USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1052 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: B 41 ASN : amide:sc= -0.0114 K(o=-2.3,f=-5.1) USER MOD Set 1.2: B 46 MET CE :methyl -104:sc= -2.29! (180deg=-3.98!) USER MOD Set 2.1: B 26 TYR OH : rot 130:sc= 0.665 USER MOD Set 2.2: B 39 HIS : no HD1:sc= 0.502 K(o=1.2,f=-2.7) USER MOD Set 3.1: B 17 HIS : no HD1:sc= 1.66 K(o=2.7,f=-8.4!) USER MOD Set 3.2: B 20 THR OG1 : rot 165:sc= 1.07 USER MOD Set 4.1: A 41 ASN : amide:sc= -0.0114 K(o=-2.4,f=-5.4) USER MOD Set 4.2: A 46 MET CE :methyl -104:sc= -2.34! (180deg=-3.89!) USER MOD Set 5.1: A 26 TYR OH : rot 133:sc= 0.616 USER MOD Set 5.2: A 39 HIS : no HD1:sc= 0.522 K(o=1.1,f=-2.7) USER MOD Set 6.1: A 17 HIS : no HD1:sc= 1.67 K(o=2.7,f=-8.5!) USER MOD Set 6.2: A 20 THR OG1 : rot 167:sc= 1.07 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot -120:sc= -2.8! USER MOD Single : A 6 HIS : no HE2:sc= 0.112 K(o=0.11,f=-5.1!) USER MOD Single : A 18 THR OG1 : rot 140:sc= -2.07! USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -1.14! C(o=-1.1!,f=-2.2!) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 THR OG1 : rot -76:sc= 1.13 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.449 X(o=-0.45,f=-0.09) USER MOD Single : A 49 GLN : amide:sc= 0.0163 X(o=0.016,f=0) USER MOD Single : A 50 HIS : no HD1:sc= -1.33 X(o=-1.3,f=-1.4) USER MOD Single : A 53 LYS NZ :NH3+ -171:sc= 1.26 (180deg=0.898) USER MOD Single : A 56 THR OG1 : rot 90:sc= -0.555 USER MOD Single : A 64 TYR OH : rot 47:sc= -0.21 USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 100:sc= -2.84! USER MOD Single : B 6 HIS : no HE2:sc= 0.38 K(o=0.38,f=-5.2!) USER MOD Single : B 18 THR OG1 : rot 180:sc= -2.1! USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 24 ASN : amide:sc= -1.2! C(o=-1.2!,f=-2.1!) USER MOD Single : B 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 28 THR OG1 : rot -76:sc= 1.14 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 ASN : amide:sc= -0.409 X(o=-0.41,f=-0.076) USER MOD Single : B 49 GLN : amide:sc= 0.0196 X(o=0.02,f=0) USER MOD Single : B 50 HIS : no HD1:sc= -1.38 X(o=-1.4,f=-1.5) USER MOD Single : B 53 LYS NZ :NH3+ -150:sc= 1.25 (180deg=0.869) USER MOD Single : B 56 THR OG1 : rot 77:sc= -0.695 USER MOD Single : B 64 TYR OH : rot 51:sc= -0.287 USER MOD ----------------------------------------------------------------- ATOM 10 N PRO A 2 -4.484 9.471 -6.968 1.00 0.00 N ATOM 11 CA PRO A 2 -5.891 9.072 -6.942 1.00 0.00 C ATOM 12 C PRO A 2 -6.689 9.883 -5.937 1.00 0.00 C ATOM 13 O PRO A 2 -6.455 9.803 -4.732 1.00 0.00 O ATOM 14 CB PRO A 2 -5.859 7.604 -6.518 1.00 0.00 C ATOM 15 CG PRO A 2 -4.457 7.158 -6.735 1.00 0.00 C ATOM 16 CD PRO A 2 -3.603 8.377 -6.548 1.00 0.00 C ATOM 0 HA PRO A 2 -6.370 9.233 -7.908 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.150 7.491 -5.474 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.556 7.010 -7.109 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -4.182 6.376 -6.027 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -4.330 6.742 -7.734 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -3.285 8.491 -5.512 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -2.699 8.332 -7.155 1.00 0.00 H new ATOM 24 N LYS A 3 -7.619 10.669 -6.438 1.00 0.00 N ATOM 25 CA LYS A 3 -8.470 11.476 -5.587 1.00 0.00 C ATOM 26 C LYS A 3 -9.678 10.673 -5.140 1.00 0.00 C ATOM 27 O LYS A 3 -10.336 11.012 -4.154 1.00 0.00 O ATOM 28 CB LYS A 3 -8.928 12.728 -6.333 1.00 0.00 C ATOM 29 CG LYS A 3 -7.782 13.578 -6.866 1.00 0.00 C ATOM 30 CD LYS A 3 -6.933 14.174 -5.751 1.00 0.00 C ATOM 31 CE LYS A 3 -7.730 15.138 -4.886 1.00 0.00 C ATOM 32 NZ LYS A 3 -6.862 15.872 -3.930 1.00 0.00 N ATOM 0 H LYS A 3 -7.806 10.767 -7.436 1.00 0.00 H new ATOM 0 HA LYS A 3 -7.898 11.776 -4.709 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -9.566 12.431 -7.166 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -9.538 13.335 -5.665 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -7.151 12.968 -7.513 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -8.186 14.382 -7.481 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.535 13.372 -5.129 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.079 14.695 -6.184 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.252 15.851 -5.524 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -8.492 14.586 -4.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -7.443 16.519 -3.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.383 15.193 -3.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -6.151 16.419 -4.456 1.00 0.00 H new ATOM 46 N THR A 4 -9.967 9.602 -5.862 1.00 0.00 N ATOM 47 CA THR A 4 -11.135 8.802 -5.571 1.00 0.00 C ATOM 48 C THR A 4 -10.784 7.339 -5.354 1.00 0.00 C ATOM 49 O THR A 4 -9.684 6.889 -5.697 1.00 0.00 O ATOM 50 CB THR A 4 -12.184 8.900 -6.691 1.00 0.00 C ATOM 51 OG1 THR A 4 -11.610 8.472 -7.929 1.00 0.00 O ATOM 52 CG2 THR A 4 -12.701 10.320 -6.831 1.00 0.00 C ATOM 0 H THR A 4 -9.409 9.272 -6.649 1.00 0.00 H new ATOM 0 HA THR A 4 -11.553 9.206 -4.649 1.00 0.00 H new ATOM 0 HB THR A 4 -13.023 8.254 -6.432 1.00 0.00 H new ATOM 0 HG1 THR A 4 -11.649 9.205 -8.579 1.00 0.00 H new ATOM 0 HG21 THR A 4 -13.441 10.361 -7.630 1.00 0.00 H new ATOM 0 HG22 THR A 4 -13.161 10.634 -5.894 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.873 10.987 -7.070 1.00 0.00 H new ATOM 60 N LEU A 5 -11.733 6.606 -4.799 1.00 0.00 N ATOM 61 CA LEU A 5 -11.565 5.190 -4.520 1.00 0.00 C ATOM 62 C LEU A 5 -11.230 4.429 -5.803 1.00 0.00 C ATOM 63 O LEU A 5 -10.275 3.652 -5.851 1.00 0.00 O ATOM 64 CB LEU A 5 -12.856 4.666 -3.873 1.00 0.00 C ATOM 65 CG LEU A 5 -12.793 3.277 -3.236 1.00 0.00 C ATOM 66 CD1 LEU A 5 -13.043 2.187 -4.265 1.00 0.00 C ATOM 67 CD2 LEU A 5 -11.455 3.077 -2.550 1.00 0.00 C ATOM 0 H LEU A 5 -12.644 6.976 -4.528 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.734 5.037 -3.832 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -13.165 5.377 -3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -13.637 4.656 -4.633 1.00 0.00 H new ATOM 0 HG LEU A 5 -13.582 3.208 -2.488 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.992 1.211 -3.781 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -14.031 2.322 -4.705 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -12.286 2.245 -5.047 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.422 2.085 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.653 3.171 -3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -11.328 3.832 -1.774 1.00 0.00 H new ATOM 79 N HIS A 6 -12.003 4.698 -6.847 1.00 0.00 N ATOM 80 CA HIS A 6 -11.824 4.052 -8.143 1.00 0.00 C ATOM 81 C HIS A 6 -10.394 4.207 -8.647 1.00 0.00 C ATOM 82 O HIS A 6 -9.758 3.232 -9.055 1.00 0.00 O ATOM 83 CB HIS A 6 -12.802 4.658 -9.151 1.00 0.00 C ATOM 84 CG HIS A 6 -12.746 4.050 -10.522 1.00 0.00 C ATOM 85 ND1 HIS A 6 -12.107 4.647 -11.587 1.00 0.00 N ATOM 86 CD2 HIS A 6 -13.280 2.904 -11.003 1.00 0.00 C ATOM 87 CE1 HIS A 6 -12.253 3.895 -12.661 1.00 0.00 C ATOM 88 NE2 HIS A 6 -12.960 2.831 -12.334 1.00 0.00 N ATOM 0 H HIS A 6 -12.771 5.369 -6.821 1.00 0.00 H new ATOM 0 HA HIS A 6 -12.024 2.987 -8.028 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -13.815 4.552 -8.763 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -12.602 5.726 -9.234 1.00 0.00 H new ATOM 0 HD1 HIS A 6 -11.601 5.532 -11.551 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -13.853 2.180 -10.442 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -11.860 4.114 -13.643 1.00 0.00 H new ATOM 97 N GLU A 7 -9.888 5.430 -8.592 1.00 0.00 N ATOM 98 CA GLU A 7 -8.562 5.724 -9.106 1.00 0.00 C ATOM 99 C GLU A 7 -7.500 5.032 -8.262 1.00 0.00 C ATOM 100 O GLU A 7 -6.458 4.617 -8.772 1.00 0.00 O ATOM 101 CB GLU A 7 -8.318 7.233 -9.125 1.00 0.00 C ATOM 102 CG GLU A 7 -9.378 8.019 -9.879 1.00 0.00 C ATOM 103 CD GLU A 7 -9.585 7.537 -11.298 1.00 0.00 C ATOM 104 OE1 GLU A 7 -10.610 6.872 -11.558 1.00 0.00 O ATOM 105 OE2 GLU A 7 -8.728 7.826 -12.162 1.00 0.00 O ATOM 0 H GLU A 7 -10.377 6.233 -8.197 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.498 5.348 -10.127 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -8.272 7.597 -8.098 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -7.345 7.428 -9.576 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -10.322 7.953 -9.339 