 -15.428 20.056 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.201 -14.096 19.322 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.384 -12.380 20.740 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.488 -13.759 21.421 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.606 -12.408 20.670 1.00 0.00 H new ATOM 20 N GLY A 2 -7.029 -15.176 16.459 1.00 0.00 N ATOM 21 CA GLY A 2 -5.961 -14.263 16.067 1.00 0.00 C ATOM 22 C GLY A 2 -4.597 -14.926 16.216 1.00 0.00 C ATOM 23 O GLY A 2 -3.564 -14.300 15.981 1.00 0.00 O ATOM 0 H GLY A 2 -7.505 -15.633 15.681 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.106 -13.949 15.033 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.002 -13.364 16.682 1.00 0.00 H new ATOM 27 N VAL A 3 -4.601 -16.197 16.612 1.00 0.00 N ATOM 28 CA VAL A 3 -3.356 -16.940 16.794 1.00 0.00 C ATOM 29 C VAL A 3 -2.297 -16.065 17.452 1.00 0.00 C ATOM 30 O VAL A 3 -1.430 -15.510 16.779 1.00 0.00 O ATOM 31 CB VAL A 3 -2.843 -17.435 15.442 1.00 0.00 C ATOM 32 CG1 VAL A 3 -1.785 -18.519 15.660 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.008 -18.016 14.639 1.00 0.00 C ATOM 0 H VAL A 3 -5.447 -16.731 16.812 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.557 -17.793 17.442 1.00 0.00 H new ATOM 0 HB VAL A 3 -2.401 -16.602 14.895 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -1.420 -18.871 14.695 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -0.955 -18.107 16.233 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -2.225 -19.352 16.207 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.644 -18.370 13.674 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.449 -18.848 15.188 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.762 -17.245 14.482 1.00 0.00 H new ATOM 43 N TRP A 4 -2.379 -15.942 18.776 1.00 0.00 N ATOM 44 CA TRP A 4 -1.428 -15.126 19.531 1.00 0.00 C ATOM 45 C TRP A 4 -0.771 -15.944 20.636 1.00 0.00 C ATOM 46 O TRP A 4 -1.428 -16.376 21.585 1.00 0.00 O ATOM 47 CB TRP A 4 -2.152 -13.923 20.141 1.00 0.00 C ATOM 48 CG TRP A 4 -2.485 -12.944 19.059 1.00 0.00 C ATOM 49 CD1 TRP A 4 -3.647 -12.912 18.367 1.00 0.00 C ATOM 50 CD2 TRP A 4 -1.667 -11.858 18.536 1.00 0.00 C ATOM 51 NE1 TRP A 4 -3.593 -11.877 17.450 1.00 0.00 N ATOM 52 CE2 TRP A 4 -2.392 -11.199 17.515 1.00 0.00 C ATOM 53 CE3 TRP A 4 -0.378 -11.389 18.843 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -1.857 -10.109 16.826 1.00 0.00 C ATOM 55 CZ3 TRP A 4 0.163 -10.293 18.153 1.00 0.00 C ATOM 56 CH2 TRP A 4 -0.573 -9.655 17.145 1.00 0.00 C ATOM 0 H TRP A 4 -3.092 -16.396 19.347 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.652 -14.779 18.849 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -3.062 -14.249 20.645 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -1.523 -13.449 20.895 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -4.481 -13.584 18.507 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -4.348 -11.644 16.805 1.00 0.00 H new ATOM 0 HE3 TRP A 4 0.200 -11.875 19.615 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -2.430 -9.620 16.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 1.153 -9.939 18.400 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -0.149 -8.814 16.616 1.00 0.00 H new ATOM 67 N THR A 5 0.534 -16.135 20.509 1.00 0.00 N ATOM 68 CA THR A 5 1.297 -16.881 21.496 1.00 0.00 C ATOM 69 C THR A 5 2.790 -16.587 21.342 1.00 0.00 C ATOM 70 O THR A 5 3.621 -17.495 21.403 1.00 0.00 O ATOM 71 CB THR A 5 1.037 -18.386 21.335 1.00 0.00 C ATOM 72 OG1 THR A 5 -0.342 -18.600 21.068 1.00 0.00 O ATOM 73 CG2 THR A 5 1.425 -19.121 22.621 1.00 0.00 C ATOM 0 H THR A 5 1.087 -15.782 19.728 1.00 0.00 H new ATOM 0 HA THR A 5 0.980 -16.572 22.492 1.00 0.00 H new ATOM 0 HB THR A 5 1.636 -18.768 20.508 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.877 -17.950 21.570 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.238 -20.188 22.501 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.483 -18.959 22.828 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.830 -18.740 23.451 1.00 0.00 H new ATOM 81 N PRO A 6 3.143 -15.339 21.150 1.00 0.00 N ATOM 82 CA PRO A 6 4.570 -14.913 20.995 1.00 0.00 C ATOM 83 C PRO A 6 5.363 -15.102 22.290 1.00 0.00 C ATOM 84 O PRO A 6 4.822 -15.547 23.299 1.00 0.00 O ATOM 85 CB PRO A 6 4.462 -13.424 20.628 1.00 0.00 C ATOM 86 CG PRO A 6 3.159 -12.991 21.213 1.00 0.00 C ATOM 87 CD PRO A 6 2.228 -14.184 21.056 1.00 0.00 C ATOM 0 HA PRO A 6 5.101 -15.502 20.247 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.293 -12.852 21.041 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.481 -13.279 19.548 1.00 0.00 H new ATOM 0 HG2 PRO A 6 3.271 -12.716 22.262 1.00 0.00 H new ATOM 0 HG3 PRO A 6 2.767 -12.116 20.694 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.468 -14.207 21.837 1.00 0.00 H new ATOM 0 HD3 PRO A 6 1.703 -14.163 20.101 1.00 0.00 H new ATOM 95 N GLU A 7 6.642 -14.754 22.247 1.00 0.00 N ATOM 96 CA GLU A 7 7.503 -14.878 23.417 1.00 0.00 C ATOM 97 C GLU A 7 6.936 -14.081 24.591 1.00 0.00 C ATOM 98 O GLU A 7 7.332 -14.284 25.739 1.00 0.00 O ATOM 99 CB GLU A 7 8.912 -14.387 23.085 1.00 0.00 C ATOM 100 CG GLU A 7 8.858 -12.924 22.645 1.00 0.00 C ATOM 101 CD GLU A 7 10.254 -12.447 22.264 1.00 0.00 C ATOM 102 OE1 GLU A 7 11.195 -13.189 22.495 1.00 0.00 O ATOM 103 OE2 GLU A 7 10.365 -11.348 21.746 1.00 0.00 O ATOM 0 H GLU A 7 7.106 -14.384 21.417 1.00 0.00 H new ATOM 0 HA GLU A 7 7.548 -15.929 23.702 1.00 0.00 H new ATOM 0 HB2 GLU A 7 9.558 -14.491 23.956 1.00 0.00 H new ATOM 0 HB3 GLU A 7 9.344 -14.999 22.293 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.182 -12.815 21.797 1.00 0.00 H new ATOM 0 HG3 GLU A 7 8.460 -12.307 23.451 1.00 0.00 H new ATOM 110 N VAL A 8 6.012 -13.169 24.295 1.00 0.00 N ATOM 111 CA VAL A 8 5.404 -12.339 25.334 1.00 0.00 C ATOM 112 C VAL A 8 5.068 -13.183 26.559 1.00 0.00 C ATOM 113 O VAL A 8 5.151 -12.707 27.692 1.00 0.00 O ATOM 114 CB VAL A 8 4.124 -11.688 24.806 1.00 0.00 C ATOM 115 CG1 VAL A 8 3.516 -10.797 25.888 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.449 -10.844 23.570 1.00 0.00 C ATOM 0 H VAL A 8 5.670 -12.986 23.352 1.00 0.00 H new ATOM 0 HA VAL A 8 6.118 -11.565 25.615 1.00 0.00 H new ATOM 0 HB VAL A 8 3.410 -12.466 24.536 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.605 -10.335 25.509 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.280 -11.399 26.765 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.229 -10.020 26.163 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.536 -10.381 23.195 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.166 -10.068 23.838 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.877 -11.482 22.796 1.00 0.00 H new ATOM 126 N LEU A 9 4.701 -14.438 26.326 1.00 0.00 N ATOM 127 CA LEU A 9 4.373 -15.338 27.425 1.00 0.00 C ATOM 128 C LEU A 9 5.598 -15.525 28.315 1.00 0.00 C ATOM 129 O LEU A 9 5.494 -15.513 29.541 1.00 0.00 O ATOM 130 CB LEU A 9 3.911 -16.695 26.872 1.00 0.00 C ATOM 131 CG LEU A 9 2.424 -16.634 26.501 1.00 0.00 C ATOM 132 CD1 LEU A 9 2.197 -15.537 25.460 1.00 0.00 C ATOM 133 CD2 LEU A 9 1.989 -17.983 25.925 1.00 0.00 C ATOM 0 H LEU A 9 4.624 -14.852 25.397 1.00 0.00 H new ATOM 0 HA LEU A 9 3.564 -14.906 28.015 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.502 -16.959 25.995 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.077 -17.475 27.615 1.00 0.00 H new ATOM 0 HG LEU A 9 1.837 -16.411 27.392 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.140 -15.497 25.199 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.506 -14.576 25.871 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.783 -15.756 24.567 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.932 -17.942 25.661 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.577 -18.205 25.035 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.147 -18.764 26.669 1.00 0.00 H new ATOM 145 N LYS A 10 6.760 -15.684 27.688 1.00 0.00 N ATOM 146 CA LYS A 10 8.000 -15.855 28.433 1.00 0.00 C ATOM 147 C LYS A 10 8.310 -14.589 29.221 1.00 0.00 C ATOM 148 O LYS A 10 8.893 -14.644 30.303 1.00 0.00 O ATOM 149 CB LYS A 10 9.152 -16.182 27.481 1.00 0.00 C ATOM 150 CG LYS A 10 10.413 -16.533 28.282 1.00 0.00 C ATOM 151 CD LYS A 10 11.436 -17.195 27.354 1.00 0.00 C ATOM 152 CE LYS A 10 11.789 -16.249 26.201 1.00 0.00 C ATOM 153 NZ LYS A 10 11.995 -14.871 26.731 1.00 0.00 N ATOM 0 H LYS A 10 6.867 -15.698 26.674 1.00 0.00 H new ATOM 0 HA LYS A 10 7.881 -16.685 29.129 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.876 -17.017 26.837 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.350 -15.330 26.831 1.00 0.00 H new ATOM 0 HG2 LYS A 10 10.837 -15.633 28.726 1.00 0.00 H new ATOM 0 HG3 LYS A 10 10.161 -17.205 29.102 1.00 0.00 H new ATOM 0 HD2 LYS A 10 12.336 -17.450 27.914 1.00 0.00 H new ATOM 0 HD3 LYS A 10 11.031 -18.127 26.959 1.00 0.00 H new ATOM 0 HE2 LYS A 10 12.692 -16.594 25.697 1.00 0.00 H new ATOM 0 HE3 LYS A 10 10.990 -16.249 25.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 12.659 -14.358 26.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 11.085 -14.368 26.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 12.385 -14.924 27.694 1.00 0.00 H new ATOM 167 N ALA A 11 7.911 -13.445 28.669 1.00 0.00 N ATOM 168 CA ALA A 11 8.151 -12.171 29.333 1.00 0.00 C ATOM 169 C ALA A 11 7.604 -12.206 30.759 1.00 0.00 C ATOM 170 O ALA A 11 8.318 -11.906 31.715 1.00 0.00 O ATOM 171 CB ALA A 11 7.474 -11.042 28.552 1.00 0.00 C ATOM 0 H ALA A 11 7.426 -13.376 27.774 1.00 0.00 H new ATOM 0 HA ALA A 11 9.226 -11.993 29.369 1.00 0.00 H new ATOM 0 HB1 ALA A 11 7.657 -10.092 29.054 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.881 -11.003 27.542 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.401 -11.226 28.504 1.00 0.00 H new ATOM 177 N ARG A 12 6.337 -12.588 30.892 1.00 0.00 N ATOM 178 CA ARG A 12 5.706 -12.678 32.206 1.00 0.00 C ATOM 179 C ARG A 12 6.358 -13.796 33.017 1.00 0.00 C ATOM 180 O ARG A 12 6.614 -13.647 34.211 1.00 0.00 O ATOM 181 CB ARG A 12 4.197 -12.942 32.046 1.00 0.00 C ATOM 182 CG ARG A 12 3.442 -11.616 31.876 1.00 0.00 C ATOM 183 CD ARG A 12 3.896 -10.918 30.592 1.00 0.00 C ATOM 184 NE ARG A 12 3.131 -9.693 30.391 1.00 0.00 N ATOM 185 CZ ARG A 12 1.930 -9.718 29.826 1.00 0.00 C ATOM 186 NH1 ARG A 12 1.413 -10.854 29.445 1.00 0.00 N ATOM 187 NH2 ARG A 12 1.267 -8.608 29.653 1.00 0.00 N ATOM 0 H ARG A 12 5.730 -12.839 30.112 1.00 0.00 H new ATOM 0 HA ARG A 12 5.841 -11.735 32.736 1.00 0.00 H new ATOM 0 HB2 ARG A 12 4.022 -13.582 31.181 1.00 0.00 H new ATOM 0 HB3 ARG A 12 3.819 -13.475 32.919 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.368 -11.801 31.839 1.00 0.00 H new ATOM 0 HG3 ARG A 12 3.625 -10.971 32.735 1.00 0.00 H new ATOM 0 HD2 ARG A 12 4.959 -10.686 30.651 1.00 0.00 H new ATOM 0 HD3 ARG A 12 3.762 -11.584 29.740 1.00 0.00 H new ATOM 0 HE ARG A 12 3.526 -8.801 30.690 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.932 -11.722 29.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 0.490 -10.874 29.011 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.671 -7.721 29.952 1.00 0.00 H new ATOM 0 HH22 ARG A 12 0.344 -8.628 29.219 1.00 0.00 H new ATOM 201 N ALA A 13 6.628 -14.911 32.347 1.00 0.00 N ATOM 202 CA ALA A 13 7.259 -16.055 32.992 1.00 0.00 C ATOM 203 C ALA A 13 8.750 -15.796 33.176 1.00 0.00 C ATOM 204 O ALA A 13 9.477 -16.632 33.710 1.00 0.00 O ATOM 205 CB ALA A 13 7.045 -17.322 32.162 1.00 0.00 C ATOM 0 H ALA A 13 6.420 -15.046 31.358 1.00 0.00 H new ATOM 0 HA ALA A 13 6.801 -16.198 33.970 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.523 -18.167 32.658 1.00 0.00 H new ATOM 0 HB2 ALA A 13 5.977 -17.516 32.063 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.483 -17.187 31.173 1.00 0.00 H new ATOM 211 N SER A 14 9.199 -14.629 32.719 1.00 0.00 N ATOM 212 CA SER A 14 10.607 -14.267 32.828 1.00 0.00 C ATOM 213 C SER A 14 10.994 -14.085 34.291 1.00 0.00 C ATOM 214 O SER A 14 12.099 -13.643 34.601 1.00 0.00 O ATOM 215 CB SER A 14 10.871 -12.963 32.078 1.00 0.00 C ATOM 216 OG SER A 14 10.390 -11.873 32.855 1.00 0.00 O ATOM 0 H SER A 14 8.612 -13.924 32.273 1.00 0.00 H new ATOM 0 HA SER A 14 11.203 -15.069 32.392 1.00 0.00 H new ATOM 0 HB2 SER A 14 11.938 -12.848 31.889 1.00 0.00 H new ATOM 0 HB3 SER A 14 10.375 -12.981 31.107 1.00 0.00 H new ATOM 0 HG SER A 14 9.752 -11.350 32.326 1.00 0.00 H new ATOM 222 N VAL A 15 10.077 -14.439 35.186 1.00 0.00 N ATOM 223 CA VAL A 15 10.334 -14.322 36.613 1.00 0.00 C ATOM 224 C VAL A 15 11.597 -15.091 36.979 1.00 0.00 C ATOM 225 O VAL A 15 12.300 -14.737 37.925 1.00 0.00 O ATOM 226 CB VAL A 15 9.147 -14.881 37.401 1.00 0.00 C ATOM 227 CG1 VAL A 15 8.990 -16.372 37.094 1.00 0.00 C ATOM 228 CG2 VAL A 15 9.396 -14.694 38.898 1.00 0.00 C ATOM 0 H VAL A 15 9.156 -14.807 34.948 1.00 0.00 H new ATOM 0 HA VAL A 15 10.470 -13.270 36.863 1.00 0.00 H new ATOM 0 HB VAL A 15 8.238 -14.352 37.114 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.145 -16.772 37.654 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.814 -16.507 36.027 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.899 -16.900 37.382 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.551 -15.092 39.460 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.304 -15.224 39.185 1.00 0.00 H new ATOM 0 HG23 VAL A 15 9.510 -13.633 39.118 1.00 0.00 H new ATOM 238 N ILE A 16 11.884 -16.145 36.216 1.00 0.00 N ATOM 239 CA ILE A 16 13.073 -16.962 36.453 1.00 0.00 C ATOM 240 C ILE A 16 13.747 -17.299 35.127 1.00 0.00 C ATOM 241 O ILE A 16 13.154 -17.941 34.259 1.00 0.00 O ATOM 242 CB ILE A 16 12.674 -18.249 37.191 1.00 0.00 C ATOM 243 CG1 ILE A 16 13.932 -19.042 37.585 1.00 0.00 C ATOM 244 CG2 ILE A 16 11.783 -19.116 36.291 1.00 0.00 C ATOM 245 CD1 ILE A 16 14.781 -18.246 38.590 1.00 0.00 C ATOM 0 H ILE A 16 11.311 -16.453 35.430 1.00 0.00 H new ATOM 0 HA ILE A 16 13.778 -16.404 37.069 1.00 0.00 H new ATOM 0 HB ILE A 16 12.122 -17.979 38.091 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.644 -19.998 38.021 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.523 -19.262 36.696 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.505 -20.026 36.822 1.00 0.00 H new ATOM 0 HG22 ILE A 16 10.883 -18.561 36.027 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.327 -19.378 35.384 1.00 0.00 H new ATOM 0 HD11 ILE A 16 15.666 -18.824 38.856 1.00 0.00 H new ATOM 0 HD12 ILE A 16 15.086 -17.301 38.141 1.00 0.00 H new ATOM 0 HD13 ILE A 16 14.193 -18.048 39.487 1.00 0.00 H new ATOM 257 N GLY A 17 14.991 -16.858 34.976 1.00 0.00 N ATOM 258 CA GLY A 17 15.737 -17.114 33.752 1.00 0.00 C ATOM 259 C GLY A 17 16.043 -18.598 33.621 1.00 0.00 C ATOM 260 O GLY A 17 16.150 -19.309 34.621 1.00 0.00 O ATOM 0 H GLY A 17 15.500 -16.325 35.681 1.00 0.00 H new ATOM 0 HA2 GLY A 17 15.161 -16.777 32.890 1.00 0.00 H new ATOM 0 HA3 GLY A 17 16.666 -16.543 33.758 1.00 0.00 H new ATOM 264 N LYS A 18 16.169 -19.067 32.384 1.00 0.00 N ATOM 265 CA LYS A 18 16.446 -20.481 32.136 1.00 0.00 C ATOM 266 C LYS A 18 17.200 -20.647 30.812 1.00 0.00 C ATOM 267 O LYS A 18 17.138 -19.779 29.943 1.00 0.00 O ATOM 268 CB LYS A 18 15.116 -21.274 32.097 1.00 0.00 C ATOM 269 CG LYS A 18 13.955 -20.328 31.768 1.00 0.00 C ATOM 270 CD LYS A 18 12.689 -21.148 31.507 1.00 0.00 C ATOM 271 CE LYS A 18 11.559 -20.209 31.087 1.00 0.00 C ATOM 272 NZ LYS A 18 11.335 -19.197 32.156 1.00 0.00 N ATOM 0 H LYS A 18 16.085 -18.496 31.543 1.00 0.00 H new ATOM 0 HA LYS A 18 17.069 -20.869 32.942 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.176 -22.065 31.349 1.00 0.00 H new ATOM 0 HB3 LYS A 18 14.942 -21.757 33.058 1.00 0.00 H new ATOM 0 HG2 LYS A 18 13.790 -19.636 32.594 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.199 -19.726 30.892 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.874 -21.886 30.726 1.00 0.00 H new ATOM 0 HD3 LYS A 18 12.406 -21.698 32.405 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.812 -19.714 30.149 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.645 -20.777 30.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 10.386 -18.785 32.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 11.412 -19.653 33.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 12.050 -18.446 32.078 1.00 0.00 H new ATOM 286 N PRO A 19 17.893 -21.746 30.643 1.00 0.00 N ATOM 287 CA PRO A 19 18.657 -22.026 29.391 1.00 0.00 C ATOM 288 C PRO A 19 17.748 -22.050 28.162 1.00 0.00 C ATOM 289 O PRO A 19 16.641 -22.588 28.204 1.00 0.00 O ATOM 290 CB PRO A 19 19.296 -23.407 29.648 1.00 0.00 C ATOM 291 CG PRO A 19 18.486 -24.007 30.751 1.00 0.00 C ATOM 292 CD PRO A 19 18.033 -22.839 31.616 1.00 0.00 C ATOM 0 HA PRO A 19 19.396 -21.254 29.176 1.00 0.00 H new ATOM 0 HB2 PRO A 19 19.266 -24.029 28.753 1.00 0.00 H new ATOM 0 HB3 PRO A 19 20.343 -23.310 29.935 1.00 0.00 H new ATOM 0 HG2 PRO A 19 17.631 -24.555 30.355 1.00 0.00 H new ATOM 0 HG3 PRO A 19 19.078 -24.716 31.330 1.00 0.00 H new ATOM 0 HD2 PRO A 19 17.092 -23.052 32.122 1.00 0.00 H new ATOM 0 HD3 PRO A 19 18.764 -22.601 32.389 1.00 0.00 H new ATOM 300 N ILE A 20 18.230 -21.463 27.068 1.00 0.00 N ATOM 301 CA ILE A 20 17.464 -21.413 25.823 1.00 0.00 C ATOM 302 C ILE A 20 17.715 -22.663 24.989 1.00 0.00 C ATOM 303 O ILE A 20 18.856 -23.092 24.820 1.00 0.00 O ATOM 304 CB ILE A 20 17.850 -20.165 25.018 1.00 0.00 C ATOM 305 CG1 ILE A 20 19.331 -20.268 24.564 1.00 0.00 C ATOM 306 CG2 ILE A 20 17.646 -18.926 25.902 1.00 0.00 C ATOM 307 CD1 ILE A 20 19.413 -20.713 23.093 1.00 0.00 C ATOM 0 H ILE A 20 19.145 -21.016 27.018 1.00 0.00 H new ATOM 0 HA ILE A 20 16.404 -21.366 26.072 1.00 0.00 H new ATOM 0 HB ILE A 20 17.224 -20.085 24.130 1.00 0.00 H new ATOM 0 HG12 ILE A 20 19.823 -19.303 24.686 1.00 0.00 H new ATOM 0 HG13 ILE A 20 19.863 -20.980 25.196 1.00 0.00 H new ATOM 0 HG21 ILE A 20 17.917 -18.031 25.342 1.00 0.00 H new ATOM 0 HG22 ILE A 20 16.601 -18.863 26.204 1.00 0.00 H new ATOM 0 HG23 ILE A 20 18.276 -19.004 26.788 1.00 0.00 H new ATOM 0 HD11 ILE A 20 20.458 -20.780 22.791 1.00 0.00 H new ATOM 0 HD12 ILE A 20 18.940 -21.688 22.981 1.00 0.00 H new ATOM 0 HD13 ILE A 20 18.899 -19.986 22.464 1.00 0.00 H new ATOM 319 N GLY A 21 16.640 -23.240 24.467 1.00 0.00 N ATOM 320 CA GLY A 21 16.741 -24.440 23.642 1.00 0.00 C ATOM 321 C GLY A 21 16.971 -24.076 22.177 1.00 0.00 C ATOM 322 O GLY A 21 16.581 -22.999 21.732 1.00 0.00 O ATOM 0 H GLY A 21 15.688 -22.898 24.599 1.00 0.00 H new ATOM 0 HA2 GLY A 21 17.561 -25.064 23.999 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.828 -25.029 23.736 1.00 0.00 H new ATOM 326 N GLU A 22 17.608 -24.972 21.431 1.00 0.00 N ATOM 327 CA GLU A 22 17.877 -24.717 20.018 1.00 0.00 C ATOM 328 C GLU A 22 16.606 -24.902 19.188 1.00 0.00 C ATOM 329 O GLU A 22 15.886 -23.940 18.917 1.00 0.00 O ATOM 330 CB GLU A 22 18.967 -25.668 19.517 1.00 0.00 C ATOM 331 CG GLU A 22 19.304 -25.353 18.057 1.00 0.00 C ATOM 332 CD GLU A 22 20.434 -26.258 17.577 1.00 0.00 C ATOM 333 OE1 GLU A 22 21.075 -26.868 18.416 1.00 0.00 O ATOM 334 OE2 GLU A 22 20.640 -26.329 16.377 1.00 0.00 O ATOM 0 H GLU A 22 17.945 -25.871 21.774 1.00 0.00 H new ATOM 0 HA GLU A 22 18.218 -23.687 19.909 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.860 -25.569 20.135 1.00 0.00 H new ATOM 0 HB3 GLU A 22 18.630 -26.701 19.607 1.00 0.00 H new ATOM 0 HG2 GLU A 22 18.422 -25.496 17.432 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.598 -24.308 17.960 1.00 0.00 H new ATOM 341 N SER A 23 16.336 -26.142 18.790 1.00 0.00 N ATOM 342 CA SER A 23 15.150 -26.443 17.994 1.00 0.00 C ATOM 343 C SER A 23 13.883 -26.267 18.825 1.00 0.00 C ATOM 344 O SER A 23 12.811 -25.987 18.289 1.00 0.00 O ATOM 345 CB SER A 23 15.226 -27.877 17.466 1.00 0.00 C ATOM 346 OG SER A 23 15.338 -28.775 18.561 1.00 0.00 O ATOM 0 H SER A 23 16.919 -26.951 19.004 1.00 0.00 H new ATOM 0 HA SER A 23 15.114 -25.749 17.154 1.00 0.00 H new ATOM 0 HB2 SER A 23 14.336 -28.109 16.880 1.00 0.00 H new ATOM 0 HB3 SER A 23 16.083 -27.987 16.801 1.00 0.00 H new ATOM 0 HG SER A 23 15.385 -29.695 18.226 1.00 0.00 H new ATOM 352 N TYR A 24 14.012 -26.431 20.136 1.00 0.00 N ATOM 353 CA TYR A 24 12.868 -26.285 21.027 1.00 0.00 C ATOM 354 C TYR A 24 12.379 -24.839 21.025 1.00 0.00 C ATOM 355 O TYR A 24 11.184 -24.576 21.150 1.00 0.00 O ATOM 356 CB TYR A 24 13.250 -26.710 22.446 1.00 0.00 C ATOM 357 CG TYR A 24 13.581 -28.183 22.455 1.00 0.00 C ATOM 358 CD1 TYR A 24 14.871 -28.611 22.122 1.00 0.00 C ATOM 359 CD2 TYR A 24 12.599 -29.120 22.797 1.00 0.00 C ATOM 360 CE1 TYR A 24 15.180 -29.977 22.130 1.00 0.00 C ATOM 361 CE2 TYR A 24 12.907 -30.487 22.805 1.00 0.00 C ATOM 362 CZ TYR A 24 14.198 -30.915 22.472 1.00 0.00 C ATOM 363 OH TYR A 24 14.502 -32.261 22.481 1.00 0.00 O ATOM 0 H TYR A 24 14.889 -26.663 20.602 1.00 0.00 H new ATOM 0 HA TYR A 24 12.062 -26.927 20.672 1.00 0.00 H new ATOM 0 HB2 TYR A 24 14.106 -26.131 22.793 1.00 0.00 H new ATOM 0 HB3 TYR A 24 12.428 -26.506 23.132 1.00 0.00 H new ATOM 0 HD1 TYR A 24 15.629 -27.888 21.859 1.00 0.00 H new ATOM 0 HD2 TYR A 24 11.604 -28.789 23.055 1.00 0.00 H new ATOM 0 HE1 TYR A 24 16.176 -30.307 21.872 1.00 0.00 H new ATOM 0 HE2 TYR A 24 12.149 -31.210 23.068 1.00 0.00 H new ATOM 0 HH TYR A 24 13.709 -32.774 22.741 1.00 0.00 H new ATOM 373 N LYS A 25 13.316 -23.903 20.883 1.00 0.00 N ATOM 374 CA LYS A 25 12.976 -22.483 20.861 1.00 0.00 C ATOM 375 C LYS A 25 12.579 -22.050 19.451 1.00 0.00 C ATOM 376 O LYS A 25 12.024 -20.969 19.256 1.00 0.00 O ATOM 377 CB LYS A 25 14.177 -21.657 21.333 1.00 0.00 C ATOM 378 CG LYS A 25 13.768 -20.190 21.483 1.00 0.00 C ATOM 379 CD LYS A 25 14.908 -19.402 22.129 1.00 0.00 C ATOM 380 CE LYS A 25 14.485 -17.943 22.313 1.00 0.00 C ATOM 381 NZ LYS A 25 14.353 -17.288 20.980 1.00 0.00 N ATOM 0 H LYS A 25 14.311 -24.102 20.782 1.00 0.00 H new ATOM 0 HA LYS A 25 12.132 -22.316 21.530 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.543 -22.041 22.285 1.00 0.00 H new ATOM 0 HB3 LYS A 25 14.995 -21.745 20.618 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.528 -19.768 20.507 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.868 -20.114 22.094 1.00 0.00 H new ATOM 0 HD2 LYS A 25 15.166 -19.841 23.093 1.00 0.00 H new ATOM 0 HD3 LYS A 25 15.800 -19.456 21.505 1.00 0.00 H new ATOM 0 HE2 LYS A 25 13.537 -17.894 22.849 1.00 0.00 H new ATOM 0 HE3 LYS A 25 15.221 -17.414 22.