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -9.095 9.071 -9.898 1.00 0.00 H new ATOM 112 N LEU A 8 -7.779 4.906 -6.970 1.00 0.00 N ATOM 113 CA LEU A 8 -6.868 4.245 -6.048 1.00 0.00 C ATOM 114 C LEU A 8 -6.754 2.763 -6.384 1.00 0.00 C ATOM 115 O LEU A 8 -5.653 2.212 -6.451 1.00 0.00 O ATOM 116 CB LEU A 8 -7.359 4.448 -4.611 1.00 0.00 C ATOM 117 CG LEU A 8 -6.385 4.053 -3.495 1.00 0.00 C ATOM 118 CD1 LEU A 8 -6.418 2.557 -3.238 1.00 0.00 C ATOM 119 CD2 LEU A 8 -4.974 4.498 -3.836 1.00 0.00 C ATOM 0 H LEU A 8 -8.634 5.255 -6.537 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.875 4.684 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.616 5.499 -4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.278 3.877 -4.480 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.702 4.559 -2.583 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.716 2.309 -2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.424 2.261 -2.941 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.137 2.025 -4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.297 4.209 -3.032 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -4.658 4.024 -4.765 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.953 5.581 -3.956 1.00 0.00 H new ATOM 131 N LEU A 9 -7.892 2.124 -6.602 1.00 0.00 N ATOM 132 CA LEU A 9 -7.917 0.710 -6.944 1.00 0.00 C ATOM 133 C LEU A 9 -7.191 0.454 -8.255 1.00 0.00 C ATOM 134 O LEU A 9 -6.430 -0.508 -8.370 1.00 0.00 O ATOM 135 CB LEU A 9 -9.353 0.196 -7.025 1.00 0.00 C ATOM 136 CG LEU A 9 -9.972 -0.256 -5.700 1.00 0.00 C ATOM 137 CD1 LEU A 9 -9.307 -1.524 -5.205 1.00 0.00 C ATOM 138 CD2 LEU A 9 -9.864 0.828 -4.646 1.00 0.00 C ATOM 0 H LEU A 9 -8.812 2.562 -6.548 1.00 0.00 H new ATOM 0 HA LEU A 9 -7.399 0.167 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -9.978 0.983 -7.447 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.381 -0.641 -7.722 1.00 0.00 H new ATOM 0 HG LEU A 9 -11.028 -0.456 -5.881 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -9.761 -1.829 -4.262 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.437 -2.315 -5.943 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.243 -1.341 -5.053 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -10.312 0.477 -3.716 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.814 1.066 -4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.388 1.721 -4.987 1.00 0.00 H new ATOM 150 N GLU A 10 -7.412 1.321 -9.234 1.00 0.00 N ATOM 151 CA GLU A 10 -6.726 1.200 -10.514 1.00 0.00 C ATOM 152 C GLU A 10 -5.227 1.416 -10.344 1.00 0.00 C ATOM 153 O GLU A 10 -4.421 0.837 -11.071 1.00 0.00 O ATOM 154 CB GLU A 10 -7.271 2.198 -11.531 1.00 0.00 C ATOM 155 CG GLU A 10 -8.724 1.974 -11.896 1.00 0.00 C ATOM 156 CD GLU A 10 -9.131 2.772 -13.113 1.00 0.00 C ATOM 157 OE1 GLU A 10 -9.320 2.168 -14.186 1.00 0.00 O ATOM 158 OE2 GLU A 10 -9.248 4.006 -13.007 1.00 0.00 O ATOM 0 H GLU A 10 -8.055 2.110 -9.168 1.00 0.00 H new ATOM 0 HA GLU A 10 -6.905 0.191 -10.885 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -7.159 3.206 -11.132 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.667 2.145 -12.437 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -8.891 0.914 -12.085 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.357 2.251 -11.053 1.00 0.00 H new ATOM 165 N ARG A 11 -4.863 2.245 -9.373 1.00 0.00 N ATOM 166 CA ARG A 11 -3.470 2.549 -9.099 1.00 0.00 C ATOM 167 C ARG A 11 -2.750 1.289 -8.639 1.00 0.00 C ATOM 168 O ARG A 11 -1.728 0.907 -9.202 1.00 0.00 O ATOM 169 CB ARG A 11 -3.382 3.632 -8.018 1.00 0.00 C ATOM 170 CG ARG A 11 -2.214 4.600 -8.160 1.00 0.00 C ATOM 171 CD ARG A 11 -0.861 3.948 -7.914 1.00 0.00 C ATOM 172 NE ARG A 11 -0.365 3.214 -9.079 1.00 0.00 N ATOM 173 CZ ARG A 11 0.569 3.669 -9.916 1.00 0.00 C ATOM 174 NH1 ARG A 11 1.115 4.865 -9.734 1.00 0.00 N ATOM 175 NH2 ARG A 11 0.959 2.920 -10.938 1.00 0.00 N ATOM 0 H ARG A 11 -5.523 2.721 -8.758 1.00 0.00 H new ATOM 0 HA ARG A 11 -2.994 2.916 -10.008 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.310 4.204 -8.024 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -3.314 3.146 -7.045 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.226 5.029 -9.162 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -2.346 5.424 -7.458 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -0.138 4.716 -7.639 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.940 3.266 -7.067 1.00 0.00 H new ATOM 0 HE ARG A 11 -0.760 2.292 -9.264 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.821 5.446 -8.948 1.00 0.00 H new ATOM 0 HH12 ARG A 11 1.828 5.204 -10.380 1.00 0.00 H new ATOM 0 HH21 ARG A 11 0.545 1.999 -11.082 1.00 0.00 H new ATOM 0 HH22 ARG A 11 1.673 3.265 -11.580 1.00 0.00 H new ATOM 189 N ILE A 12 -3.305 0.632 -7.636 1.00 0.00 N ATOM 190 CA ILE A 12 -2.659 -0.527 -7.038 1.00 0.00 C ATOM 191 C ILE A 12 -2.902 -1.795 -7.846 1.00 0.00 C ATOM 192 O ILE A 12 -2.239 -2.811 -7.640 1.00 0.00 O ATOM 193 CB ILE A 12 -3.113 -0.728 -5.585 1.00 0.00 C ATOM 194 CG1 ILE A 12 -4.618 -0.982 -5.500 1.00 0.00 C ATOM 195 CG2 ILE A 12 -2.738 0.497 -4.774 1.00 0.00 C ATOM 196 CD1 ILE A 12 -5.094 -1.290 -4.098 1.00 0.00 C ATOM 0 H ILE A 12 -4.201 0.880 -7.217 1.00 0.00 H new ATOM 0 HA ILE A 12 -1.587 -0.328 -7.044 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.611 -1.607 -5.180 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -5.149 -0.106 -5.872 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.877 -1.814 -6.155 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.058 0.361 -3.741 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.657 0.637 -4.804 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.229 1.375 -5.193 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -6.171 -1.460 -4.108 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -4.589 -2.183 -3.730 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.866 -0.449 -3.443 1.00 0.00 H new ATOM 208 N GLY A 13 -3.856 -1.736 -8.763 1.00 0.00 N ATOM 209 CA GLY A 13 -4.081 -2.847 -9.664 1.00 0.00 C ATOM 210 C GLY A 13 -5.166 -3.780 -9.181 1.00 0.00 C ATOM 211 O GLY A 13 -5.194 -4.954 -9.550 1.00 0.00 O ATOM 0 H GLY A 13 -4.478 -0.939 -8.899 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.350 -2.463 -10.648 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.153 -3.406 -9.783 1.00 0.00 H new ATOM 215 N LEU A 14 -6.064 -3.261 -8.360 1.00 0.00 N ATOM 216 CA LEU A 14 -7.174 -4.045 -7.849 1.00 0.00 C ATOM 217 C LEU A 14 -8.490 -3.468 -8.323 1.00 0.00 C ATOM 218 O LEU A 14 -9.507 -3.565 -7.636 1.00 0.00 O ATOM 219 CB LEU A 14 -7.163 -4.118 -6.320 1.00 0.00 C ATOM 220 CG LEU A 14 -6.190 -5.129 -5.709 1.00 0.00 C ATOM 221 CD1 LEU A 14 -6.301 -6.465 -6.414 1.00 0.00 C ATOM 222 CD2 LEU A 14 -4.763 -4.626 -5.753 1.00 0.00 C ATOM 0 H LEU A 14 -6.045 -2.295 -8.032 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.060 -5.058 -8.236 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -6.923 -3.129 -5.929 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.170 -4.359 -5.979 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.464 -5.259 -4.662 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.602 -7.172 -5.967 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -7.317 -6.846 -6.313 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.064 -6.340 -7.470 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.101 -5.370 -5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.471 -4.450 -6.788 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.688 -3.695 -5.192 1.00 0.00 H new ATOM 234 N GLU A 15 -8.463 -2.881 -9.511 1.00 0.00 N ATOM 235 CA GLU A 15 -9.658 -2.307 -10.114 1.00 0.00 C ATOM 236 C GLU A 15 -10.738 -3.370 -10.303 1.00 0.00 C ATOM 237 O GLU A 15 -11.915 -3.053 -10.465 1.00 0.00 O ATOM 238 CB GLU A 15 -9.314 -1.660 -11.451 1.00 0.00 C ATOM 239 CG GLU A 15 -8.696 -2.623 -12.448 1.00 0.00 C ATOM 240 CD GLU A 15 -8.481 -1.995 -13.806 1.00 0.00 C ATOM 241 OE1 GLU A 15 -7.329 -1.641 -14.126 1.00 0.00 O ATOM 242 OE2 GLU A 15 -9.466 -1.859 -14.561 1.00 0.00 O ATOM 0 H GLU A 15 -7.621 -2.789 -10.080 1.00 0.00 H new ATOM 0 HA GLU A 15 -10.047 -1.543 -9.441 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -10.219 -1.234 -11.883 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.623 -0.834 -11.279 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.741 -2.978 -12.061 