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 14.335 -16.255 21.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 15.161 -17.553 20.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 13.470 -17.599 20.526 1.00 0.00 H new ATOM 395 N ARG A 26 12.862 -22.902 18.473 1.00 0.00 N ATOM 396 CA ARG A 26 12.528 -22.595 17.091 1.00 0.00 C ATOM 397 C ARG A 26 11.021 -22.498 16.933 1.00 0.00 C ATOM 398 O ARG A 26 10.511 -21.599 16.264 1.00 0.00 O ATOM 399 CB ARG A 26 13.079 -23.681 16.167 1.00 0.00 C ATOM 400 CG ARG A 26 12.800 -23.309 14.708 1.00 0.00 C ATOM 401 CD ARG A 26 13.379 -24.385 13.790 1.00 0.00 C ATOM 402 NE ARG A 26 14.835 -24.377 13.860 1.00 0.00 N ATOM 403 CZ ARG A 26 15.561 -25.250 13.171 1.00 0.00 C ATOM 404 NH1 ARG A 26 14.970 -26.140 12.420 1.00 0.00 N ATOM 405 NH2 ARG A 26 16.863 -25.221 13.245 1.00 0.00 N ATOM 0 H ARG A 26 13.318 -23.804 18.611 1.00 0.00 H new ATOM 0 HA ARG A 26 12.977 -21.639 16.822 1.00 0.00 H new ATOM 0 HB2 ARG A 26 14.151 -23.796 16.324 1.00 0.00 H new ATOM 0 HB3 ARG A 26 12.618 -24.640 16.402 1.00 0.00 H new ATOM 0 HG2 ARG A 26 11.727 -23.215 14.544 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.244 -22.341 14.477 1.00 0.00 H new ATOM 0 HD2 ARG A 26 12.999 -25.364 14.081 1.00 0.00 H new ATOM 0 HD3 ARG A 26 13.056 -24.210 12.764 1.00 0.00 H new ATOM 0 HE ARG A 26 15.305 -23.689 14.449 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.952 -26.164 12.363 1.00 0.00 H new ATOM 0 HH12 ARG A 26 15.527 -26.811 11.890 1.00 0.00 H new ATOM 0 HH21 ARG A 26 17.325 -24.527 13.833 1.00 0.00 H new ATOM 0 HH22 ARG A 26 17.419 -25.892 12.715 1.00 0.00 H new ATOM 419 N ILE A 27 10.312 -23.429 17.558 1.00 0.00 N ATOM 420 CA ILE A 27 8.862 -23.435 17.486 1.00 0.00 C ATOM 421 C ILE A 27 8.293 -22.195 18.153 1.00 0.00 C ATOM 422 O ILE A 27 7.317 -21.616 17.684 1.00 0.00 O ATOM 423 CB ILE A 27 8.294 -24.703 18.151 1.00 0.00 C ATOM 424 CG1 ILE A 27 6.752 -24.570 18.349 1.00 0.00 C ATOM 425 CG2 ILE A 27 9.009 -24.961 19.479 1.00 0.00 C ATOM 426 CD1 ILE A 27 6.379 -24.087 19.765 1.00 0.00 C ATOM 0 H ILE A 27 10.715 -24.182 18.115 1.00 0.00 H new ATOM 0 HA ILE A 27 8.571 -23.432 16.436 1.00 0.00 H new ATOM 0 HB ILE A 27 8.470 -25.559 17.500 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.353 -23.871 17.613 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.280 -25.534 18.161 1.00 0.00 H new ATOM 0 HG21 ILE A 27 8.602 -25.859 19.943 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.075 -25.098 19.298 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.860 -24.110 20.144 1.00 0.00 H new ATOM 0 HD11 ILE A 27 5.295 -24.011 19.850 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.752 -24.798 20.502 1.00 0.00 H new ATOM 0 HD13 ILE A 27 6.826 -23.109 19.946 1.00 0.00 H new ATOM 438 N LEU A 28 8.897 -21.807 19.264 1.00 0.00 N ATOM 439 CA LEU A 28 8.428 -20.650 20.004 1.00 0.00 C ATOM 440 C LEU A 28 8.499 -19.393 19.140 1.00 0.00 C ATOM 441 O LEU A 28 7.581 -18.574 19.145 1.00 0.00 O ATOM 442 CB LEU A 28 9.287 -20.458 21.263 1.00 0.00 C ATOM 443 CG LEU A 28 8.808 -19.236 22.061 1.00 0.00 C ATOM 444 CD1 LEU A 28 7.342 -19.421 22.486 1.00 0.00 C ATOM 445 CD2 LEU A 28 9.695 -19.080 23.301 1.00 0.00 C ATOM 0 H LEU A 28 9.708 -22.274 19.670 1.00 0.00 H new ATOM 0 HA LEU A 28 7.390 -20.819 20.290 1.00 0.00 H new ATOM 0 HB2 LEU A 28 9.233 -21.350 21.886 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.332 -20.329 20.981 1.00 0.00 H new ATOM 0 HG LEU A 28 8.877 -18.343 21.440 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.014 -18.548 23.051 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.718 -19.535 21.600 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.253 -20.311 23.109 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.366 -18.215 23.877 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.620 -19.976 23.917 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.730 -18.937 22.992 1.00 0.00 H new ATOM 457 N ALA A 29 9.598 -19.239 18.411 1.00 0.00 N ATOM 458 CA ALA A 29 9.780 -18.073 17.553 1.00 0.00 C ATOM 459 C ALA A 29 9.062 -18.271 16.222 1.00 0.00 C ATOM 460 O ALA A 29 8.801 -17.313 15.496 1.00 0.00 O ATOM 461 CB ALA A 29 11.268 -17.839 17.307 1.00 0.00 C ATOM 0 H ALA A 29 10.373 -19.902 18.396 1.00 0.00 H new ATOM 0 HA ALA A 29 9.354 -17.203 18.053 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.398 -16.967 16.666 1.00 0.00 H new ATOM 0 HB2 ALA A 29 11.772 -17.668 18.258 1.00 0.00 H new ATOM 0 HB3 ALA A 29 11.698 -18.714 16.821 1.00 0.00 H new ATOM 467 N LYS A 30 8.748 -19.523 15.911 1.00 0.00 N ATOM 468 CA LYS A 30 8.061 -19.847 14.668 1.00 0.00 C ATOM 469 C LYS A 30 6.726 -19.118 14.588 1.00 0.00 C ATOM 470 O LYS A 30 6.162 -18.953 13.508 1.00 0.00 O ATOM 471 CB LYS A 30 7.831 -21.355 14.576 1.00 0.00 C ATOM 472 CG LYS A 30 7.241 -21.697 13.205 1.00 0.00 C ATOM 473 CD LYS A 30 7.129 -23.223 13.046 1.00 0.00 C ATOM 474 CE LYS A 30 8.458 -23.806 12.548 1.00 0.00 C ATOM 475 NZ LYS A 30 8.281 -25.257 12.254 1.00 0.00 N ATOM 0 H LYS A 30 8.958 -20.328 16.501 1.00 0.00 H new ATOM 0 HA LYS A 30 8.686 -19.525 13.835 1.00 0.00 H new ATOM 0 HB2 LYS A 30 8.771 -21.887 14.723 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.154 -21.680 15.367 1.00 0.00 H new ATOM 0 HG2 LYS A 30 6.258 -21.239 13.099 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.871 -21.286 12.416 1.00 0.00 H new ATOM 0 HD2 LYS A 30 6.860 -23.676 14.000 1.00 0.00 H new ATOM 0 HD3 LYS A 30 6.332 -23.465 12.343 1.00 0.00 H new ATOM 0 HE2 LYS A 30 8.786 -23.279 11.652 1.00 0.00 H new ATOM 0 HE3 LYS A 30 9.234 -23.668 13.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 9.210 -25.692 12.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.827 -25.723 13.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 7.683 -25.370 11.411 1.00 0.00 H new ATOM 489 N LEU A 31 6.230 -18.681 15.738 1.00 0.00 N ATOM 490 CA LEU A 31 4.960 -17.969 15.793 1.00 0.00 C ATOM 491 C LEU A 31 5.039 -16.697 14.955 1.00 0.00 C ATOM 492 O LEU A 31 4.072 -16.314 14.298 1.00 0.00 O ATOM 493 CB LEU A 31 4.622 -17.614 17.250 1.00 0.00 C ATOM 494 CG LEU A 31 3.997 -18.826 17.962 1.00 0.00 C ATOM 495 CD1 LEU A 31 2.596 -19.134 17.388 1.00 0.00 C ATOM 496 CD2 LEU A 31 4.914 -20.041 17.786 1.00 0.00 C ATOM 0 H LEU A 31 6.685 -18.806 16.642 1.00 0.00 H new ATOM 0 HA LEU A 31 4.176 -18.611 15.391 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.525 -17.301 17.774 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.930 -16.772 17.276 1.00 0.00 H new ATOM 0 HG LEU A 31 3.888 -18.598 19.022 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.172 -19.995 17.905 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.947 -18.270 17.529 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.679 -19.355 16.324 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.476 -20.903 18.289 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.029 -20.260 16.724 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.891 -19.826 18.220 1.00 0.00 H new ATOM 508 N GLN A 32 6.196 -16.047 14.979 1.00 0.00 N ATOM 509 CA GLN A 32 6.380 -14.820 14.214 1.00 0.00 C ATOM 510 C GLN A 32 5.944 -15.035 12.767 1.00 0.00 C ATOM 511 O GLN A 32 5.253 -14.196 12.189 1.00 0.00 O ATOM 512 CB GLN A 32 7.852 -14.407 14.252 1.00 0.00 C ATOM 513 CG GLN A 32 8.037 -13.078 13.516 1.00 0.00 C ATOM 514 CD GLN A 32 9.502 -12.665 13.553 1.00 0.00 C ATOM 515 OE1 GLN A 32 10.363 -13.382 13.045 1.00 0.00 O ATOM 516 NE2 GLN A 32 9.838 -11.545 14.129 1.00 0.00 N ATOM 0 H GLN A 32 7.012 -16.344 15.513 1.00 0.00 H new ATOM 0 HA GLN A 32 5.770 -14.031 14.655 1.00 0.00 H new ATOM 0 HB2 GLN A 32 8.185 -14.310 15.285 1.00 0.00 H new ATOM 0 HB3 GLN A 32 8.468 -15.178 13.789 1.00 0.00 H new ATOM 0 HG2 GLN A 32 7.703 -13.175 12.483 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.421 -12.307 13.979 1.00 0.00 H new ATOM 0 HE21 GLN A 32 9.122 -10.953 14.549 1.00 0.00 H new ATOM 0 HE22 GLN A 32 10.817 -11.261 14.159 1.00 0.00 H new ATOM 525 N ARG A 33 6.342 -16.165 12.191 1.00 0.00 N ATOM 526 CA ARG A 33 5.972 -16.479 10.815 1.00 0.00 C ATOM 527 C ARG A 33 4.463 -16.647 10.696 1.00 0.00 C ATOM 528 O ARG A 33 3.853 -16.190 9.731 1.00 0.00 O ATOM 529 CB ARG A 33 6.676 -17.770 10.365 1.00 0.00 C ATOM 530 CG ARG A 33 8.139 -17.480 9.985 1.00 0.00 C ATOM 531 CD ARG A 33 8.221 -17.011 8.525 1.00 0.00 C ATOM 532 NE ARG A 33 9.615 -16.837 8.130 1.00 0.00 N ATOM 533 CZ ARG A 33 9.931 -16.337 6.940 1.00 0.00 C ATOM 534 NH1 ARG A 33 8.988 -15.996 6.107 1.00 0.00 N ATOM 535 NH2 ARG A 33 11.184 -16.185 6.607 1.00 0.00 N ATOM 0 H ARG A 33 6.915 -16.873 12.650 1.00 0.00 H new ATOM 0 HA ARG A 33 6.285 -15.655 10.173 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.641 -18.509 11.166 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.151 -18.200 9.512 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.550 -16.715 10.644 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.743 -18.377 10.122 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.739 -17.740 7.873 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.682 -16.071 8.406 1.00 0.00 H new ATOM 0 HE ARG A 33 10.358 -17.103 8.777 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.009 -16.113 6.369 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.229 -15.612 5.193 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.921 -16.450 7.260 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.426 -15.801 5.693 1.00 0.00 H new ATOM 549 N ILE A 34 3.869 -17.305 11.680 1.00 0.00 N ATOM 550 CA ILE A 34 2.433 -17.528 11.674 1.00 0.00 C ATOM 551 C ILE A 34 1.692 -16.200 11.787 1.00 0.00 C ATOM 552 O ILE A 34 0.705 -15.969 11.094 1.00 0.00 O ATOM 553 CB ILE A 34 2.042 -18.438 12.841 1.00 0.00 C ATOM 554 CG1 ILE A 34 2.910 -19.707 12.825 1.00 0.00 C ATOM 555 CG2 ILE A 34 0.568 -18.821 12.723 1.00 0.00 C ATOM 556 CD1 ILE A 34 2.857 -20.378 11.447 1.00 0.00 C ATOM 0 H ILE A 34 4.357 -17.692 12.488 1.00 0.00 H new ATOM 0 HA ILE A 34 2.157 -18.008 10.735 1.00 0.00 H new ATOM 0 HB ILE A 34 2.202 -17.907 13.779 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.941 -19.453 13.073 1.00 0.00 H new ATOM 0 HG13 ILE A 34 2.561 -20.403 13.588 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.293 -19.469 13.555 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.045 -17.920 12.746 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.403 -19.348 11.783 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.477 -21.274 11.455 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.828 -20.651 11.215 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.228 -19.686 10.691 1.00 0.00 H new ATOM 568 N HIS A 35 2.173 -15.330 12.665 1.00 0.00 N ATOM 569 CA HIS A 35 1.535 -14.034 12.851 1.00 0.00 C ATOM 570 C HIS A 35 1.448 -13.282 11.524 1.00 0.00 C ATOM 571 O HIS A 35 0.365 -12.870 11.106 1.00 0.00 O ATOM 572 CB HIS A 35 2.340 -13.206 13.857 1.00 0.00 C ATOM 573 CG HIS A 35 1.681 -11.872 14.053 1.00 0.00 C ATOM 574 ND1 HIS A 35 2.196 -10.708 13.502 1.00 0.00 N ATOM 575 CD2 HIS A 35 0.552 -11.496 14.735 1.00 0.00 C ATOM 576 CE1 HIS A 35 1.384 -9.697 13.859 1.00 0.00 C ATOM 577 NE2 HIS A 35 0.366 -10.123 14.612 1.00 0.00 N ATOM 0 H HIS A 35 2.991 -15.494 13.252 1.00 0.00 H new ATOM 0 HA HIS A 35 0.525 -14.193 13.229 1.00 0.00 H new ATOM 0 HB2 HIS A 35 2.405 -13.734 14.808 1.00 0.00 H new ATOM 0 HB3 HIS A 35 3.360 -13.070 13.498 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -0.094 -12.164 15.284 1.00 0.00 H new ATOM 0 HE1 HIS A 35 1.536 -8.667 13.572 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -0.386 -9.562 15.011 1.00 0.00 H new ATOM 585 N ASN A 36 2.589 -13.109 10.864 1.00 0.00 N ATOM 586 CA ASN A 36 2.624 -12.408 9.582 1.00 0.00 C ATOM 587 C ASN A 36 2.047 -13.279 8.467 1.00 0.00 C ATOM 588 O ASN A 36 1.263 -12.812 7.639 1.00 0.00 O ATOM 589 CB ASN A 36 4.067 -12.025 9.245 1.00 0.00 C ATOM 590 CG ASN A 36 4.503 -10.838 10.099 1.00 0.00 C ATOM 591 OD1 ASN A 36 3.662 -10.110 10.626 1.00 0.00 O ATOM 592 ND2 ASN A 36 5.774 -10.604 10.273 1.00 0.00 N ATOM 0 H ASN A 36 3.496 -13.441 11.191 1.00 0.00 H new ATOM 0 HA ASN A 36 2.015 -11.508 9.664 1.00 0.00 H new ATOM 0 HB2 ASN A 36 4.728 -12.873 9.422 1.00 0.00 H new ATOM 0 HB3 ASN A 36 4.148 -11.773 8.188 1.00 0.00 H new ATOM 0 HD21 ASN A 36 6.074 -9.816 10.847 1.00 0.00 H new ATOM 0 HD22 ASN A 36 6.469 -11.209 9.835 1.00 0.00 H new ATOM 599 N SER A 37 2.451 -14.548 8.449 1.00 0.00 N ATOM 600 CA SER A 37 1.990 -15.491 7.435 1.00 0.00 C ATOM 601 C SER A 37 0.684 -16.144 7.863 1.00 0.00 C ATOM 602 O SER A 37 0.299 -17.189 7.339 1.00 0.00 O ATOM 603 CB SER A 37 3.045 -16.571 7.202 1.00 0.00 C ATOM 604 OG SER A 37 2.856 -17.619 8.143 1.00 0.00 O ATOM 0 H SER A 37 3.099 -14.947 9.128 1.00 0.00 H new ATOM 0 HA SER A 37 1.823 -14.940 6.509 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.967 -16.959 6.187 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.044 -16.149 7.306 1.00 0.00 H new ATOM 0 HG SER A 37 2.795 -17.241 9.045 1.00 0.00 H new ATOM 610 N ASN A 38 0.008 -15.528 8.824 1.00 0.00 N ATOM 611 CA ASN A 38 -1.252 -16.068 9.316 1.00 0.00 C ATOM 612 C ASN A 38 -2.136 -16.480 8.150 1.00 0.00 C ATOM 613 O ASN A 38 -2.261 -15.745 7.173 1.00 0.00 O ATOM 614 CB ASN A 38 -1.983 -15.007 10.142 1.00 0.00 C ATOM 615 CG ASN A 38 -3.155 -15.637 10.886 1.00 0.00 C ATOM 616 OD1 ASN A 38 -3.093 -16.805 11.269 1.00 0.00 O ATOM 617 ND2 ASN A 38 -4.226 -14.928 11.115 1.00 0.00 N ATOM 0 H ASN A 38 0.307 -14.663 9.274 1.00 0.00 H new ATOM 0 HA ASN A 38 -1.039 -16.939 9.936 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.294 -14.550 10.853 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -2.342 -14.211 9.490 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -5.015 -15.341 11.613 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -4.275 -13.960 10.796 1.00 0.00 H new ATOM 624 N ILE A 39 -2.736 -17.666 8.259 1.00 0.00 N ATOM 625 CA ILE A 39 -3.614 -18.186 7.211 1.00 0.00 C ATOM 626 C ILE A 39 -3.121 -17.790 5.824 1.00 0.00 C ATOM 627 O ILE A 39 -3.899 -17.337 4.982 1.00 0.00 O ATOM 628 CB ILE A 39 -5.043 -17.689 7.417 1.00 0.00 C ATOM 629 CG1 ILE A 39 -5.055 -16.174 7.482 1.00 0.00 C ATOM 630 CG2 ILE A 39 -5.602 -18.257 8.721 1.00 0.00 C ATOM 631 CD1 ILE A 39 -6.492 -15.679 7.413 1.00 0.00 C ATOM 0 H ILE A 39 -2.630 -18.285 9.063 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.600 -19.274 7.279 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.660 -18.020 6.582 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.585 -15.834 8.405 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -4.475 -15.759 6.658 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.622 -17.901 8.865 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.601 -19.346 8.673 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.982 -17.930 9.556 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -6.504 -14.590 7.460 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -6.945 -16.007 6.478 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.057 -16.084 8.252 1.00 0.00 H new ATOM 643 N LEU A 40 -1.819 -17.955 5.594 1.00 0.00 N ATOM 644 CA LEU A 40 -1.220 -17.604 4.307 1.00 0.00 C ATOM 645 C LEU A 40 -1.117 -18.835 3.416 1.00 0.00 C ATOM 646 O LEU A 40 -0.696 -19.900 3.859 1.00 0.00 O ATOM 647 CB LEU A 40 0.171 -17.003 4.524 1.00 0.00 C ATOM 648 CG LEU A 40 0.735 -16.471 3.197 1.00 0.00 C ATOM 649 CD1 LEU A 40 -0.135 -15.314 2.669 1.00 0.00 C ATOM 650 CD2 LEU A 40 2.169 -15.980 3.429 1.00 0.00 C ATOM 0 H LEU A 40 -1.161 -18.328 6.279 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.856 -16.868 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.116 -16.195 5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.841 -17.758 4.935 1.00 0.00 H new ATOM 0 HG LEU A 40 0.731 -17.270 2.456 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.278 -14.948 1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.152 -15.669 2.505 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.147 -14.505 3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.579 -15.600 2.493 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.165 -15.184 4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.783 -16.807 3.785 1.00 0.00 H new ATOM 662 N ASP A 41 -1.514 -18.680 2.161 1.00 0.00 N ATOM 663 CA ASP A 41 -1.476 -19.786 1.212 1.00 0.00 C ATOM 664 C ASP A 41 -0.111 -20.467 1.217 1.00 0.00 C ATOM 665 O ASP A 41 -0.015 -21.686 1.070 1.00 0.00 O ATOM 666 CB ASP A 41 -1.796 -19.271 -0.194 1.00 0.00 C ATOM 667 CG ASP A 41 -3.271 -18.889 -0.284 1.00 0.00 C ATOM 668 OD1 ASP A 41 -4.020 -19.279 0.597 1.00 0.00 O ATOM 669 OD2 ASP A 41 -3.630 -18.212 -1.233 1.00 0.00 O ATOM 0 H ASP A 41 -1.865 -17.803 1.776 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.223 -20.521 1.511 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.173 -18.407 -0.425 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -1.564 -20.038 -0.933 1.00 0.00 H new ATOM 674 N GLU A 42 0.941 -19.675 1.371 1.00 0.00 N ATOM 675 CA GLU A 42 2.298 -20.209 1.379 1.00 0.00 C ATOM 676 C GLU A 42 2.559 -21.065 2.622 1.00 0.00 C ATOM 677 O GLU A 42 2.936 -22.232 2.514 1.00 0.00 O ATOM 678 CB GLU A 42 3.294 -19.050 1.350 1.00 0.00 C ATOM 679 CG GLU A 42 4.716 -19.599 1.200 1.00 0.00 C ATOM 680 CD GLU A 42 5.718 -18.450 1.140 1.00 0.00 C ATOM 681 OE1 GLU A 42 5.291 -17.328 0.924 1.00 0.00 O ATOM 682 OE2 GLU A 42 6.897 -18.711 1.307 1.00 0.00 O ATOM 0 H GLU A 42 0.883 -18.664 1.492 1.00 0.00 H new ATOM 0 HA GLU A 42 2.419 -20.841 0.499 1.00 0.00 H new ATOM 0 HB2 GLU A 42 3.063 -18.379 0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 42 3.214 -18.465 2.266 1.00 0.00 H new ATOM 0 HG2 GLU A 42 4.952 -20.254 2.039 1.00 0.00 H new ATOM 0 HG3 GLU A 42 4.788 -20.202 0.295 1.00 0.00 H new ATOM 689 N ARG A 43 2.370 -20.470 3.799 1.00 0.00 N ATOM 690 CA ARG A 43 2.600 -21.174 5.066 1.00 0.00 C ATOM 691 C ARG A 43 1.442 -22.115 5.389 1.00 0.00 C ATOM 692 O ARG A 43 1.573 -23.009 6.224 1.00 0.00 O ATOM 693 CB ARG A 43 2.813 -20.158 6.212 1.00 0.00 C ATOM 694 CG ARG A 43 4.288 -19.713 6.264 1.00 0.00 C ATOM 695 CD ARG A 43 5.126 -20.727 7.053 1.00 0.00 C ATOM 696 NE ARG A 43 6.499 -20.246 7.170 1.00 0.00 N ATOM 697 CZ ARG A 43 7.415 -20.533 6.249 1.00 0.00 C ATOM 698 NH1 ARG A 43 7.093 -21.242 5.202 1.00 0.00 N ATOM 699 NH2 ARG A 43 8.636 -20.094 6.390 1.00 0.00 N ATOM 0 H ARG A 43 2.059 -19.504 3.905 1.00 0.00 H new ATOM 0 HA ARG A 43 3.502 -21.778 4.962 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.169 -19.291 6.063 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.528 -20.607 7.163 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.681 -19.616 5.252 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.362 -18.730 6.730 1.00 0.00 H new ATOM 0 HD2 ARG A 43 4.697 -20.875 8.044 1.00 0.00 H new ATOM 0 HD3 ARG A 43 5.111 -21.694 6.551 1.00 0.00 H new ATOM 0 HE ARG A 43 6.762 -19.678 7.975 1.00 0.00 H new ATOM 0 HH11 ARG A 43 6.137 -21.578 5.088 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.798 -21.460 4.498 1.00 0.00 H new ATOM 0 HH21 ARG A 43 8.885 -19.533 7.204 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.341 -20.312 5.686 1.00 0.00 H new ATOM 713 N GLN A 44 0.311 -21.906 4.729 1.00 0.00 N ATOM 714 CA GLN A 44 -0.867 -22.740 4.954 1.00 0.00 C ATOM 715 C GLN A 44 -0.461 -24.211 5.058 1.00 0.00 C ATOM 716 O GLN A 44 -1.022 -24.960 5.851 1.00 0.00 O ATOM 717 CB GLN A 44 -1.865 -22.540 3.787 1.00 0.00 C ATOM 718 CG GLN A 44 -3.060 -21.687 4.236 1.00 0.00 C ATOM 719 CD GLN A 44 -3.904 -22.475 5.228 1.00 0.00 C ATOM 720 OE1 GLN A 44 -4.340 -23.587 4.927 1.00 0.00 O ATOM 721 NE2 GLN A 44 -4.161 -21.966 6.402 1.00 0.00 N ATOM 0 H GLN A 44 0.182 -21.169 4.035 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.343 -22.448 5.890 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -1.361 -22.057 2.950 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -2.216 -23.509 3.432 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.708 -20.763 4.695 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -3.663 -21.405 3.373 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.799 -21.045 6.649 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -4.724 -22.489 7.073 1.00 0.00 H new ATOM 730 N GLY A 45 0.520 -24.612 4.260 1.00 0.00 N ATOM 731 CA GLY A 45 0.989 -25.987 4.287 1.00 0.00 C ATOM 732 C GLY A 45 1.712 -26.279 5.595 1.00 0.00 C ATOM 733 O GLY A 45 1.547 -27.345 6.184 1.00 0.00 O ATOM 0 H GLY A 45 1.001 -24.009 3.592 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.145 -26.667 4.171 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.660 -26.165 3.446 1.00 0.00 H new ATOM 737 N LEU A 46 2.522 -25.322 6.038 1.00 0.00 N ATOM 738 CA LEU A 46 3.274 -25.490 7.273 1.00 0.00 C ATOM 739 C LEU A 46 2.321 -25.627 8.458 1.00 0.00 C ATOM 740 O LEU A 46 2.513 -26.472 9.332 1.00 0.00 O ATOM 741 CB LEU A 46 4.216 -24.289 7.484 1.00 0.00 C ATOM 742 CG LEU A 46 5.391 -24.677 8.404 1.00 0.00 C ATOM 743 CD1 LEU A 46 6.406 -23.530 8.433 1.00 0.00 C ATOM 744 CD2 LEU A 46 4.891 -24.957 9.836 1.00 0.00 C ATOM 0 H LEU A 46 2.672 -24.431 5.564 1.00 0.00 H new ATOM 0 HA LEU A 46 3.872 -26.399 7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.598 -23.946 6.522 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.663 -23.458 7.922 1.00 0.00 H new ATOM 0 HG LEU A 46 5.859 -25.582 8.016 1.00 0.00 H new ATOM 0 HD11 LEU A 46 7.240 -23.798 9.082 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.776 -23.346 7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.926 -22.629 8.813 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.735 -25.229 10.469 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.411 -24.063 10.235 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.173 -25.777 9.817 1.00 0.00 H new ATOM 756 N MET A 47 1.287 -24.797 8.480 1.00 0.00 N ATOM 757 CA MET A 47 0.320 -24.834 9.569 1.00 0.00 C ATOM 758 C MET A 47 -0.256 -26.240 9.730 1.00 0.00 C ATOM 759 O MET A 47 -0.451 -26.714 10.849 1.00 0.00 O ATOM 760 CB MET A 47 -0.819 -23.850 9.284 1.00 0.00 C ATOM 761 CG MET A 47 -1.687 -23.671 10.537 1.00 0.00 C ATOM 762 SD MET A 47 -0.922 -22.437 11.622 1.00 0.00 S ATOM 763 CE MET A 47 -2.034 -21.057 11.246 1.00 0.00 C ATOM 0 H MET A 47 1.097 -24.096 7.764 