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.341 -3.495 -12.553 1.00 0.00 H new ATOM 249 N GLU A 16 -10.321 -4.630 -10.269 1.00 0.00 N ATOM 250 CA GLU A 16 -11.237 -5.759 -10.339 1.00 0.00 C ATOM 251 C GLU A 16 -12.165 -5.786 -9.127 1.00 0.00 C ATOM 252 O GLU A 16 -13.244 -6.371 -9.164 1.00 0.00 O ATOM 253 CB GLU A 16 -10.440 -7.059 -10.399 1.00 0.00 C ATOM 254 CG GLU A 16 -9.566 -7.280 -9.175 1.00 0.00 C ATOM 255 CD GLU A 16 -8.702 -8.512 -9.285 1.00 0.00 C ATOM 256 OE1 GLU A 16 -7.710 -8.476 -10.041 1.00 0.00 O ATOM 257 OE2 GLU A 16 -9.006 -9.515 -8.607 1.00 0.00 O ATOM 0 H GLU A 16 -9.339 -4.896 -10.192 1.00 0.00 H new ATOM 0 HA GLU A 16 -11.845 -5.654 -11.237 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -11.130 -7.897 -10.501 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -9.812 -7.052 -11.290 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -8.929 -6.408 -9.027 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -10.200 -7.365 -8.293 1.00 0.00 H new ATOM 264 N HIS A 17 -11.735 -5.143 -8.052 1.00 0.00 N ATOM 265 CA HIS A 17 -12.485 -5.159 -6.810 1.00 0.00 C ATOM 266 C HIS A 17 -12.978 -3.773 -6.436 1.00 0.00 C ATOM 267 O HIS A 17 -13.462 -3.572 -5.326 1.00 0.00 O ATOM 268 CB HIS A 17 -11.636 -5.731 -5.672 1.00 0.00 C ATOM 269 CG HIS A 17 -11.534 -7.228 -5.686 1.00 0.00 C ATOM 270 ND1 HIS A 17 -12.638 -8.055 -5.641 1.00 0.00 N ATOM 271 CD2 HIS A 17 -10.455 -8.045 -5.733 1.00 0.00 C ATOM 272 CE1 HIS A 17 -12.242 -9.316 -5.656 1.00 0.00 C ATOM 273 NE2 HIS A 17 -10.922 -9.338 -5.712 1.00 0.00 N ATOM 0 H HIS A 17 -10.870 -4.604 -8.017 1.00 0.00 H new ATOM 0 HA HIS A 17 -13.353 -5.799 -6.966 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -10.633 -5.307 -5.731 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -12.061 -5.414 -4.720 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -9.421 -7.738 -5.778 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -12.888 -10.181 -5.627 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -10.344 -10.178 -5.736 1.00 0.00 H new ATOM 282 N THR A 18 -12.868 -2.820 -7.354 1.00 0.00 N ATOM 283 CA THR A 18 -13.352 -1.472 -7.092 1.00 0.00 C ATOM 284 C THR A 18 -14.832 -1.500 -6.743 1.00 0.00 C ATOM 285 O THR A 18 -15.269 -0.871 -5.780 1.00 0.00 O ATOM 286 CB THR A 18 -13.153 -0.546 -8.298 1.00 0.00 C ATOM 287 OG1 THR A 18 -11.832 -0.695 -8.822 1.00 0.00 O ATOM 288 CG2 THR A 18 -13.382 0.898 -7.892 1.00 0.00 C ATOM 0 H THR A 18 -12.453 -2.954 -8.276 1.00 0.00 H new ATOM 0 HA THR A 18 -12.771 -1.085 -6.255 1.00 0.00 H new ATOM 0 HB THR A 18 -13.874 -0.819 -9.068 1.00 0.00 H new ATOM 0 HG1 THR A 18 -11.865 -0.678 -9.801 1.00 0.00 H new ATOM 0 HG21 THR A 18 -13.238 1.546 -8.756 1.00 0.00 H new ATOM 0 HG22 THR A 18 -14.399 1.014 -7.517 1.00 0.00 H new ATOM 0 HG23 THR A 18 -12.674 1.173 -7.110 1.00 0.00 H new ATOM 296 N SER A 19 -15.590 -2.251 -7.527 1.00 0.00 N ATOM 297 CA SER A 19 -17.010 -2.419 -7.290 1.00 0.00 C ATOM 298 C SER A 19 -17.234 -3.107 -5.951 1.00 0.00 C ATOM 299 O SER A 19 -18.166 -2.778 -5.229 1.00 0.00 O ATOM 300 CB SER A 19 -17.637 -3.230 -8.425 1.00 0.00 C ATOM 301 OG SER A 19 -19.043 -3.333 -8.283 1.00 0.00 O ATOM 0 H SER A 19 -15.238 -2.757 -8.340 1.00 0.00 H new ATOM 0 HA SER A 19 -17.488 -1.440 -7.261 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.401 -2.761 -9.380 1.00 0.00 H new ATOM 0 HB3 SER A 19 -17.199 -4.228 -8.444 1.00 0.00 H new ATOM 0 HG SER A 19 -19.409 -3.856 -9.026 1.00 0.00 H new ATOM 307 N THR A 20 -16.354 -4.041 -5.609 1.00 0.00 N ATOM 308 CA THR A 20 -16.449 -4.746 -4.343 1.00 0.00 C ATOM 309 C THR A 20 -16.388 -3.757 -3.187 1.00 0.00 C ATOM 310 O THR A 20 -17.259 -3.745 -2.320 1.00 0.00 O ATOM 311 CB THR A 20 -15.310 -5.766 -4.184 1.00 0.00 C ATOM 312 OG1 THR A 20 -15.128 -6.504 -5.402 1.00 0.00 O ATOM 313 CG2 THR A 20 -15.609 -6.724 -3.043 1.00 0.00 C ATOM 0 H THR A 20 -15.568 -4.325 -6.193 1.00 0.00 H new ATOM 0 HA THR A 20 -17.401 -5.276 -4.333 1.00 0.00 H new ATOM 0 HB THR A 20 -14.393 -5.222 -3.957 1.00 0.00 H new ATOM 0 HG1 THR A 20 -14.278 -6.990 -5.366 1.00 0.00 H new ATOM 0 HG21 THR A 20 -14.792 -7.439 -2.945 1.00 0.00 H new ATOM 0 HG22 THR A 20 -15.713 -6.163 -2.115 1.00 0.00 H new ATOM 0 HG23 THR A 20 -16.536 -7.258 -3.250 1.00 0.00 H new ATOM 321 N LEU A 21 -15.361 -2.919 -3.195 1.00 0.00 N ATOM 322 CA LEU A 21 -15.213 -1.882 -2.188 1.00 0.00 C ATOM 323 C LEU A 21 -16.406 -0.940 -2.228 1.00 0.00 C ATOM 324 O LEU A 21 -17.079 -0.726 -1.220 1.00 0.00 O ATOM 325 CB LEU A 21 -13.916 -1.089 -2.413 1.00 0.00 C ATOM 326 CG LEU A 21 -12.625 -1.719 -1.872 1.00 0.00 C ATOM 327 CD1 LEU A 21 -12.813 -2.190 -0.443 1.00 0.00 C ATOM 328 CD2 LEU A 21 -12.151 -2.861 -2.750 1.00 0.00 C ATOM 0 H LEU A 21 -14.616 -2.939 -3.891 1.00 0.00 H new ATOM 0 HA LEU A 21 -15.165 -2.359 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -13.795 -0.930 -3.485 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -14.033 -0.106 -1.956 1.00 0.00 H new ATOM 0 HG LEU A 21 -11.855 -0.948 -1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.885 -2.633 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -13.081 -1.342 0.187 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -13.609 -2.934 -0.407 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -11.235 -3.282 -2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -12.920 -3.633 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -11.957 -2.490 -3.756 1.00 0.00 H new ATOM 340 N LEU A 22 -16.675 -0.422 -3.418 1.00 0.00 N ATOM 341 CA LEU A 22 -17.728 0.560 -3.646 1.00 0.00 C ATOM 342 C LEU A 22 -19.069 0.090 -3.086 1.00 0.00 C ATOM 343 O LEU A 22 -19.741 0.819 -2.359 1.00 0.00 O ATOM 344 CB LEU A 22 -17.853 0.803 -5.151 1.00 0.00 C ATOM 345 CG LEU A 22 -18.662 2.029 -5.560 1.00 0.00 C ATOM 346 CD1 LEU A 22 -17.958 3.298 -5.117 1.00 0.00 C ATOM 347 CD2 LEU A 22 -18.885 2.032 -7.062 1.00 0.00 C ATOM 0 H LEU A 22 -16.163 -0.674 -4.263 1.00 0.00 H new ATOM 0 HA LEU A 22 -17.462 1.482 -3.129 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -16.851 0.896 -5.569 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -18.308 -0.077 -5.606 1.00 0.00 H new ATOM 0 HG LEU A 22 -19.634 1.990 -5.068 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -18.548 4.165 -5.416 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -17.846 3.292 -4.033 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -16.974 3.350 -5.583 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -19.464 2.912 -7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -17.922 2.053 -7.573 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -19.429 1.133 -7.351 1.00 0.00 H new ATOM 359 N LEU A 23 -19.439 -1.139 -3.418 1.00 0.00 N ATOM 360 CA LEU A 23 -20.729 -1.691 -3.026 1.00 0.00 C ATOM 361 C LEU A 23 -20.766 -2.028 -1.542 1.00 0.00 C ATOM 362 O LEU A 23 -21.838 -2.138 -0.946 1.00 0.00 O ATOM 363 CB LEU A 23 -21.035 -2.945 -3.842 1.00 0.00 C ATOM 364 CG LEU A 23 -21.071 -2.749 -5.357 1.00 0.00 C ATOM 365 CD1 LEU A 23 -21.395 -4.061 -6.054 1.00 0.00 C ATOM 366 CD2 LEU A 23 -22.077 -1.675 -5.738 1.00 0.00 C ATOM 0 H LEU A 23 -18.859 -1.777 -3.962 1.00 0.00 H new ATOM 0 HA LEU A 23 -21.485 -0.931 -3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -20.286 -3.702 -3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -21.999 -3.341 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 23 -20.085 -2.419 -5.684 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -21.417 -3.904 -7.132 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -20.632 -4.801 -5.810 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -22.368 -4.420 -5.720 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -22.086 -1.552 -6.821 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -23.070 -1.970 -5.398 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -21.798 -0.732 -5.268 1.00 0.00 H new ATOM 378 N ASN A 24 -19.599 -2.197 -0.944 1.00 0.00 N ATOM 379 CA ASN A 24 -19.520 -2.540 0.467 1.00 0.00 C ATOM 380 C ASN A 24 -19.305 -1.300 1.323 1.00 0.00 C ATOM 381 O ASN A 24 -18.978 -1.396 2.507 1.00 0.00 O ATOM 382 CB ASN A 24 -18.422 -3.573 0.715 1.00 0.00 C ATOM 383 CG ASN A 24 -18.884 -4.990 0.417 1.00 0.00 C ATOM 384 OD1 ASN A 24 -19.418 -5.684 1.284 1.00 0.00 O ATOM 385 ND2 ASN A 24 -18.677 -5.432 -0.813 1.00 0.00 N ATOM 0 H ASN A 24 -18.697 -2.103 -1.410 1.00 0.00 H new ATOM 0 HA ASN A 24 -20.473 -2.983 0.757 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -17.558 -3.337 0.094 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.095 -3.511 1.753 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -18.963 -6.377 -1.070 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -18.232 -4.828 -1.504 1.00 0.00 H new ATOM 392 N GLY A 25 -19.476 -0.137 0.711 1.00 0.00 N ATOM 393 CA GLY A 25 -19.463 1.105 1.457 1.00 0.00 C ATOM 394 C GLY A 25 -18.174 1.873 1.298 1.00 0.00 C ATOM 395 O GLY A 25 -18.070 3.022 1.726 1.00 0.00 O ATOM 0 H GLY A 25 -19.624 -0.031 -0.293 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -20.294 1.729 1.129 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -19.624 0.890 2.513 1.00 0.00 H new ATOM 399 N TYR A 26 -17.196 1.250 0.665 1.00 0.00 N ATOM 400 CA TYR A 26 -15.905 1.875 0.457 1.00 0.00 C ATOM 401 C TYR A 26 -15.924 2.668 -0.831 1.00 0.00 C ATOM 402 O TYR A 26 -15.466 2.206 -1.873 1.00 0.00 O ATOM 403 CB TYR A 26 -14.813 0.818 0.426 1.00 0.00 C ATOM 404 CG TYR A 26 -14.732 0.030 1.705 1.00 0.00 C ATOM 405 CD1 TYR A 26 -15.337 -1.212 1.812 1.00 0.00 C ATOM 406 CD2 TYR A 26 -14.066 0.536 2.807 1.00 0.00 C ATOM 407 CE1 TYR A 26 -15.280 -1.929 2.988 1.00 0.00 C ATOM 408 CE2 TYR A 26 -14.000 -0.174 3.985 1.00 0.00 C ATOM 409 CZ TYR A 26 -14.609 -1.405 4.072 1.00 0.00 C ATOM 410 OH TYR A 26 -14.551 -2.111 5.246 1.00 0.00 O ATOM 0 H TYR A 26 -17.274 0.307 0.285 1.00 0.00 H new ATOM 0 HA TYR A 26 -15.696 2.557 1.281 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -14.996 0.137 -0.405 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -13.853 1.299 0.239 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -15.861 -1.624 0.962 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -13.590 1.503 2.742 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -15.758 -2.895 3.060 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -13.473 0.233 4.836 1.00 0.00 H new ATOM 0 HH TYR A 26 -13.631 -2.110 5.583 1.00 0.00 H new ATOM 420 N GLN A 27 -16.469 3.862 -0.744 1.00 0.00 N ATOM 421 CA GLN A 27 -16.703 4.676 -1.917 1.00 0.00 C ATOM 422 C GLN A 27 -15.674 5.785 -2.011 1.00 0.00 C ATOM 423 O GLN A 27 -15.504 6.404 -3.063 1.00 0.00 O ATOM 424 CB GLN A 27 -18.112 5.256 -1.853 1.00 0.00 C ATOM 425 CG GLN A 27 -19.162 4.202 -1.543 1.00 0.00 C ATOM 426 CD GLN A 27 -20.566 4.762 -1.452 1.00 0.00 C ATOM 427 OE1 GLN A 27 -21.011 5.190 -0.388 1.00 0.00 O ATOM 428 NE2 GLN A 27 -21.280 4.756 -2.562 1.00 0.00 N ATOM 0 H GLN A 27 -16.760 4.293 0.133 1.00 0.00 H new ATOM 0 HA GLN A 27 -16.609 4.056 -2.809 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -18.147 6.034 -1.090 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -18.349 5.732 -2.805 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -19.134 3.434 -2.316 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.911 3.715 -0.601 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -20.877 4.393 -3.426 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -22.235 5.114 -2.556 1.00 0.00 H new ATOM 437 N THR A 28 -14.988 6.031 -0.908 1.00 0.00 N ATOM 438 CA THR A 28 -13.970 7.060 -0.869 1.00 0.00 C ATOM 439 C THR A 28 -12.677 6.514 -0.292 1.00 0.00 C ATOM 440 O THR A 28 -12.642 5.397 0.231 1.00 0.00 O ATOM 441 CB THR A 28 -14.420 8.268 -0.026 1.00 0.00 C ATOM 442 OG1 THR A 28 -14.586 7.874 1.342 1.00 0.00 O ATOM 443 CG2 THR A 28 -15.725 8.839 -0.553 1.00 0.00 C ATOM 0 H THR A 28 -15.119 5.531 -0.029 1.00 0.00 H new ATOM 0 HA THR A 28 -13.807 7.386 -1.896 1.00 0.00 H new ATOM 0 HB THR A 28 -13.651 9.037 -0.094 1.00 0.00 H new ATOM 0 HG1 THR A 28 -15.421 7.370 1.438 1.00 0.00 H new ATOM 0 HG21 THR A 28 -16.023 9.691 0.058 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.590 9.162 -1.585 1.00 0.00 H new ATOM 0 HG23 THR A 28 -16.500 8.074 -0.511 1.00 0.00 H new ATOM 451 N LEU A 29 -11.623 7.302 -0.380 1.00 0.00 N ATOM 452 CA LEU A 29 -10.357 6.950 0.236 1.00 0.00 C ATOM 453 C LEU A 29 -10.508 6.949 1.752 1.00 0.00 C ATOM 454 O LEU A 29 -9.839 6.196 2.462 1.00 0.00 O ATOM 455 CB LEU A 29 -9.280 7.944 -0.189 1.00 0.00 C ATOM 456 CG LEU A 29 -9.085 8.072 -1.698 1.00 0.00 C ATOM 457 CD1 LEU A 29 -8.059 9.145 -2.015 1.00 0.00 C ATOM 458 CD2 LEU A 29 -8.672 6.740 -2.296 1.00 0.00 C ATOM 0 H LEU A 29 -11.618 8.194 -0.874 1.00 0.00 H new ATOM 0 HA LEU A 29 -10.060 5.953 -0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.531 8.925 0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.333 7.647 0.261 1.00 0.00 H new ATOM 0 HG LEU A 29 -10.035 8.367 -2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.934 9.221 -3.095 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.400 10.102 -1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -7.105 8.883 -1.557 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -8.538 6.850 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.735 6.413 -1.845 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -9.446 5.998 -2.101 1.00 0.00 H new ATOM 470 N GLU A 30 -11.426 7.784 2.229 1.00 0.00 N ATOM 471 CA GLU A 30 -11.723 7.890 3.649 1.00 0.00 C ATOM 472 C GLU A 30 -12.327 6.592 4.163 1.00 0.00 C ATOM 473 O GLU A 30 -12.157 6.234 5.325 1.00 0.00 O ATOM 474 CB GLU A 30 -12.681 9.052 3.903 1.00 0.00 C ATOM 475 CG GLU A 30 -12.121 10.398 3.474 1.00 0.00 C ATOM 476 CD GLU A 30 -13.100 11.535 3.684 1.00 0.00 C ATOM 477 OE1 GLU A 30 -13.024 12.212 4.733 1.00 0.00 O ATOM 478 OE2 GLU A 30 -13.947 11.764 2.800 1.00 0.00 O ATOM 0 H GLU A 30 -11.983 8.404 1.641 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.792 8.078 4.185 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.614 8.868 3.370 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -12.923 9.089 4.965 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -11.209 10.602 4.034 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -11.845 10.352 2.421 1.00 0.00 H new ATOM 485 N ASP A 31 -13.036 5.894 3.287 1.00 0.00 N ATOM 486 CA ASP A 31 -13.601 4.600 3.630 1.00 0.00 C ATOM 487 C ASP A 31 -12.546 3.520 3.494 1.00 0.00 C ATOM 488 O ASP A 31 -12.402 2.659 4.356 1.00 0.00 O ATOM 489 CB ASP A 31 -14.784 4.252 2.723 1.00 0.00 C ATOM 490 CG ASP A 31 -15.898 5.271 2.764 1.00 0.00 C ATOM 491 OD1 ASP A 31 -16.194 5.868 1.709 1.00 0.00 O ATOM 492 OD2 ASP A 31 -16.488 5.480 3.843 1.00 0.00 O ATOM 0 H ASP A 31 -13.233 6.203 2.335 1.00 0.00 H new ATOM 0 HA ASP A 31 -13.951 4.655 4.661 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.428 4.156 1.697 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -15.181 3.280 3.015 1.00 0.00 H new ATOM 497 N PHE A 32 -11.797 3.586 2.403 1.00 0.00 N ATOM 498 CA PHE A 32 -10.832 2.548 2.078 1.00 0.00 C ATOM 499 C PHE A 32 -9.699 2.484 3.097 1.00 0.00 C ATOM 500 O PHE A 32 -9.126 1.430 3.317 1.00 0.00 O ATOM 501 CB PHE A 32 -10.268 2.762 0.677 1.00 0.00 C ATOM 502 CG PHE A 32 -9.471 1.590 0.173 1.00 0.00 C ATOM 503 CD1 PHE A 32 -10.089 0.557 -0.512 1.00 0.00 C ATOM 504 CD2 PHE A 32 -8.108 1.518 0.392 1.00 0.00 C ATOM 505 CE1 PHE A 32 -9.358 -0.521 -0.969 1.00 0.00 C ATOM 506 CE2 PHE A 32 -7.377 0.446 -0.062 1.00 0.00 C ATOM 507 CZ PHE A 32 -8.000 -0.576 -0.743 1.00 0.00 C ATOM 0 H PHE A 32 -11.840 4.349 1.727 1.00 0.00 H new ATOM 0 HA PHE A 32 -11.359 1.594 2.110 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.089 2.958 -0.012 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -9.635 3.649 0.679 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.153 0.595 -0.690 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -7.611 2.314 0.927 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -9.850 -1.320 -1.503 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.312 0.405 0.116 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.426 -1.418 -1.099 1.00 0.00 H new ATOM 517 N LYS A 33 -9.377 3.603 3.729 1.00 0.00 N ATOM 518 CA LYS A 33 -8.336 3.608 4.754 1.00 0.00 C ATOM 519 C LYS A 33 -8.791 2.843 5.997 1.00 0.00 C ATOM 520 O LYS A 33 -8.013 2.613 6.922 1.00 0.00 O ATOM 521 CB LYS A 33 -7.953 5.036 5.129 1.00 0.00 C ATOM 522 CG LYS A 33 -9.105 5.842 5.693 1.00 0.00 C ATOM 523 CD LYS A 33 -8.665 7.224 6.141 1.00 0.00 C ATOM 524 CE LYS A 33 -8.125 8.052 4.987 1.00 0.00 C ATOM 525 NZ LYS A 33 -7.825 9.443 5.407 1.00 0.00 N ATOM 0 H LYS A 33 -9.813 4.509 3.556 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.459 3.109 4.341 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.147 5.007 5.862 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.563 5.543 4.246 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -9.885 5.937 4.938 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.542 5.309 6.537 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.509 7.743 6.596 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -7.897 7.129 6.909 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.220 7.586 4.596 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -8.853 8.065 4.