1.00 0.00 H new ATOM 0 HA MET A 47 0.829 -24.553 10.491 1.00 0.00 H new ATOM 0 HB2 MET A 47 -0.410 -22.888 8.975 1.00 0.00 H new ATOM 0 HB3 MET A 47 -1.429 -24.217 8.459 1.00 0.00 H new ATOM 0 HG2 MET A 47 -2.691 -23.353 10.256 1.00 0.00 H new ATOM 0 HG3 MET A 47 -1.789 -24.621 11.062 1.00 0.00 H new ATOM 0 HE1 MET A 47 -1.789 -20.208 11.885 1.00 0.00 H new ATOM 0 HE2 MET A 47 -1.917 -20.770 10.201 1.00 0.00 H new ATOM 0 HE3 MET A 47 -3.065 -21.361 11.426 1.00 0.00 H new ATOM 773 N HIS A 48 -0.531 -26.896 8.611 1.00 0.00 N ATOM 774 CA HIS A 48 -1.092 -28.241 8.646 1.00 0.00 C ATOM 775 C HIS A 48 -0.158 -29.193 9.388 1.00 0.00 C ATOM 776 O HIS A 48 -0.594 -29.977 10.230 1.00 0.00 O ATOM 777 CB HIS A 48 -1.307 -28.746 7.219 1.00 0.00 C ATOM 778 CG HIS A 48 -2.215 -27.798 6.486 1.00 0.00 C ATOM 779 ND1 HIS A 48 -2.646 -28.038 5.191 1.00 0.00 N ATOM 780 CD2 HIS A 48 -2.775 -26.598 6.850 1.00 0.00 C ATOM 781 CE1 HIS A 48 -3.428 -27.008 4.826 1.00 0.00 C ATOM 782 NE2 HIS A 48 -3.540 -26.100 5.800 1.00 0.00 N ATOM 0 H HIS A 48 -0.377 -26.523 7.674 1.00 0.00 H new ATOM 0 HA HIS A 48 -2.046 -28.206 9.171 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -0.351 -28.825 6.701 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -1.743 -29.745 7.237 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.642 -26.114 7.806 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.908 -26.924 3.862 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.072 -25.230 5.778 1.00 0.00 H new ATOM 790 N GLU A 49 1.130 -29.113 9.069 1.00 0.00 N ATOM 791 CA GLU A 49 2.129 -29.965 9.707 1.00 0.00 C ATOM 792 C GLU A 49 2.542 -29.388 11.055 1.00 0.00 C ATOM 793 O GLU A 49 3.087 -30.093 11.904 1.00 0.00 O ATOM 794 CB GLU A 49 3.359 -30.103 8.808 1.00 0.00 C ATOM 795 CG GLU A 49 2.987 -30.895 7.553 1.00 0.00 C ATOM 796 CD GLU A 49 2.659 -32.339 7.919 1.00 0.00 C ATOM 797 OE1 GLU A 49 3.097 -32.777 8.969 1.00 0.00 O ATOM 798 OE2 GLU A 49 1.975 -32.986 7.143 1.00 0.00 O ATOM 0 H GLU A 49 1.507 -28.468 8.374 1.00 0.00 H new ATOM 0 HA GLU A 49 1.688 -30.949 9.865 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.733 -29.117 8.531 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.161 -30.609 9.346 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.130 -30.433 7.063 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.812 -30.871 6.841 1.00 0.00 H new ATOM 805 N LEU A 50 2.292 -28.096 11.238 1.00 0.00 N ATOM 806 CA LEU A 50 2.655 -27.428 12.480 1.00 0.00 C ATOM 807 C LEU A 50 1.943 -28.076 13.662 1.00 0.00 C ATOM 808 O LEU A 50 2.536 -28.275 14.721 1.00 0.00 O ATOM 809 CB LEU A 50 2.263 -25.951 12.410 1.00 0.00 C ATOM 810 CG LEU A 50 2.767 -25.204 13.657 1.00 0.00 C ATOM 811 CD1 LEU A 50 4.306 -25.160 13.670 1.00 0.00 C ATOM 812 CD2 LEU A 50 2.211 -23.777 13.648 1.00 0.00 C ATOM 0 H LEU A 50 1.843 -27.495 10.547 1.00 0.00 H new ATOM 0 HA LEU A 50 3.733 -27.519 12.617 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.684 -25.498 11.512 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.179 -25.859 12.336 1.00 0.00 H new ATOM 0 HG LEU A 50 2.426 -25.728 14.550 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.647 -24.628 14.558 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.699 -26.177 13.682 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.663 -24.644 12.779 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.565 -23.243 14.530 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.550 -23.260 12.750 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.122 -23.811 13.658 1.00 0.00 H new ATOM 824 N MET A 51 0.666 -28.399 13.479 1.00 0.00 N ATOM 825 CA MET A 51 -0.107 -29.017 14.550 1.00 0.00 C ATOM 826 C MET A 51 0.627 -30.240 15.085 1.00 0.00 C ATOM 827 O MET A 51 0.705 -30.445 16.296 1.00 0.00 O ATOM 828 CB MET A 51 -1.492 -29.427 14.026 1.00 0.00 C ATOM 829 CG MET A 51 -2.299 -30.090 15.144 1.00 0.00 C ATOM 830 SD MET A 51 -3.945 -30.501 14.518 1.00 0.00 S ATOM 831 CE MET A 51 -3.445 -31.762 13.319 1.00 0.00 C ATOM 0 H MET A 51 0.151 -28.246 12.612 1.00 0.00 H new ATOM 0 HA MET A 51 -0.230 -28.296 15.358 1.00 0.00 H new ATOM 0 HB2 MET A 51 -2.023 -28.551 13.653 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.384 -30.115 13.187 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.792 -30.991 15.491 1.00 0.00 H new ATOM 0 HG3 MET A 51 -2.378 -29.419 16.000 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.263 -32.467 13.170 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.199 -31.285 12.370 1.00 0.00 H new ATOM 0 HE3 MET A 51 -2.571 -32.295 13.694 1.00 0.00 H new ATOM 841 N GLU A 52 1.164 -31.050 14.182 1.00 0.00 N ATOM 842 CA GLU A 52 1.888 -32.247 14.586 1.00 0.00 C ATOM 843 C GLU A 52 3.183 -31.880 15.304 1.00 0.00 C ATOM 844 O GLU A 52 3.528 -32.477 16.324 1.00 0.00 O ATOM 845 CB GLU A 52 2.210 -33.097 13.359 1.00 0.00 C ATOM 846 CG GLU A 52 0.912 -33.647 12.768 1.00 0.00 C ATOM 847 CD GLU A 52 1.210 -34.430 11.495 1.00 0.00 C ATOM 848 OE1 GLU A 52 2.372 -34.508 11.130 1.00 0.00 O ATOM 849 OE2 GLU A 52 0.273 -34.941 10.906 1.00 0.00 O ATOM 0 H GLU A 52 1.113 -30.902 13.174 1.00 0.00 H new ATOM 0 HA GLU A 52 1.257 -32.814 15.270 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.736 -32.498 12.616 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.873 -33.917 13.635 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.417 -34.292 13.494 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.227 -32.828 12.549 1.00 0.00 H new ATOM 856 N LEU A 53 3.899 -30.902 14.760 1.00 0.00 N ATOM 857 CA LEU A 53 5.161 -30.467 15.350 1.00 0.00 C ATOM 858 C LEU A 53 4.934 -29.891 16.744 1.00 0.00 C ATOM 859 O LEU A 53 5.696 -30.167 17.670 1.00 0.00 O ATOM 860 CB LEU A 53 5.814 -29.408 14.448 1.00 0.00 C ATOM 861 CG LEU A 53 6.504 -30.084 13.244 1.00 0.00 C ATOM 862 CD1 LEU A 53 6.611 -29.087 12.085 1.00 0.00 C ATOM 863 CD2 LEU A 53 7.918 -30.539 13.630 1.00 0.00 C ATOM 0 H LEU A 53 3.629 -30.397 13.916 1.00 0.00 H new ATOM 0 HA LEU A 53 5.822 -31.330 15.437 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.059 -28.705 14.096 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.544 -28.834 15.019 1.00 0.00 H new ATOM 0 HG LEU A 53 5.911 -30.948 12.944 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.098 -29.567 11.236 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.613 -28.760 11.793 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.198 -28.224 12.400 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.394 -31.014 12.772 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.506 -29.675 13.939 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.859 -31.251 14.453 1.00 0.00 H new ATOM 875 N ILE A 54 3.882 -29.094 16.889 1.00 0.00 N ATOM 876 CA ILE A 54 3.571 -28.491 18.178 1.00 0.00 C ATOM 877 C ILE A 54 3.249 -29.568 19.208 1.00 0.00 C ATOM 878 O ILE A 54 3.688 -29.496 20.353 1.00 0.00 O ATOM 879 CB ILE A 54 2.386 -27.527 18.042 1.00 0.00 C ATOM 880 CG1 ILE A 54 2.815 -26.277 17.246 1.00 0.00 C ATOM 881 CG2 ILE A 54 1.872 -27.124 19.430 1.00 0.00 C ATOM 882 CD1 ILE A 54 3.482 -25.232 18.157 1.00 0.00 C ATOM 0 H ILE A 54 3.236 -28.852 16.138 1.00 0.00 H new ATOM 0 HA ILE A 54 4.444 -27.933 18.516 1.00 0.00 H new ATOM 0 HB ILE A 54 1.580 -28.027 17.504 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.507 -26.567 16.455 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.944 -25.836 16.761 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.031 -26.439 19.322 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.549 -28.014 19.971 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.671 -26.632 19.985 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.772 -24.364 17.564 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.780 -24.924 18.932 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.367 -25.666 18.621 1.00 0.00 H new ATOM 894 N ASP A 55 2.476 -30.561 18.796 1.00 0.00 N ATOM 895 CA ASP A 55 2.093 -31.629 19.698 1.00 0.00 C ATOM 896 C ASP A 55 3.327 -32.340 20.228 1.00 0.00 C ATOM 897 O ASP A 55 3.390 -32.703 21.402 1.00 0.00 O ATOM 898 CB ASP A 55 1.197 -32.629 18.968 1.00 0.00 C ATOM 899 CG ASP A 55 0.799 -33.762 19.908 1.00 0.00 C ATOM 900 OD1 ASP A 55 1.283 -33.773 21.028 1.00 0.00 O ATOM 901 OD2 ASP A 55 0.023 -34.604 19.492 1.00 0.00 O ATOM 0 H ASP A 55 2.105 -30.647 17.850 1.00 0.00 H new ATOM 0 HA ASP A 55 1.546 -31.199 20.537 1.00 0.00 H new ATOM 0 HB2 ASP A 55 0.305 -32.125 18.596 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.720 -33.032 18.101 1.00 0.00 H new ATOM 906 N LEU A 56 4.302 -32.545 19.358 1.00 0.00 N ATOM 907 CA LEU A 56 5.521 -33.222 19.758 1.00 0.00 C ATOM 908 C LEU A 56 6.274 -32.411 20.812 1.00 0.00 C ATOM 909 O LEU A 56 6.795 -32.968 21.780 1.00 0.00 O ATOM 910 CB LEU A 56 6.418 -33.451 18.540 1.00 0.00 C ATOM 911 CG LEU A 56 5.768 -34.472 17.593 1.00 0.00 C ATOM 912 CD1 LEU A 56 6.548 -34.492 16.277 1.00 0.00 C ATOM 913 CD2 LEU A 56 5.776 -35.879 18.223 1.00 0.00 C ATOM 0 H LEU A 56 4.273 -32.255 18.380 1.00 0.00 H new ATOM 0 HA LEU A 56 5.250 -34.184 20.192 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.581 -32.509 18.016 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.396 -33.811 18.861 1.00 0.00 H new ATOM 0 HG LEU A 56 4.733 -34.184 17.411 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.095 -35.214 15.597 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.523 -33.501 15.824 1.00 0.00 H new ATOM 0 HD13 LEU A 56 7.582 -34.776 16.471 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.311 -36.587 17.537 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.804 -36.184 18.419 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.218 -35.862 19.159 1.00 0.00 H new ATOM 925 N TYR A 57 6.332 -31.095 20.620 1.00 0.00 N ATOM 926 CA TYR A 57 7.027 -30.221 21.560 1.00 0.00 C ATOM 927 C TYR A 57 6.154 -29.913 22.770 1.00 0.00 C ATOM 928 O TYR A 57 6.528 -30.207 23.901 1.00 0.00 O ATOM 929 CB TYR A 57 7.421 -28.912 20.867 1.00 0.00 C ATOM 930 CG TYR A 57 8.607 -29.155 19.961 1.00 0.00 C ATOM 931 CD1 TYR A 57 9.843 -29.500 20.518 1.00 0.00 C ATOM 932 CD2 TYR A 57 8.471 -29.040 18.572 1.00 0.00 C ATOM 933 CE1 TYR A 57 10.945 -29.728 19.687 1.00 0.00 C ATOM 934 CE2 TYR A 57 9.572 -29.269 17.742 1.00 0.00 C ATOM 935 CZ TYR A 57 10.810 -29.613 18.300 1.00 0.00 C ATOM 936 OH TYR A 57 11.897 -29.836 17.481 1.00 0.00 O ATOM 0 H TYR A 57 5.909 -30.613 19.827 1.00 0.00 H new ATOM 0 HA TYR A 57 7.923 -30.739 21.902 1.00 0.00 H new ATOM 0 HB2 TYR A 57 6.581 -28.528 20.288 1.00 0.00 H new ATOM 0 HB3 TYR A 57 7.668 -28.155 21.611 1.00 0.00 H new ATOM 0 HD1 TYR A 57 9.946 -29.590 21.589 1.00 0.00 H new ATOM 0 HD2 TYR A 57 7.516 -28.775 18.143 1.00 0.00 H new ATOM 0 HE1 TYR A 57 11.900 -29.993 20.117 1.00 0.00 H new ATOM 0 HE2 TYR A 57 9.468 -29.181 16.671 1.00 0.00 H new ATOM 0 HH TYR A 57 11.632 -29.716 16.545 1.00 0.00 H new ATOM 946 N GLU A 58 4.994 -29.310 22.527 1.00 0.00 N ATOM 947 CA GLU A 58 4.088 -28.953 23.615 1.00 0.00 C ATOM 948 C GLU A 58 3.990 -30.094 24.622 1.00 0.00 C ATOM 949 O GLU A 58 3.592 -29.890 25.758 1.00 0.00 O ATOM 950 CB GLU A 58 2.684 -28.601 23.060 1.00 0.00 