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.459 9.979 4.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.694 9.895 5.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.112 9.431 6.164 1.00 0.00 H new ATOM 539 N GLU A 34 -10.060 2.460 6.008 1.00 0.00 N ATOM 540 CA GLU A 34 -10.626 1.681 7.096 1.00 0.00 C ATOM 541 C GLU A 34 -10.779 0.230 6.655 1.00 0.00 C ATOM 542 O GLU A 34 -11.285 -0.620 7.391 1.00 0.00 O ATOM 543 CB GLU A 34 -11.984 2.253 7.493 1.00 0.00 C ATOM 544 CG GLU A 34 -11.989 3.767 7.603 1.00 0.00 C ATOM 545 CD GLU A 34 -13.301 4.314 8.118 1.00 0.00 C ATOM 546 OE1 GLU A 34 -14.277 4.372 7.343 1.00 0.00 O ATOM 547 OE2 GLU A 34 -13.362 4.694 9.305 1.00 0.00 O ATOM 0 H GLU A 34 -10.723 2.680 5.265 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.960 1.726 7.958 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -12.728 1.947 6.758 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -12.285 1.825 8.449 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -11.184 4.081 8.268 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -11.780 4.198 6.624 1.00 0.00 H new ATOM 554 N LEU A 35 -10.338 -0.036 5.438 1.00 0.00 N ATOM 555 CA LEU A 35 -10.430 -1.354 4.845 1.00 0.00 C ATOM 556 C LEU A 35 -9.380 -2.272 5.458 1.00 0.00 C ATOM 557 O LEU A 35 -8.193 -1.960 5.470 1.00 0.00 O ATOM 558 CB LEU A 35 -10.255 -1.223 3.324 1.00 0.00 C ATOM 559 CG LEU A 35 -10.456 -2.480 2.481 1.00 0.00 C ATOM 560 CD1 LEU A 35 -9.234 -3.378 2.549 1.00 0.00 C ATOM 561 CD2 LEU A 35 -11.708 -3.220 2.924 1.00 0.00 C ATOM 0 H LEU A 35 -9.904 0.661 4.832 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.406 -1.796 5.045 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.953 -0.465 2.969 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -9.250 -0.846 3.132 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.588 -2.181 1.441 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.401 -4.267 1.941 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.365 -2.839 2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.057 -3.674 3.583 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.838 -4.114 2.314 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.610 -3.507 3.971 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.575 -2.571 2.805 1.00 0.00 H new ATOM 573 N ARG A 36 -9.830 -3.404 5.976 1.00 0.00 N ATOM 574 CA ARG A 36 -8.941 -4.342 6.638 1.00 0.00 C ATOM 575 C ARG A 36 -9.146 -5.745 6.098 1.00 0.00 C ATOM 576 O ARG A 36 -10.106 -5.985 5.364 1.00 0.00 O ATOM 577 CB ARG A 36 -9.170 -4.317 8.150 1.00 0.00 C ATOM 578 CG ARG A 36 -8.881 -2.966 8.786 1.00 0.00 C ATOM 579 CD ARG A 36 -7.454 -2.527 8.510 1.00 0.00 C ATOM 580 NE ARG A 36 -7.163 -1.203 9.051 1.00 0.00 N ATOM 581 CZ ARG A 36 -6.049 -0.530 8.776 1.00 0.00 C ATOM 582 NH1 ARG A 36 -5.137 -1.058 7.977 1.00 0.00 N ATOM 583 NH2 ARG A 36 -5.840 0.668 9.299 1.00 0.00 N ATOM 0 H ARG A 36 -10.807 -3.695 5.950 1.00 0.00 H new ATOM 0 HA ARG A 36 -7.913 -4.041 6.435 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -10.204 -4.593 8.357 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -8.538 -5.072 8.618 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.576 -2.221 8.397 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.045 -3.024 9.862 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -6.764 -3.252 8.942 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.280 -2.523 7.434 1.00 0.00 H new ATOM 0 HE ARG A 36 -7.848 -0.772 9.671 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -5.288 -1.982 7.571 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -4.283 -0.542 7.766 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -6.536 1.082 9.919 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -4.983 1.177 9.082 1.00 0.00 H new ATOM 597 N GLU A 37 -8.260 -6.665 6.452 1.00 0.00 N ATOM 598 CA GLU A 37 -8.349 -8.028 5.945 1.00 0.00 C ATOM 599 C GLU A 37 -9.655 -8.669 6.390 1.00 0.00 C ATOM 600 O GLU A 37 -10.326 -9.350 5.613 1.00 0.00 O ATOM 601 CB GLU A 37 -7.168 -8.866 6.423 1.00 0.00 C ATOM 602 CG GLU A 37 -7.138 -10.249 5.799 1.00 0.00 C ATOM 603 CD GLU A 37 -5.949 -11.070 6.240 1.00 0.00 C ATOM 604 OE1 GLU A 37 -6.019 -11.701 7.311 1.00 0.00 O ATOM 605 OE2 GLU A 37 -4.938 -11.097 5.508 1.00 0.00 O ATOM 0 H GLU A 37 -7.477 -6.495 7.083 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.323 -7.988 4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.240 -8.346 6.187 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.212 -8.963 7.508 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.055 -10.779 6.059 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.123 -10.152 4.713 1.00 0.00 H new ATOM 612 N THR A 38 -10.021 -8.412 7.638 1.00 0.00 N ATOM 613 CA THR A 38 -11.271 -8.902 8.191 1.00 0.00 C ATOM 614 C THR A 38 -12.448 -8.422 7.347 1.00 0.00 C ATOM 615 O THR A 38 -13.449 -9.122 7.193 1.00 0.00 O ATOM 616 CB THR A 38 -11.446 -8.417 9.641 1.00 0.00 C ATOM 617 OG1 THR A 38 -10.276 -8.741 10.405 1.00 0.00 O ATOM 618 CG2 THR A 38 -12.668 -9.049 10.284 1.00 0.00 C ATOM 0 H THR A 38 -9.462 -7.861 8.290 1.00 0.00 H new ATOM 0 HA THR A 38 -11.244 -9.992 8.182 1.00 0.00 H new ATOM 0 HB THR A 38 -11.587 -7.336 9.625 1.00 0.00 H new ATOM 0 HG1 THR A 38 -10.391 -8.429 11.327 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.768 -8.689 11.308 1.00 0.00 H new ATOM 0 HG22 THR A 38 -13.558 -8.779 9.716 1.00 0.00 H new ATOM 0 HG23 THR A 38 -12.556 -10.133 10.290 1.00 0.00 H new ATOM 626 N HIS A 39 -12.299 -7.234 6.780 1.00 0.00 N ATOM 627 CA HIS A 39 -13.326 -6.660 5.932 1.00 0.00 C ATOM 628 C HIS A 39 -13.300 -7.327 4.568 1.00 0.00 C ATOM 629 O HIS A 39 -14.336 -7.635 4.007 1.00 0.00 O ATOM 630 CB HIS A 39 -13.143 -5.147 5.803 1.00 0.00 C ATOM 631 CG HIS A 39 -13.361 -4.417 7.093 1.00 0.00 C ATOM 632 ND1 HIS A 39 -12.981 -3.108 7.304 1.00 0.00 N ATOM 633 CD2 HIS A 39 -13.926 -4.831 8.249 1.00 0.00 C ATOM 634 CE1 HIS A 39 -13.299 -2.754 8.534 1.00 0.00 C ATOM 635 NE2 HIS A 39 -13.875 -3.781 9.129 1.00 0.00 N ATOM 0 H HIS A 39 -11.472 -6.649 6.894 1.00 0.00 H new ATOM 0 HA HIS A 39 -14.299 -6.838 6.390 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -12.137 -4.938 5.440 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -13.837 -4.765 5.055 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -14.341 -5.809 8.444 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -13.118 -1.787 8.979 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -14.225 -3.792 10.087 1.00 0.00 H new ATOM 644 N LEU A 40 -12.102 -7.579 4.058 1.00 0.00 N ATOM 645 CA LEU A 40 -11.939 -8.295 2.796 1.00 0.00 C ATOM 646 C LEU A 40 -12.554 -9.677 2.870 1.00 0.00 C ATOM 647 O LEU A 40 -13.094 -10.177 1.887 1.00 0.00 O ATOM 648 CB LEU A 40 -10.460 -8.400 2.431 1.00 0.00 C ATOM 649 CG LEU A 40 -9.961 -7.402 1.386 1.00 0.00 C ATOM 650 CD1 LEU A 40 -10.794 -6.134 1.392 1.00 0.00 C ATOM 651 CD2 LEU A 40 -8.506 -7.067 1.646 1.00 0.00 C ATOM 0 H LEU A 40 -11.226 -7.298 4.499 1.00 0.00 H new ATOM 0 HA LEU A 40 -12.457 -7.731 2.021 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.871 -8.272 3.339 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.266 -9.408 2.065 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.058 -7.864 0.404 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -10.413 -5.445 0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -11.832 -6.380 1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.736 -5.665 2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.157 -6.355 0.898 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.405 -6.628 2.639 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.907 -7.976 1.589 1.00 0.00 H new ATOM 663 N ASN A 41 -12.476 -10.285 4.041 1.00 0.00 N ATOM 664 CA ASN A 41 -13.116 -11.568 4.274 1.00 0.00 C ATOM 665 C ASN A 41 -14.624 -11.439 4.106 1.00 0.00 C ATOM 666 O ASN A 41 -15.282 -12.333 3.574 1.00 0.00 O ATOM 667 CB ASN A 41 -12.777 -12.097 5.669 1.00 0.00 C ATOM 668 CG ASN A 41 -11.317 -12.491 5.798 1.00 0.00 C ATOM 669 OD1 ASN A 41 -10.670 -12.852 4.817 1.00 0.00 O ATOM 670 ND2 ASN A 41 -10.794 -12.447 7.013 1.00 0.00 N ATOM 0 H ASN A 41 -11.975 -9.910 4.846 1.00 0.00 H new ATOM 0 HA ASN A 41 -12.740 -12.281 3.540 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -13.012 -11.334 6.411 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -13.405 -12.960 5.890 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -9.822 -12.718 7.160 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -11.363 -12.142 7.802 1.00 0.00 H new ATOM 677 N GLU A 42 -15.154 -10.303 4.534 1.00 0.00 N ATOM 678 CA GLU A 42 -16.572 -10.009 4.406 1.00 0.00 C ATOM 679 C GLU A 42 -16.921 -9.677 2.958 1.00 0.00 C ATOM 680 O GLU A 42 -17.989 -10.030 2.463 1.00 0.00 O ATOM 681 CB GLU A 42 -16.936 -8.838 5.313 1.00 0.00 C ATOM 682 CG GLU A 42 -16.699 -9.115 6.786 1.00 0.00 C ATOM 683 CD GLU A 42 -17.504 -10.293 7.294 1.00 0.00 C ATOM 684 OE1 GLU A 42 -16.910 -11.362 7.545 1.00 0.00 O ATOM 685 OE2 GLU A 42 -18.735 -10.154 7.440 1.00 0.00 O ATOM 0 H GLU A 42 -14.614 -9.561 4.979 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.142 -10.888 4.705 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.353 -7.965 5.017 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.986 -8.586 5.163 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.639 -9.307 6.950 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.956 -8.228 7.365 1.00 0.00 H new ATOM 692 N LEU A 43 -16.000 -9.000 2.286 1.00 0.00 N ATOM 693 CA LEU A 43 -16.164 -8.635 0.885 1.00 0.00 C ATOM 694 C LEU A 43 -15.905 -9.831 -0.026 1.00 0.00 C ATOM 695 O LEU A 43 -16.060 -9.743 -1.247 1.00 0.00 O ATOM 696 CB LEU A 43 -15.214 -7.490 0.521 1.00 0.00 C ATOM 697 CG LEU A 43 -15.713 -6.078 0.843 1.00 0.00 C ATOM 698 CD1 LEU A 43 -15.936 -5.885 2.330 1.00 0.00 C ATOM 699 CD2 LEU A 43 -14.735 -5.044 0.324 1.00 0.00 C ATOM 0 H LEU A 43 -15.119 -8.689 2.696 1.00 0.00 H new ATOM 0 HA LEU A 43 -17.194 -8.308 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -14.269 -7.648 1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -15.002 -7.545 -0.547 1.00 0.00 H new ATOM 0 HG LEU A 43 -16.673 -5.948 0.344 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -16.290 -4.871 2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -16.680 -6.599 2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -14.999 -6.046 2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -15.102 -4.045 0.560 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.763 -5.194 0.795 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -14.635 -5.148 -0.756 1.00 0.00 H new ATOM 711 N ASN A 44 -15.494 -10.934 0.591 1.00 0.00 N ATOM 712 CA ASN A 44 -15.225 -12.194 -0.102 1.00 0.00 C ATOM 713 C ASN A 44 -14.011 -12.056 -1.016 1.00 0.00 C ATOM 714 O ASN A 44 -13.895 -12.720 -2.044 1.00 0.00 O ATOM 715 CB ASN A 44 -16.458 -12.664 -0.882 1.00 0.00 C ATOM 716 CG ASN A 44 -16.417 -14.146 -1.215 1.00 0.00 C ATOM 717 OD1 ASN A 44 -16.809 -14.983 -0.403 1.00 0.00 O ATOM 718 ND2 ASN A 44 -15.962 -14.482 -2.411 1.00 0.00 N ATOM 0 H ASN A 44 -15.336 -10.981 1.598 1.00 0.00 H new ATOM 0 HA ASN A 44 -14.998 -12.954 0.645 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -17.354 -12.453 -0.298 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -16.537 -12.091 -1.806 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -15.928 -15.464 -2.686 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -15.645 -13.760 -3.058 1.00 0.00 H new ATOM 725 N ILE A 45 -13.100 -11.183 -0.628 1.00 0.00 N ATOM 726 CA ILE A 45 -11.844 -11.026 -1.331 1.00 0.00 C ATOM 727 C ILE A 45 -10.814 -11.955 -0.712 1.00 0.00 C ATOM 728 O ILE A 45 -10.001 -11.553 0.113 1.00 0.00 O ATOM 729 CB ILE A 45 -11.343 -9.571 -1.302 1.00 0.00 C ATOM 730 CG1 ILE A 45 -12.418 -8.647 -1.877 1.00 0.00 C ATOM 731 CG2 ILE A 45 -10.039 -9.439 -2.086 1.00 0.00 C ATOM 732 CD1 ILE A 45 -12.033 -7.186 -1.881 1.00 0.00 C ATOM 0 H ILE A 45 -13.210 -10.567 0.178 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.000 -11.285 -2.378 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.145 -9.281 -0.270 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.641 -8.957 -2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -13.335 -8.769 -1.300 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.699 -8.404 -2.055 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.280 -10.083 -1.642 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -10.206 -9.735 -3.122 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -12.847 -6.596 -2.303 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -11.839 -6.858 -0.860 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -11.135 -7.048 -2.483 1.00 0.00 H new ATOM 744 N MET A 46 -10.902 -13.215 -1.086 1.00 0.00 N ATOM 745 CA MET A 46 -10.045 -14.251 -0.532 1.00 0.00 C ATOM 746 C MET A 46 -8.669 -14.201 -1.172 1.00 0.00 C ATOM 747 O MET A 46 -7.730 -14.843 -0.701 1.00 0.00 O ATOM 748 CB MET A 46 -10.678 -15.622 -0.759 1.00 0.00 C ATOM 749 CG MET A 46 -12.098 -15.754 -0.219 1.00 0.00 C ATOM 750 SD MET A 46 -12.179 -15.913 1.580 1.00 0.00 S ATOM 751 CE MET A 46 -12.168 -14.200 2.102 1.00 0.00 C ATOM 0 H MET A 46 -11.568 -13.553 -1.781 1.00 0.00 H new ATOM 0 HA MET A 46 -9.935 -14.079 0.539 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.687 -15.832 -1.828 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.051 -16.381 -0.290 1.00 0.00 H new ATOM 0 HG2 MET A 46 -12.676 -14.882 -0.524 1.00 0.00 H new ATOM 0 HG3 MET A 46 -12.571 -16.625 -0.674 1.00 0.00 H new ATOM 0 HE1 MET A 46 -11.182 -13.944 2.489 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.402 -13.559 1.252 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.913 -14.053 2.884 1.00 0.00 H new ATOM 761 N ASP A 47 -8.576 -13.426 -2.248 1.00 0.00 N ATOM 762 CA ASP A 47 -7.332 -13.207 -2.980 1.00 0.00 C ATOM 763 C ASP A 47 -6.243 -12.691 -2.043 1.00 0.00 C ATOM 764 O ASP A 47 -6.245 -11.523 -1.673 1.00 0.00 O ATOM 765 CB ASP A 47 -7.565 -12.162 -4.070 1.00 0.00 C ATOM 766 CG ASP A 47 -8.658 -12.516 -5.052 1.00 0.00 C ATOM 767 OD1 ASP A 47 -8.716 -13.675 -5.504 1.00 0.00 O ATOM 768 OD2 ASP A 47 -9.456 -11.613 -5.393 1.00 0.00 O ATOM 0 H ASP A 47 -9.373 -12.926 -2.642 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.016 -14.154 -3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.812 -11.211 -3.598 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.635 -12.013 -4.619 1.00 0.00 H new ATOM 773 N PRO A 48 -5.280 -13.555 -1.680 1.00 0.00 N ATOM 774 CA PRO A 48 -4.273 -13.255 -0.652 1.00 0.00 C ATOM 775 C PRO A 48 -3.374 -12.071 -0.996 1.00 0.00 C ATOM 776 O PRO A 48 -3.199 -11.166 -0.180 1.00 0.00 O ATOM 777 CB PRO A 48 -3.443 -14.536 -0.561 1.00 0.00 C ATOM 778 CG PRO A 48 -4.281 -15.590 -1.192 1.00 0.00 C ATOM 779 CD PRO A 48 -5.092 -14.898 -2.244 1.00 0.00 C ATOM 0 HA PRO A 48 -4.756 -12.968 0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -2.491 -14.426 -1.081 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -3.213 -14.784 0.475 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.660 -16.372 -1.629 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -4.925 -16.069 -0.455 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -4.570 -14.865 -3.200 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -6.044 -15.401 -2.417 1.00 0.00 H new ATOM 787 N GLN A 49 -2.790 -12.081 -2.188 1.00 0.00 N ATOM 788 CA GLN A 49 -1.928 -10.986 -2.612 1.00 0.00 C ATOM 789 C GLN A 49 -2.748 -9.726 -2.823 1.00 0.00 C ATOM 790 O GLN A 49 -2.304 -8.624 -2.515 1.00 0.00 O ATOM 791 CB GLN A 49 -1.166 -11.342 -3.890 1.00 0.00 C ATOM 792 CG GLN A 49 -0.009 -12.300 -3.659 1.00 0.00 C ATOM 793 CD GLN A 49 0.692 -12.696 -4.943 1.00 0.00 C ATOM 794 OE1 GLN A 49 0.315 -13.666 -5.601 1.00 0.00 O ATOM 795 NE2 GLN A 49 1.732 -11.960 -5.303 1.00 0.00 N ATOM 0 H GLN A 49 -2.896 -12.829 -2.873 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.197 -10.808 -1.824 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.859 -11.787 -4.605 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.785 -10.427 -4.343 1.00 0.00 H new ATOM 0 HG2 GLN A 49 0.712 -11.836 -2.985 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.379 -13.196 -3.161 