C ATOM 951 CG GLU A 58 1.771 -29.837 23.055 1.00 0.00 C ATOM 952 CD GLU A 58 0.502 -29.558 22.263 1.00 0.00 C ATOM 953 OE1 GLU A 58 0.290 -28.416 21.896 1.00 0.00 O ATOM 954 OE2 GLU A 58 -0.243 -30.497 22.042 1.00 0.00 O ATOM 0 H GLU A 58 4.661 -29.060 21.596 1.00 0.00 H new ATOM 0 HA GLU A 58 4.489 -28.075 24.123 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.235 -27.815 23.667 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.777 -28.208 22.047 1.00 0.00 H new ATOM 0 HG2 GLU A 58 2.299 -30.685 22.620 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.515 -30.112 24.078 1.00 0.00 H new ATOM 961 N GLU A 59 4.305 -31.303 24.183 1.00 0.00 N ATOM 962 CA GLU A 59 4.214 -32.464 25.060 1.00 0.00 C ATOM 963 C GLU A 59 5.472 -32.590 25.917 1.00 0.00 C ATOM 964 O GLU A 59 5.395 -32.902 27.106 1.00 0.00 O ATOM 965 CB GLU A 59 4.014 -33.729 24.217 1.00 0.00 C ATOM 966 CG GLU A 59 3.754 -34.931 25.129 1.00 0.00 C ATOM 967 CD GLU A 59 2.394 -34.786 25.805 1.00 0.00 C ATOM 968 OE1 GLU A 59 1.650 -33.902 25.413 1.00 0.00 O ATOM 969 OE2 GLU A 59 2.119 -35.558 26.709 1.00 0.00 O ATOM 0 H GLU A 59 4.623 -31.507 23.235 1.00 0.00 H new ATOM 0 HA GLU A 59 3.361 -32.338 25.727 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.175 -33.592 23.534 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.897 -33.911 23.605 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.784 -35.853 24.548 1.00 0.00 H new ATOM 0 HG3 GLU A 59 4.538 -35.003 25.882 1.00 0.00 H new ATOM 976 N SER A 60 6.630 -32.358 25.305 1.00 0.00 N ATOM 977 CA SER A 60 7.905 -32.459 26.014 1.00 0.00 C ATOM 978 C SER A 60 8.336 -31.111 26.607 1.00 0.00 C ATOM 979 O SER A 60 9.203 -31.062 27.481 1.00 0.00 O ATOM 980 CB SER A 60 8.983 -32.957 25.048 1.00 0.00 C ATOM 981 OG SER A 60 10.149 -33.311 25.779 1.00 0.00 O ATOM 0 H SER A 60 6.713 -32.099 24.322 1.00 0.00 H new ATOM 0 HA SER A 60 7.777 -33.162 26.838 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.616 -33.818 24.490 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.219 -32.182 24.319 1.00 0.00 H new ATOM 0 HG SER A 60 10.197 -32.775 26.598 1.00 0.00 H new ATOM 987 N GLN A 61 7.746 -30.021 26.115 1.00 0.00 N ATOM 988 CA GLN A 61 8.099 -28.674 26.585 1.00 0.00 C ATOM 989 C GLN A 61 7.656 -28.442 28.034 1.00 0.00 C ATOM 990 O GLN A 61 8.395 -27.871 28.831 1.00 0.00 O ATOM 991 CB GLN A 61 7.462 -27.607 25.654 1.00 0.00 C ATOM 992 CG GLN A 61 8.520 -26.608 25.174 1.00 0.00 C ATOM 993 CD GLN A 61 9.402 -27.266 24.121 1.00 0.00 C ATOM 994 OE1 GLN A 61 9.513 -28.491 24.081 1.00 0.00 O ATOM 995 NE2 GLN A 61 10.041 -26.522 23.264 1.00 0.00 N ATOM 0 H GLN A 61 7.024 -30.040 25.394 1.00 0.00 H new ATOM 0 HA GLN A 61 9.185 -28.584 26.555 1.00 0.00 H new ATOM 0 HB2 GLN A 61 6.999 -28.095 24.796 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.670 -27.079 26.186 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.038 -25.724 24.758 1.00 0.00 H new ATOM 0 HG3 GLN A 61 9.128 -26.274 26.015 1.00 0.00 H new ATOM 0 HE21 GLN A 61 9.947 -25.507 23.300 1.00 0.00 H new ATOM 0 HE22 GLN A 61 10.636 -26.954 22.557 1.00 0.00 H new ATOM 1004 N PRO A 62 6.471 -28.862 28.385 1.00 0.00 N ATOM 1005 CA PRO A 62 5.920 -28.693 29.746 1.00 0.00 C ATOM 1006 C PRO A 62 5.955 -29.987 30.553 1.00 0.00 C ATOM 1007 O PRO A 62 5.038 -30.810 30.506 1.00 0.00 O ATOM 1008 CB PRO A 62 4.473 -28.298 29.439 1.00 0.00 C ATOM 1009 CG PRO A 62 4.141 -29.006 28.139 1.00 0.00 C ATOM 1010 CD PRO A 62 5.480 -29.493 27.526 1.00 0.00 C ATOM 0 HA PRO A 62 6.479 -27.977 30.348 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.801 -28.607 30.240 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.372 -27.217 29.337 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.472 -29.847 28.319 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.627 -28.331 27.454 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.562 -30.580 27.543 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.587 -29.182 26.487 1.00 0.00 H new ATOM 1018 N SER A 63 7.038 -30.128 31.298 1.00 0.00 N ATOM 1019 CA SER A 63 7.252 -31.282 32.151 1.00 0.00 C ATOM 1020 C SER A 63 6.209 -31.313 33.264 1.00 0.00 C ATOM 1021 O SER A 63 5.967 -32.352 33.875 1.00 0.00 O ATOM 1022 CB SER A 63 8.655 -31.212 32.758 1.00 0.00 C ATOM 1023 OG SER A 63 8.787 -30.000 33.491 1.00 0.00 O ATOM 0 H SER A 63 7.794 -29.444 31.328 1.00 0.00 H new ATOM 0 HA SER A 63 7.157 -32.190 31.556 1.00 0.00 H new ATOM 0 HB2 SER A 63 8.824 -32.067 33.412 1.00 0.00 H new ATOM 0 HB3 SER A 63 9.408 -31.259 31.971 1.00 0.00 H new ATOM 0 HG SER A 63 9.684 -29.951 33.883 1.00 0.00 H new ATOM 1029 N SER A 64 5.592 -30.159 33.520 1.00 0.00 N ATOM 1030 CA SER A 64 4.573 -30.054 34.563 1.00 0.00 C ATOM 1031 C SER A 64 3.203 -30.441 34.014 1.00 0.00 C ATOM 1032 O SER A 64 2.173 -30.073 34.579 1.00 0.00 O ATOM 1033 CB SER A 64 4.520 -28.626 35.108 1.00 0.00 C ATOM 1034 OG SER A 64 5.805 -28.262 35.599 1.00 0.00 O ATOM 0 H SER A 64 5.779 -29.289 33.022 1.00 0.00 H new ATOM 0 HA SER A 64 4.838 -30.738 35.369 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.209 -27.936 34.323 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.780 -28.556 35.905 1.00 0.00 H new ATOM 0 HG SER A 64 5.775 -27.347 35.947 1.00 0.00 H new ATOM 1040 N GLU A 65 3.199 -31.182 32.910 1.00 0.00 N ATOM 1041 CA GLU A 65 1.949 -31.613 32.291 1.00 0.00 C ATOM 1042 C GLU A 65 1.063 -30.411 31.983 1.00 0.00 C ATOM 1043 O GLU A 65 -0.161 -30.484 32.078 1.00 0.00 O ATOM 1044 CB GLU A 65 1.209 -32.580 33.218 1.00 0.00 C ATOM 1045 CG GLU A 65 2.003 -33.884 33.330 1.00 0.00 C ATOM 1046 CD GLU A 65 2.004 -34.620 31.993 1.00 0.00 C ATOM 1047 OE1 GLU A 65 0.928 -34.851 31.467 1.00 0.00 O ATOM 1048 OE2 GLU A 65 3.080 -34.939 31.516 1.00 0.00 O ATOM 0 H GLU A 65 4.041 -31.495 32.428 1.00 0.00 H new ATOM 0 HA GLU A 65 2.184 -32.123 31.357 1.00 0.00 H new ATOM 0 HB2 GLU A 65 1.083 -32.132 34.204 1.00 0.00 H new ATOM 0 HB3 GLU A 65 0.211 -32.781 32.830 1.00 0.00 H new ATOM 0 HG2 GLU A 65 3.027 -33.669 33.635 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.567 -34.518 34.102 1.00 0.00 H new ATOM 1055 N ARG A 66 1.699 -29.300 31.620 1.00 0.00 N ATOM 1056 CA ARG A 66 0.976 -28.073 31.303 1.00 0.00 C ATOM 1057 C ARG A 66 0.419 -28.105 29.882 1.00 0.00 C ATOM 1058 O ARG A 66 -0.403 -27.265 29.517 1.00 0.00 O ATOM 1059 CB ARG A 66 1.887 -26.847 31.478 1.00 0.00 C ATOM 1060 CG ARG A 66 1.033 -25.586 31.729 1.00 0.00 C ATOM 1061 CD ARG A 66 0.723 -25.449 33.226 1.00 0.00 C ATOM 1062 NE ARG A 66 -0.150 -24.307 33.458 1.00 0.00 N ATOM 1063 CZ ARG A 66 -0.565 -24.003 34.682 1.00 0.00 C ATOM 1064 NH1 ARG A 66 -0.209 -24.748 35.693 1.00 0.00 N ATOM 1065 NH2 ARG A 66 -1.333 -22.965 34.873 1.00 0.00 N ATOM 0 H ARG A 66 2.713 -29.225 31.538 1.00 0.00 H new ATOM 0 HA ARG A 66 0.139 -27.998 31.997 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.569 -27.007 32.313 1.00 0.00 H new ATOM 0 HB3 ARG A 66 2.500 -26.709 30.588 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.564 -24.702 31.377 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.104 -25.647 31.161 1.00 0.00 H new ATOM 0 HD2 ARG A 66 0.247 -26.359 33.591 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.650 -25.327 33.787 1.00 0.00 H new ATOM 0 HE ARG A 66 -0.447 -23.733 32.669 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.387 -25.562 35.542 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -0.527 -24.516 36.634 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -1.615 -22.387 34.082 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -1.651 -22.732 35.814 1.00 0.00 H new ATOM 1079 N LEU A 67 0.883 -29.062 29.076 1.00 0.00 N ATOM 1080 CA LEU A 67 0.428 -29.169 27.689 1.00 0.00 C ATOM 1081 C LEU A 67 -1.072 -28.907 27.586 1.00 0.00 C ATOM 1082 O LEU A 67 -1.581 -28.571 26.516 1.00 0.00 O ATOM 1083 CB LEU A 67 0.729 -30.569 27.139 1.00 0.00 C ATOM 1084 CG LEU A 67 0.276 -31.654 28.159 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -0.666 -32.658 27.485 1.00 0.00 C ATOM 1086 CD2 LEU A 67 1.502 -32.404 28.701 1.00 0.00 C ATOM 0 H LEU A 67 1.566 -29.766 29.356 1.00 0.00 H new ATOM 0 HA LEU A 67 0.962 -28.420 27.104 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.213 -30.714 26.190 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.796 -30.668 26.941 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.248 -31.161 28.978 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.975 -33.411 28.210 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.545 -32.136 27.108 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.149 -33.143 26.657 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.179 -33.162 29.414 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.029 -32.883 27.876 1.00 0.00 H new ATOM 0 HD23 LEU A 67 2.169 -31.700 29.198 1.00 0.00 H new ATOM 1098 N ASN A 68 -1.771 -29.050 28.705 1.00 0.00 N ATOM 1099 CA ASN A 68 -3.204 -28.815 28.726 1.00 0.00 C ATOM 1100 C ASN A 68 -3.503 -27.389 28.275 1.00 0.00 C ATOM 1101 O ASN A 68 -4.424 -27.154 27.494 1.00 0.00 O ATOM 1102 CB ASN A 68 -3.741 -29.033 30.142 1.00 0.00 C ATOM 1103 CG ASN A 68 -3.198 -27.957 31.078 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -3.590 -26.794 30.981 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -2.314 -28.275 31.985 1.00 0.00 N ATOM 0 H ASN A 68 -1.370 -29.325 29.602 1.00 0.00 H new ATOM 0 HA ASN A 68 -3.691 -29.513 28.045 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.831 -29.004 30.135 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.451 -30.020 30.502 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -1.948 -27.560 32.613 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -1.989 -29.239 32.065 1.00 0.00 H new ATOM 1112 N ALA A 69 -2.710 -26.441 28.762 1.00 0.00 N ATOM 1113 CA ALA A 69 -2.889 -25.043 28.388 1.00 0.00 C ATOM 1114 C ALA A 69 -2.510 -24.835 26.924 1.00 0.00 C ATOM 1115 O ALA A 69 -3.160 -24.078 26.204 1.00 0.00 O ATOM 1116 CB ALA A 69 -2.028 -24.143 29.278 1.00 0.00 C ATOM 0 H ALA A 69 -1.943 -26.613 29.412 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.938 -24.779 28.524 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.171 -23.102 28.989 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.321 -24.274 30.320 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.978 -24.412 29.160 1.00 0.00 H new ATOM 1122 N PHE A 70 -1.451 -25.518 26.495 1.00 0.00 N ATOM 1123 CA PHE A 70 -0.985 -25.410 25.116 1.00 0.00 C ATOM 1124 C PHE A 70 -2.000 -26.021 24.162 1.00 0.00 C ATOM 1125 O PHE A 70 -2.071 -25.645 22.993 1.00 0.00 O ATOM 1126 CB PHE A 70 0.360 -26.116 24.955 1.00 0.00 C ATOM 1127 CG PHE A 70 1.434 -25.335 25.678 1.00 0.00 C ATOM 1128 CD1 PHE A 70 1.617 -25.497 27.057 1.00 0.00 C ATOM 1129 CD2 PHE A 70 2.247 -24.444 24.967 1.00 0.00 C ATOM 1130 CE1 PHE A 70 2.613 -24.772 27.722 1.00 0.00 C ATOM 1131 CE2 PHE A 70 3.242 -23.719 25.632 1.00 0.00 C ATOM 1132 CZ PHE A 70 3.426 -23.883 27.010 1.00 0.00 C ATOM 0 H PHE A 70 -0.902 -26.149 27.079 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.866 -24.353 24.877 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.301 -27.128 25.355 