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.015 -11.163 -4.732 1.00 0.00 H new ATOM 0 HE22 GLN A 49 2.250 -12.190 -6.151 1.00 0.00 H new ATOM 804 N HIS A 50 -3.960 -9.898 -3.325 1.00 0.00 N ATOM 805 CA HIS A 50 -4.850 -8.768 -3.553 1.00 0.00 C ATOM 806 C HIS A 50 -5.240 -8.147 -2.224 1.00 0.00 C ATOM 807 O HIS A 50 -5.275 -6.928 -2.087 1.00 0.00 O ATOM 808 CB HIS A 50 -6.094 -9.202 -4.324 1.00 0.00 C ATOM 809 CG HIS A 50 -5.800 -9.712 -5.705 1.00 0.00 C ATOM 810 ND1 HIS A 50 -6.777 -10.135 -6.585 1.00 0.00 N ATOM 811 CD2 HIS A 50 -4.624 -9.854 -6.360 1.00 0.00 C ATOM 812 CE1 HIS A 50 -6.211 -10.513 -7.715 1.00 0.00 C ATOM 813 NE2 HIS A 50 -4.908 -10.350 -7.604 1.00 0.00 N ATOM 0 H HIS A 50 -4.350 -10.805 -3.582 1.00 0.00 H new ATOM 0 HA HIS A 50 -4.325 -8.026 -4.154 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -6.607 -9.981 -3.760 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -6.779 -8.357 -4.396 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -3.643 -9.619 -5.973 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -6.728 -10.892 -8.584 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -4.221 -10.560 -8.329 1.00 0.00 H new ATOM 822 N ARG A 51 -5.527 -9.008 -1.252 1.00 0.00 N ATOM 823 CA ARG A 51 -5.741 -8.585 0.124 1.00 0.00 C ATOM 824 C ARG A 51 -4.567 -7.757 0.601 1.00 0.00 C ATOM 825 O ARG A 51 -4.729 -6.633 1.063 1.00 0.00 O ATOM 826 CB ARG A 51 -5.895 -9.804 1.036 1.00 0.00 C ATOM 827 CG ARG A 51 -7.252 -10.475 0.955 1.00 0.00 C ATOM 828 CD ARG A 51 -7.175 -11.939 1.362 1.00 0.00 C ATOM 829 NE ARG A 51 -6.443 -12.142 2.612 1.00 0.00 N ATOM 830 CZ ARG A 51 -5.999 -13.331 3.023 1.00 0.00 C ATOM 831 NH1 ARG A 51 -6.234 -14.419 2.297 1.00 0.00 N ATOM 832 NH2 ARG A 51 -5.319 -13.430 4.158 1.00 0.00 N ATOM 0 H ARG A 51 -5.617 -10.014 -1.397 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.651 -7.987 0.162 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -5.126 -10.533 0.781 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -5.715 -9.498 2.066 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.957 -9.953 1.602 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.637 -10.399 -0.062 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -8.185 -12.335 1.469 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.692 -12.507 0.567 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.262 -11.330 3.202 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.755 -14.346 1.423 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.893 -15.327 2.614 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.135 -12.597 4.717 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.980 -14.339 4.472 1.00 0.00 H new ATOM 846 N ALA A 52 -3.381 -8.333 0.454 1.00 0.00 N ATOM 847 CA ALA A 52 -2.149 -7.703 0.881 1.00 0.00 C ATOM 848 C ALA A 52 -2.009 -6.304 0.288 1.00 0.00 C ATOM 849 O ALA A 52 -1.654 -5.357 0.990 1.00 0.00 O ATOM 850 CB ALA A 52 -0.977 -8.582 0.483 1.00 0.00 C ATOM 0 H ALA A 52 -3.251 -9.253 0.033 1.00 0.00 H new ATOM 0 HA ALA A 52 -2.164 -7.592 1.965 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.046 -8.113 0.802 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.075 -9.557 0.961 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.968 -8.708 -0.600 1.00 0.00 H new ATOM 856 N LYS A 53 -2.306 -6.176 -1.000 1.00 0.00 N ATOM 857 CA LYS A 53 -2.249 -4.882 -1.669 1.00 0.00 C ATOM 858 C LYS A 53 -3.287 -3.927 -1.094 1.00 0.00 C ATOM 859 O LYS A 53 -2.960 -2.811 -0.696 1.00 0.00 O ATOM 860 CB LYS A 53 -2.459 -5.032 -3.179 1.00 0.00 C ATOM 861 CG LYS A 53 -1.486 -6.003 -3.826 1.00 0.00 C ATOM 862 CD LYS A 53 -1.310 -5.760 -5.318 1.00 0.00 C ATOM 863 CE LYS A 53 -0.375 -4.594 -5.585 1.00 0.00 C ATOM 864 NZ LYS A 53 -0.117 -4.401 -7.036 1.00 0.00 N ATOM 0 H LYS A 53 -2.588 -6.951 -1.601 1.00 0.00 H new ATOM 0 HA LYS A 53 -1.256 -4.467 -1.496 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.478 -5.371 -3.365 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.356 -4.055 -3.652 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -0.517 -5.921 -3.333 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.839 -7.022 -3.668 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -0.915 -6.660 -5.790 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.281 -5.561 -5.772 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -0.806 -3.683 -5.170 1.00 0.00 H new ATOM 0 HE3 LYS A 53 0.570 -4.763 -5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 0.639 -3.699 -7.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 0.175 -5.305 -7.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.984 -4.064 -7.501 1.00 0.00 H new ATOM 878 N LEU A 54 -4.530 -4.385 -1.034 1.00 0.00 N ATOM 879 CA LEU A 54 -5.635 -3.576 -0.537 1.00 0.00 C ATOM 880 C LEU A 54 -5.352 -3.048 0.867 1.00 0.00 C ATOM 881 O LEU A 54 -5.561 -1.867 1.151 1.00 0.00 O ATOM 882 CB LEU A 54 -6.921 -4.401 -0.538 1.00 0.00 C ATOM 883 CG LEU A 54 -7.419 -4.817 -1.923 1.00 0.00 C ATOM 884 CD1 LEU A 54 -8.534 -5.838 -1.805 1.00 0.00 C ATOM 885 CD2 LEU A 54 -7.895 -3.608 -2.704 1.00 0.00 C ATOM 0 H LEU A 54 -4.800 -5.324 -1.327 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.752 -2.718 -1.199 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.760 -5.299 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.704 -3.826 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.587 -5.272 -2.461 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.875 -6.121 -2.801 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -8.165 -6.721 -1.283 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.365 -5.407 -1.246 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -8.245 -3.924 -3.686 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.711 -3.125 -2.166 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.071 -2.904 -2.822 1.00 0.00 H new ATOM 897 N LEU A 55 -4.856 -3.921 1.735 1.00 0.00 N ATOM 898 CA LEU A 55 -4.540 -3.540 3.107 1.00 0.00 C ATOM 899 C LEU A 55 -3.443 -2.487 3.138 1.00 0.00 C ATOM 900 O LEU A 55 -3.526 -1.521 3.885 1.00 0.00 O ATOM 901 CB LEU A 55 -4.114 -4.760 3.935 1.00 0.00 C ATOM 902 CG LEU A 55 -5.248 -5.655 4.461 1.00 0.00 C ATOM 903 CD1 LEU A 55 -6.605 -5.171 3.987 1.00 0.00 C ATOM 904 CD2 LEU A 55 -5.028 -7.100 4.044 1.00 0.00 C ATOM 0 H LEU A 55 -4.664 -4.898 1.514 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.444 -3.119 3.547 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.450 -5.372 3.325 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.532 -4.409 4.787 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.234 -5.597 5.549 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.382 -5.827 4.378 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.774 -4.155 4.344 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.635 -5.182 2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.841 -7.717 4.426 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.003 -7.165 2.956 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.081 -7.456 4.450 1.00 0.00 H new ATOM 916 N THR A 56 -2.429 -2.672 2.306 1.00 0.00 N ATOM 917 CA THR A 56 -1.314 -1.738 2.239 1.00 0.00 C ATOM 918 C THR A 56 -1.778 -0.379 1.753 1.00 0.00 C ATOM 919 O THR A 56 -1.350 0.662 2.259 1.00 0.00 O ATOM 920 CB THR A 56 -0.229 -2.255 1.294 1.00 0.00 C ATOM 921 OG1 THR A 56 0.127 -3.578 1.672 1.00 0.00 O ATOM 922 CG2 THR A 56 0.998 -1.365 1.336 1.00 0.00 C ATOM 0 H THR A 56 -2.355 -3.463 1.666 1.00 0.00 H new ATOM 0 HA THR A 56 -0.906 -1.644 3.245 1.00 0.00 H new ATOM 0 HB THR A 56 -0.620 -2.249 0.276 1.00 0.00 H new ATOM 0 HG1 THR A 56 -0.441 -4.219 1.195 1.00 0.00 H new ATOM 0 HG21 THR A 56 1.754 -1.755 0.655 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.725 -0.354 1.034 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.398 -1.345 2.350 1.00 0.00 H new ATOM 930 N ALA A 57 -2.655 -0.396 0.763 1.00 0.00 N ATOM 931 CA ALA A 57 -3.221 0.822 0.241 1.00 0.00 C ATOM 932 C ALA A 57 -4.008 1.534 1.331 1.00 0.00 C ATOM 933 O ALA A 57 -3.885 2.741 1.506 1.00 0.00 O ATOM 934 CB ALA A 57 -4.089 0.525 -0.964 1.00 0.00 C ATOM 0 H ALA A 57 -2.987 -1.246 0.308 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.417 1.482 -0.085 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.510 1.455 -1.347 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.486 0.053 -1.739 