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.611 -26.205 23.898 1.00 0.00 H new ATOM 0 HD1 PHE A 70 0.989 -26.182 27.608 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.106 -24.316 23.904 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.754 -24.899 28.785 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.868 -23.032 25.082 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.195 -23.324 27.523 1.00 0.00 H new ATOM 1142 N ARG A 71 -2.786 -26.966 24.667 1.00 0.00 N ATOM 1143 CA ARG A 71 -3.796 -27.617 23.846 1.00 0.00 C ATOM 1144 C ARG A 71 -4.606 -26.572 23.090 1.00 0.00 C ATOM 1145 O ARG A 71 -5.134 -26.840 22.011 1.00 0.00 O ATOM 1146 CB ARG A 71 -4.724 -28.453 24.726 1.00 0.00 C ATOM 1147 CG ARG A 71 -5.731 -29.201 23.852 1.00 0.00 C ATOM 1148 CD ARG A 71 -6.627 -30.066 24.736 1.00 0.00 C ATOM 1149 NE ARG A 71 -7.530 -30.860 23.909 1.00 0.00 N ATOM 1150 CZ ARG A 71 -7.159 -32.038 23.413 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -5.962 -32.500 23.652 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -7.991 -32.727 22.683 1.00 0.00 N ATOM 0 H ARG A 71 -2.743 -27.295 25.632 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.300 -28.270 23.128 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.141 -29.162 25.314 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.249 -27.809 25.432 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.335 -28.492 23.286 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.207 -29.824 23.126 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.016 -30.723 25.355 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -7.202 -29.434 25.413 1.00 0.00 H new ATOM 0 HE ARG A 71 -8.465 -30.505 23.707 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.310 -31.958 24.219 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.678 -33.403 23.272 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.925 -32.363 22.493 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.708 -33.630 22.302 1.00 0.00 H new ATOM 1166 N GLU A 72 -4.686 -25.375 23.658 1.00 0.00 N ATOM 1167 CA GLU A 72 -5.415 -24.292 23.019 1.00 0.00 C ATOM 1168 C GLU A 72 -4.713 -23.882 21.732 1.00 0.00 C ATOM 1169 O GLU A 72 -5.351 -23.478 20.765 1.00 0.00 O ATOM 1170 CB GLU A 72 -5.505 -23.089 23.957 1.00 0.00 C ATOM 1171 CG GLU A 72 -6.387 -23.440 25.155 1.00 0.00 C ATOM 1172 CD GLU A 72 -7.834 -23.614 24.706 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -8.173 -23.094 23.655 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -8.580 -24.267 25.416 1.00 0.00 O ATOM 0 H GLU A 72 -4.258 -25.133 24.552 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.422 -24.639 22.787 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.509 -22.804 24.296 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -5.919 -22.231 23.427 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.030 -24.358 25.623 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.323 -22.653 25.907 1.00 0.00 H new ATOM 1181 N LEU A 73 -3.389 -23.982 21.734 1.00 0.00 N ATOM 1182 CA LEU A 73 -2.611 -23.617 20.561 1.00 0.00 C ATOM 1183 C LEU A 73 -2.995 -24.521 19.392 1.00 0.00 C ATOM 1184 O LEU A 73 -3.202 -24.057 18.277 1.00 0.00 O ATOM 1185 CB LEU A 73 -1.109 -23.765 20.872 1.00 0.00 C ATOM 1186 CG LEU A 73 -0.271 -22.787 20.023 1.00 0.00 C ATOM 1187 CD1 LEU A 73 -0.577 -22.978 18.531 1.00 0.00 C ATOM 1188 CD2 LEU A 73 -0.570 -21.326 20.440 1.00 0.00 C ATOM 0 H LEU A 73 -2.838 -24.310 22.527 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.819 -22.581 20.293 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.933 -23.576 21.931 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.792 -24.789 20.673 1.00 0.00 H new ATOM 0 HG LEU A 73 0.785 -22.996 20.195 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.022 -22.281 17.945 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -0.335 -24.000 18.238 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.635 -22.789 18.349 1.00 0.00 H new ATOM 0 HD21 LEU A 73 0.027 -20.645 19.834 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.628 -21.114 20.288 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -0.320 -21.189 21.492 1.00 0.00 H new ATOM 1200 N ARG A 74 -3.105 -25.817 19.665 1.00 0.00 N ATOM 1201 CA ARG A 74 -3.472 -26.774 18.630 1.00 0.00 C ATOM 1202 C ARG A 74 -4.833 -26.423 18.059 1.00 0.00 C ATOM 1203 O ARG A 74 -5.100 -26.646 16.878 1.00 0.00 O ATOM 1204 CB ARG A 74 -3.500 -28.196 19.191 1.00 0.00 C ATOM 1205 CG ARG A 74 -2.070 -28.656 19.473 1.00 0.00 C ATOM 1206 CD ARG A 74 -2.084 -30.118 19.913 1.00 0.00 C ATOM 1207 NE ARG A 74 -2.630 -30.237 21.260 1.00 0.00 N ATOM 1208 CZ ARG A 74 -2.794 -31.425 21.831 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -2.461 -32.510 21.186 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -3.288 -31.508 23.036 1.00 0.00 N ATOM 0 H ARG A 74 -2.947 -26.225 20.586 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.723 -26.727 17.839 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -4.091 -28.227 20.106 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.978 -28.870 18.480 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -1.456 -28.540 18.580 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.623 -28.035 20.250 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -2.681 -30.708 19.218 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -1.072 -30.522 19.887 1.00 0.00 H new ATOM 0 HE ARG A 74 -2.890 -29.394 21.772 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.075 -32.445 20.244 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -2.587 -33.423 21.624 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -3.548 -30.660 23.540 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -3.414 -32.421 23.474 1.00 0.00 H new ATOM 1224 N THR A 75 -5.687 -25.868 18.902 1.00 0.00 N ATOM 1225 CA THR A 75 -7.016 -25.487 18.467 1.00 0.00 C ATOM 1226 C THR A 75 -6.932 -24.465 17.338 1.00 0.00 C ATOM 1227 O THR A 75 -7.647 -24.567 16.345 1.00 0.00 O ATOM 1228 CB THR A 75 -7.795 -24.898 19.631 1.00 0.00 C ATOM 1229 OG1 THR A 75 -7.639 -25.726 20.776 1.00 0.00 O ATOM 1230 CG2 THR A 75 -9.272 -24.807 19.263 1.00 0.00 C ATOM 0 H THR A 75 -5.485 -25.673 19.883 1.00 0.00 H new ATOM 0 HA THR A 75 -7.530 -26.376 18.102 1.00 0.00 H new ATOM 0 HB THR A 75 -7.416 -23.900 19.852 1.00 0.00 H new ATOM 0 HG1 THR A 75 -8.140 -25.344 21.527 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.830 -24.384 20.099 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.390 -24.168 18.388 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.653 -25.803 19.039 1.00 0.00 H new ATOM 1238 N GLN A 76 -6.052 -23.480 17.496 1.00 0.00 N ATOM 1239 CA GLN A 76 -5.890 -22.450 16.477 1.00 0.00 C ATOM 1240 C GLN A 76 -5.476 -23.087 15.152 1.00 0.00 C ATOM 1241 O GLN A 76 -6.041 -22.781 14.102 1.00 0.00 O ATOM 1242 CB GLN A 76 -4.823 -21.439 16.926 1.00 0.00 C ATOM 1243 CG GLN A 76 -5.440 -20.423 17.893 1.00 0.00 C ATOM 1244 CD GLN A 76 -5.940 -21.129 19.148 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -7.027 -21.705 19.145 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -5.205 -21.120 20.226 1.00 0.00 N ATOM 0 H GLN A 76 -5.447 -23.374 18.310 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.839 -21.932 16.340 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.997 -21.960 17.411 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.410 -20.924 16.059 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.700 -19.669 18.161 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.265 -19.901 17.407 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.304 -20.641 20.225 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.531 -21.592 21.070 1.00 0.00 H new ATOM 1255 N LEU A 77 -4.494 -23.981 15.212 1.00 0.00 N ATOM 1256 CA LEU A 77 -4.021 -24.665 14.013 1.00 0.00 C ATOM 1257 C LEU A 77 -5.140 -25.518 13.425 1.00 0.00 C ATOM 1258 O LEU A 77 -5.348 -25.544 12.212 1.00 0.00 O ATOM 1259 CB LEU A 77 -2.818 -25.550 14.366 1.00 0.00 C ATOM 1260 CG LEU A 77 -1.537 -24.702 14.427 1.00 0.00 C ATOM 1261 CD1 LEU A 77 -1.766 -23.460 15.294 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -0.400 -25.534 15.031 1.00 0.00 C ATOM 0 H LEU A 77 -4.013 -24.248 16.071 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.717 -23.924 13.274 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.986 -26.039 15.326 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.706 -26.339 13.622 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.272 -24.391 13.416 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.852 -22.868 15.330 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.570 -22.861 14.867 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.039 -23.766 16.304 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.508 -24.932 15.074 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.675 -25.849 16.038 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.224 -26.413 14.411 1.00 0.00 H new ATOM 1274 N GLU A 78 -5.865 -26.207 14.299 1.00 0.00 N ATOM 1275 CA GLU A 78 -6.972 -27.050 13.865 1.00 0.00 C ATOM 1276 C GLU A 78 -8.100 -26.198 13.293 1.00 0.00 C ATOM 1277 O GLU A 78 -8.709 -26.555 12.285 1.00 0.00 O ATOM 1278 CB GLU A 78 -7.489 -27.868 15.048 1.00 0.00 C ATOM 1279 CG GLU A 78 -6.498 -28.978 15.389 1.00 0.00 C ATOM 1280 CD GLU A 78 -6.938 -29.698 16.659 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -8.004 -29.376 17.159 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -6.205 -30.561 17.113 1.00 0.00 O ATOM 0 H GLU A 78 -5.707 -26.199 15.307 1.00 0.00 H new ATOM 0 HA GLU A 78 -6.616 -27.723 13.085 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.634 -27.220 15.913 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.461 -28.299 14.806 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.434 -29.686 14.563 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.502 -28.558 15.526 1.00 0.00 H new ATOM 1289 N LYS A 79 -8.366 -25.064 13.936 1.00 0.00 N ATOM 1290 CA LYS A 79 -9.409 -24.160 13.476 1.00 0.00 C ATOM 1291 C LYS A 79 -9.032 -23.582 12.126 1.00 0.00 C ATOM 1292 O LYS A 79 -9.858 -23.498 11.219 1.00 0.00 O ATOM 1293 CB LYS A 79 -9.603 -23.026 14.487 1.00 0.00 C ATOM 1294 CG LYS A 79 -10.305 -23.551 15.751 1.00 0.00 C ATOM 1295 CD LYS A 79 -11.826 -23.569 15.549 1.00 0.00 C ATOM 1296 CE LYS A 79 -12.501 -23.997 16.852 1.00 0.00 C ATOM 1297 NZ LYS A 79 -12.245 -25.446 17.093 1.00 0.00 N ATOM 0 H LYS A 79 -7.874 -24.753 14.774 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.342 -24.716 13.381 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.637 -22.596 14.751 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -10.195 -22.228 14.039 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.950 -24.556 15.981 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.052 -22.921 16.604 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.177 -22.581 15.251 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.090 -24.257 14.746 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.117 -23.406 17.684 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -13.574 -23.811 16.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -12.874 -25.789 17.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.427 -25.981 16.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -11.255 -25.580 17.381 1.00 0.00 H new ATOM 1311 N ALA A 80 -7.773 -23.190 11.999 1.00 0.00 N ATOM 1312 CA ALA A 80 -7.299 -22.628 10.747 1.00 0.00 C ATOM 1313 C ALA A 80 -7.405 -23.665 9.636 1.00 0.00 C ATOM 1314 O ALA A 80 -7.516 -23.322 8.460 1.00 0.00 O ATOM 1315 CB ALA A 80 -5.848 -22.166 10.880 1.00 0.00 C ATOM 0 H ALA A 80 -7.071 -23.250 12.737 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.921 -21.768 10.500 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.511 -21.748 9.932 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.778 -21.405 11.657 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.219 -23.015 11.146 1.00 0.00 H new ATOM 1321 N LEU A 81 -7.362 -24.937 10.022 1.00 0.00 N ATOM 1322 CA LEU A 81 -7.448 -26.023 9.055 1.00 0.00 C ATOM 1323 C LEU A 81 -8.800 -25.983 8.346 1.00 0.00 C ATOM 1324 O LEU A 81 -8.888 -26.221 7.143 1.00 0.00 O ATOM 1325 CB LEU A 81 -7.257 -27.377 9.768 1.00 0.00 C ATOM 1326 CG LEU A 81 -6.566 -28.388 8.832 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -7.354 -28.509 7.517 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -5.116 -27.931 8.534 1.00 0.00 C ATOM 0 H LEU A 81 -7.269 -25.238 10.992 1.00 0.00 H new ATOM 0 HA LEU A 81 -6.659 -25.904 8.312 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.659 -27.239 10.669 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -8.224 -27.768 10.084 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.538 -29.361 9.323 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.859 -29.225 6.861 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -8.367 -28.851 7.730 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.395 -27.536 7.027 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.636 -28.652 7.872 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.134 -26.953 8.053 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.556 -27.866 9.467 1.00 0.00 H new ATOM 1340 N GLY A 82 -9.851 -25.674 9.099 1.00 0.00 N ATOM 1341 CA GLY A 82 -11.188 -25.603 8.522 1.00 0.00 C ATOM 1342 C GLY A 82 -11.268 -24.481 7.489 1.00 0.00 C ATOM 1343 O GLY A 82 -12.345 -24.171 6.982 1.00 0.00 O ATOM 0 H GLY A 82 -9.804 -25.471 10.098 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.439 -26.555 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -11.922 -25.432 9.310 1.00 0.00 H new ATOM 1347 N LEU A 83 -10.118 -23.886 7.181 1.00 0.00 N ATOM 1348 CA LEU A 83 -10.054 -22.808 6.202 1.00 0.00 C ATOM 1349 C LEU A 83 -10.931 -21.642 6.635 1.00 0.00 C ATOM 1350 O LEU A 83 -11.681 -21.084 5.836 1.00 0.00 O ATOM 1351 CB LEU A 83 -10.507 -23.322 4.831 1.00 0.00 C ATOM 1352 CG LEU A 83 -9.710 -24.579 4.460 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -10.182 -25.096 3.098 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -8.206 -24.255 4.400 1.00 0.00 C ATOM 0 H LEU A 83 -9.219 -24.133 7.596 1.00 0.00 H new ATOM 0 HA LEU A 83 -9.023 -22.460 6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -11.573 -23.549 4.851 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.359 -22.550 4.076 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.875 -25.344 5.219 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -9.617 -25.989 2.832 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -11.243 -25.340 3.149 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -10.022 -24.327 2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -7.650 -25.155 4.136 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -8.029 -23.486 3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.872 -23.895 5.373 1.00 0.00 H new ATOM 1366 N GLU A 84 -10.824 -21.274 7.906 1.00 0.00 N ATOM 1367 CA GLU A 84 -11.606 -20.167 8.437 1.00 0.00 C ATOM 1368 C GLU A 84 -11.182 -18.860 7.776 1.00 0.00 C ATOM 1369 O GLU A 84 -9.992 -18.579 7.642 1.00 0.00 O ATOM 1370 CB GLU A 84 -11.408 -20.068 9.953 1.00 0.00 C ATOM 1371 CG GLU A 84 -11.964 -21.324 10.629 1.00 0.00 C ATOM 1372 CD GLU A 84 -13.478 -21.390 10.456 1.00 0.00 C ATOM 1373 OE1 GLU A 84 -14.068 -20.360 10.174 1.00 0.00 O ATOM 1374 OE2 GLU A 84 -14.025 -22.470 10.608 1.00 0.00 O ATOM 0 H GLU A 84 -10.208 -21.723 8.583 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.660 -20.347 8.224 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -10.349 -19.957 10.185 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.913 -19.182 10.338 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.502 -22.212 10.198 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.712 -21.317 11.689 1.00 0.00 H new ATOM 1381 N HIS A 85 -12.165 -18.069 7.360 1.00 0.00 N ATOM 1382 CA HIS A 85 -11.885 -16.796 6.707 1.00 0.00 C ATOM 1383 C HIS A 85 -11.021 -17.008 5.467 1.00 0.00 C ATOM 1384 O HIS A 85 -9.829 -16.694 5.464 1.00 0.00 O ATOM 1385 CB HIS A 85 -11.169 -15.858 7.680 1.00 0.00 C ATOM 1386 CG HIS A 85 -11.044 -14.494 7.059 1.00 0.00 C ATOM 1387 ND1 HIS A 85 -12.150 -13.713 6.764 1.00 0.00 N ATOM 1388 CD2 HIS A 85 -9.951 -13.758 6.675 1.00 0.00 C ATOM 1389 CE1 HIS A 85 -11.703 -12.564 6.227 1.00 0.00 C ATOM 1390 NE2 HIS A 85 -10.370 -12.539 6.149 1.00 0.00 N ATOM 0 H HIS A 85 -13.157 -18.285 7.462 1.00 0.00 H new ATOM 0 HA HIS A 85 -12.831 -16.348 6.402 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -11.724 -15.794 8.616 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -10.182 -16.252 7.922 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.923 -14.076 6.767 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -12.344 -11.759 5.899 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -9.785 -11.788 5.783 1.00 0.00 H new ATOM 1398 N HIS A 86 -11.632 -17.544 4.413 1.00 0.00 N ATOM 1399 CA HIS A 86 -10.922 -17.800 3.159 1.00 0.00 C ATOM 1400 C HIS A 86 -11.874 -17.655 1.972 1.00 0.00 C ATOM 1401 O HIS A 86 -13.072 -17.432 2.147 1.00 0.00 O ATOM 1402 CB HIS A 86 -10.310 -19.215 3.178 1.00 0.00 C ATOM 1403 CG HIS A 86 -8.951 -19.181 3.834 1.00 0.00 C ATOM 1404 ND1 HIS A 86 -7.820 -18.746 3.159 1.00 0.00 N ATOM 1405 CD2 HIS A 86 -8.528 -19.516 5.095 1.00 0.00 C ATOM 1406 CE1 HIS A 86 -6.781 -18.831 4.010 1.00 0.00 C ATOM 1407 NE2 HIS A 86 -7.157 -19.293 5.204 1.00 0.00 N ATOM 0 H HIS A 86 -12.617 -17.810 4.401 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.120 -17.069 3.055 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -10.967 -19.897 3.718 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -10.222 -19.596 2.161 1.00 0.00 H new ATOM 0 HD1 HIS A 86 -7.783 -18.421 2.193 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -9.161 -19.895 5.883 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -5.767 -18.559 3.757 1.00 0.00 H new ATOM 1415 N HIS A 87 -11.328 -17.784 0.766 1.00 0.00 N ATOM 1416 CA HIS A 87 -12.132 -17.665 -0.445 1.00 0.00 C ATOM 1417 C HIS A 87 -13.053 -18.870 -0.592 1.00 0.00 C ATOM 1418 O HIS A 87 -12.797 -19.935 -0.029 1.00 0.00 O ATOM 1419 CB HIS A 87 -11.220 -17.570 -1.670 1.00 0.00 C ATOM 1420 CG HIS A 87 -10.378 -16.327 -1.582 1.00 0.00 C ATOM 1421 ND1 HIS A 87 -9.086 -16.343 -1.083 1.00 0.00 N ATOM 1422 CD2 HIS A 87 -10.629 -15.022 -1.930 1.00 0.00 C ATOM 1423 CE1 HIS A 87 -8.610 -15.085 -1.144 1.00 0.00 C ATOM 1424 NE2 HIS A 87 -9.510 -14.240 -1.652 1.00 0.00 N ATOM 0 H HIS A 87 -10.339 -17.970 0.602 1.00 0.00 H new ATOM 0 HA HIS A 87 -12.737 -16.762 -0.371 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -10.580 -18.451 -1.728 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -11.819 -17.551 -2.580 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -11.553 -14.658 -2.354 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -7.621 -14.795 -0.821 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -9.402 -13.237 -1.804 1.00 0.00 H new ATOM 1432 N HIS A 88 -14.128 -18.696 -1.354 1.00 0.00 N ATOM 1433 CA HIS A 88 -15.084 -19.775 -1.570 1.00 0.00 C ATOM 1434 C HIS A 88 -14.495 -20.827 -2.508 1.00 0.00 C ATOM 1435 O HIS A 88 -15.038 -21.923 -2.651 1.00 0.00 O ATOM 1436 CB HIS A 88 -16.374 -19.211 -2.169 1.00 0.00 C ATOM 1437 CG HIS A 88 -17.082 -18.371 -1.140 1.00 0.00 C ATOM 1438 ND1 HIS A 88 -17.745 -18.931 -0.059 1.00 0.00 N ATOM 1439 CD2 HIS A 88 -17.240 -17.012 -1.013 1.00 0.00 C ATOM 1440 CE1 HIS A 88 -18.266 -17.923 0.665 1.00 0.00 C ATOM 1441 NE2 HIS A 88 -17.987 -16.732 0.128 1.00 0.00 N ATOM 0 H HIS A 88 -14.358 -17.823 -1.830 1.00 0.00 H new ATOM 0 HA HIS A 88 -15.306 -20.245 -0.612 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -16.146 -18.610 -3.049 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -17.021 -20.025 -2.497 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -16.845 -16.273 -1.695 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -18.840 -18.060 1.570 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -18.262 -15.815 0.479 1.00 0.00 H new ATOM 1449 N HIS A 89 -13.381 -20.479 -3.140 1.00 0.00 N ATOM 1450 CA HIS A 89 -12.711 -21.387 -4.067 1.00 0.00 C ATOM 1451 C HIS A 89 -12.064 -22.550 -3.317 1.00 0.00 C ATOM 1452 O HIS A 89 -11.348 -22.349 -2.336 1.00 0.00 O ATOM 1453 CB HIS A 89 -11.642 -20.619 -4.845 1.00 0.00 C ATOM 1454 CG HIS A 89 -10.970 -21.534 -5.830 1.00 0.00 C ATOM 1455 ND1 HIS A 89 -9.770 -22.166 -5.548 1.00 0.00 N ATOM 1456 CD2 HIS A 89 -11.309 -21.925 -7.102 1.00 0.00 C ATOM 1457 CE1 HIS A 89 -9.431 -22.896 -6.626 1.00 0.00 C ATOM 1458 NE2 HIS A 89 -10.336 -22.784 -7.603 1.00 0.00 N ATOM 0 H HIS A 89 -12.921 -19.575 -3.029 1.00 0.00 H new ATOM 0 HA HIS A 89 -13.452 -21.792 -4.756 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -12.095 -19.777 -5.368 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -10.904 -20.207 -4.156 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -12.196 -21.613 -7.633 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -8.537 -23.499 -6.694 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -10.317 -23.232 -8.519 1.00 0.00 H new ATOM 1466 N HIS A 90 -12.323 -23.767 -3.787 1.00 0.00 N ATOM 1467 CA HIS A 90 -11.764 -24.960 -3.157 1.00 0.00 C ATOM 1468 C HIS A 90 -12.026 -24.950 -1.654 1.00 0.00 C ATOM 1469 O HIS A 90 -13.159 -25.188 -1.269 1.00 0.00 O ATOM 1470 CB HIS A 90 -10.257 -25.039 -3.411 1.00 0.00 C ATOM 1471 CG HIS A 90 -9.738 -26.367 -2.929 1.00 0.00 C ATOM 1472 ND1 HIS A 90 -9.382 -26.587 -1.608 1.00 0.00 N ATOM 1473 CD2 HIS A 90 -9.515 -27.557 -3.579 1.00 0.00 C ATOM 1474 CE1 HIS A 90 -8.967 -27.864 -1.505 1.00 0.00 C ATOM 1475 NE2 HIS A 90 -9.029 -28.500 -2.678 1.00 0.00 N ATOM 1476 OXT HIS A 90 -11.089 -24.707 -0.911 1.00 0.00 O ATOM 0 H HIS A 90 -12.913 -23.953 -4.598 1.00 0.00 H new ATOM 0 HA HIS A 90 -12.250 -25.832 -3.595 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -10.049 -24.919 -4.474 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -9.747 -24.227 -2.893 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -9.426 -25.905 -0.851 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -9.690 -27.734 -4.630 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -8.626 -28.318 -0.586 1.00 0.00 H new TER 1484 HIS A 90