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.897 -0.146 -0.674 1.00 0.00 H new ATOM 940 N ALA A 58 -4.787 0.770 2.085 1.00 0.00 N ATOM 941 CA ALA A 58 -5.523 1.314 3.218 1.00 0.00 C ATOM 942 C ALA A 58 -4.570 1.936 4.234 1.00 0.00 C ATOM 943 O ALA A 58 -4.824 3.022 4.756 1.00 0.00 O ATOM 944 CB ALA A 58 -6.357 0.227 3.870 1.00 0.00 C ATOM 0 H ALA A 58 -4.926 -0.229 1.932 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.189 2.096 2.854 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.903 0.645 4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -7.064 -0.174 3.144 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.704 -0.573 4.219 1.00 0.00 H new ATOM 950 N GLU A 59 -3.466 1.241 4.487 1.00 0.00 N ATOM 951 CA GLU A 59 -2.436 1.712 5.406 1.00 0.00 C ATOM 952 C GLU A 59 -1.897 3.072 4.978 1.00 0.00 C ATOM 953 O GLU A 59 -1.875 4.026 5.760 1.00 0.00 O ATOM 954 CB GLU A 59 -1.284 0.705 5.459 1.00 0.00 C ATOM 955 CG GLU A 59 -1.667 -0.643 6.041 1.00 0.00 C ATOM 956 CD GLU A 59 -1.965 -0.587 7.524 1.00 0.00 C ATOM 957 OE1 GLU A 59 -1.303 -1.318 8.288 1.00 0.00 O ATOM 958 OE2 GLU A 59 -2.863 0.173 7.933 1.00 0.00 O ATOM 0 H GLU A 59 -3.260 0.337 4.062 1.00 0.00 H new ATOM 0 HA GLU A 59 -2.887 1.812 6.393 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -0.898 0.557 4.450 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -0.473 1.128 6.052 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.542 -1.024 5.515 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.857 -1.351 5.866 1.00 0.00 H new ATOM 965 N LEU A 60 -1.470 3.164 3.727 1.00 0.00 N ATOM 966 CA LEU A 60 -0.877 4.390 3.226 1.00 0.00 C ATOM 967 C LEU A 60 -1.920 5.477 2.987 1.00 0.00 C ATOM 968 O LEU A 60 -1.584 6.646 2.963 1.00 0.00 O ATOM 969 CB LEU A 60 -0.055 4.132 1.963 1.00 0.00 C ATOM 970 CG LEU A 60 1.431 3.853 2.204 1.00 0.00 C ATOM 971 CD1 LEU A 60 1.626 2.663 3.125 1.00 0.00 C ATOM 972 CD2 LEU A 60 2.143 3.634 0.887 1.00 0.00 C ATOM 0 H LEU A 60 -1.524 2.407 3.045 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.203 4.756 4.001 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.487 3.283 1.433 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.145 4.997 1.306 1.00 0.00 H new ATOM 0 HG LEU A 60 1.864 4.724 2.695 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.692 2.491 3.276 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.151 2.864 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.176 1.778 2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.199 3.437 1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.700 2.782 0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.044 4.525 0.267 1.00 0.00 H new ATOM 984 N LEU A 61 -3.181 5.110 2.814 1.00 0.00 N ATOM 985 CA LEU A 61 -4.236 6.119 2.742 1.00 0.00 C ATOM 986 C LEU A 61 -4.509 6.687 4.126 1.00 0.00 C ATOM 987 O LEU A 61 -4.922 7.837 4.272 1.00 0.00 O ATOM 988 CB LEU A 61 -5.528 5.540 2.175 1.00 0.00 C ATOM 989 CG LEU A 61 -5.475 5.095 0.718 1.00 0.00 C ATOM 990 CD1 LEU A 61 -6.864 4.714 0.253 1.00 0.00 C ATOM 991 CD2 LEU A 61 -4.896 6.192 -0.160 1.00 0.00 C ATOM 0 H LEU A 61 -3.498 4.145 2.722 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.890 6.909 2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.819 4.685 2.785 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.314 6.288 2.278 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.823 4.225 0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -6.824 4.396 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -7.242 3.897 0.868 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -7.527 5.574 0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.868 5.852 -1.195 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.519 7.083 -0.087 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.885 6.428 0.172 1.00 0.00 H new ATOM 1003 N LEU A 62 -4.286 5.862 5.133 1.00 0.00 N ATOM 1004 CA LEU A 62 -4.474 6.262 6.512 1.00 0.00 C ATOM 1005 C LEU A 62 -3.374 7.226 6.938 1.00 0.00 C ATOM 1006 O LEU A 62 -3.630 8.219 7.616 1.00 0.00 O ATOM 1007 CB LEU A 62 -4.474 5.022 7.405 1.00 0.00 C ATOM 1008 CG LEU A 62 -4.739 5.274 8.886 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -6.142 5.826 9.091 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -4.543 3.991 9.673 1.00 0.00 C ATOM 0 H LEU A 62 -3.970 4.899 5.017 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.432 6.773 6.611 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.228 4.329 7.033 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.508 4.526 7.307 1.00 0.00 H new ATOM 0 HG LEU A 62 -4.029 6.017 9.250 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.313 6.000 10.153 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.246 6.766 8.548 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.873 5.109 8.718 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -4.734 4.179 10.729 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.235 3.232 9.309 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.519 3.639 9.547 1.00 0.00 H new ATOM 1022 N ASP A 63 -2.153 6.928 6.528 1.00 0.00 N ATOM 1023 CA ASP A 63 -1.005 7.750 6.891 1.00 0.00 C ATOM 1024 C ASP A 63 -0.749 8.867 5.881 1.00 0.00 C ATOM 1025 O ASP A 63 -0.529 10.019 6.256 1.00 0.00 O ATOM 1026 CB ASP A 63 0.242 6.878 7.021 1.00 0.00 C ATOM 1027 CG ASP A 63 0.346 6.199 8.373 1.00 0.00 C ATOM 1028 OD1 ASP A 63 -0.409 5.243 8.625 1.00 0.00 O ATOM 1029 OD2 ASP A 63 1.198 6.611 9.186 1.00 0.00 O ATOM 0 H ASP A 63 -1.928 6.123 5.943 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.233 8.218 7.848 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.232 6.119 6.238 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.128 7.492 6.859 1.00 0.00 H new ATOM 1034 N TYR A 64 -0.783 8.529 4.604 1.00 0.00 N ATOM 1035 CA TYR A 64 -0.464 9.475 3.542 1.00 0.00 C ATOM 1036 C TYR A 64 -1.730 10.085 2.967 1.00 0.00 C ATOM 1037 O TYR A 64 -1.943 10.076 1.756 1.00 0.00 O ATOM 1038 CB TYR A 64 0.332 8.790 2.431 1.00 0.00 C ATOM 1039 CG TYR A 64 1.685 8.299 2.875 1.00 0.00 C ATOM 1040 CD1 TYR A 64 2.819 9.069 2.676 1.00 0.00 C ATOM 1041 CD2 TYR A 64 1.825 7.071 3.499 1.00 0.00 C ATOM 1042 CE1 TYR A 64 4.059 8.630 3.088 1.00 0.00 C ATOM 1043 CE2 TYR A 64 3.059 6.622 3.913 1.00 0.00 C ATOM 1044 CZ TYR A 64 4.174 7.404 3.706 1.00 0.00 C ATOM 1045 OH TYR A 64 5.406 6.959 4.119 1.00 0.00 O ATOM 0 H TYR A 64 -1.031 7.597 4.272 1.00 0.00 H new ATOM 0 HA TYR A 64 0.144 10.270 3.973 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -0.244 7.947 2.049 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.461 9.488 1.604 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.730 10.029 2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.953 6.456 3.664 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.934 9.243 2.928 1.00 0.00 H new ATOM 0 HE2 TYR A 64 3.152 5.661 4.398 1.00 0.00 H new ATOM 0 HH TYR A 64 5.872 7.679 4.593 1.00 0.00 H new ATOM 1124 N PRO B 2 4.598 7.953 7.967 1.00 0.00 N ATOM 1125 CA PRO B 2 6.000 7.543 7.865 1.00 0.00 C ATOM 1126 C PRO B 2 6.813 8.519 7.031 1.00 0.00 C ATOM 1127 O PRO B 2 6.574 8.678 5.834 1.00 0.00 O ATOM 1128 CB PRO B 2 5.945 6.183 7.167 1.00 0.00 C ATOM 1129 CG PRO B 2 4.534 5.728 7.297 1.00 0.00 C ATOM 1130 CD PRO B 2 3.702 6.974 7.346 1.00 0.00 C ATOM 0 HA PRO B 2 6.479 7.508 8.843 1.00 0.00 H new ATOM 0 HB2 PRO B 2 6.236 6.267 6.120 1.00 0.00 H new ATOM 0 HB3 PRO B 2 6.631 5.475 7.632 1.00 0.00 H new ATOM 0 HG2 PRO B 2 4.247 5.100 6.454 1.00 0.00 H new ATOM 0 HG3 PRO B 2 4.398 5.132 8.199 1.00 0.00 H new ATOM 0 HD2 PRO B 2 3.390 7.289 6.350 1.00 0.00 H new ATOM 0 HD3 PRO B 2 2.795 6.829 7.933 1.00 0.00 H new ATOM 1138 N LYS B 3 7.756 9.179 7.669 1.00 0.00 N ATOM 1139 CA LYS B 3 8.619 10.122 6.987 1.00 0.00 C ATOM 1140 C LYS B 3 9.819 9.404 6.393 1.00 0.00 C ATOM 1141 O LYS B 3 10.492 9.923 5.503 1.00 0.00 O ATOM 1142 CB LYS B 3 9.095 11.202 7.955 1.00 0.00 C ATOM 1143 CG LYS B 3 7.964 11.952 8.643 1.00 0.00 C ATOM 1144 CD LYS B 3 7.123 12.759 7.661 1.00 0.00 C ATOM 1145 CE LYS B 3 7.933 13.858 6.991 1.00 0.00 C ATOM 1146 NZ LYS B 3 7.076 14.765 6.185 1.00 0.00 N ATOM 0 H LYS B 3 7.946 9.079 8.666 1.00 0.00 H new ATOM 0 HA LYS B 3 8.050 10.590 6.184 1.00 0.00 H new ATOM 0 HB2 LYS B 3 9.728 10.743 8.714 1.00 0.00 H new ATOM 0 HB3 LYS B 3 9.714 11.916 7.412 1.00 0.00 H new ATOM 0 HG2 LYS B 3 7.325 11.241 9.166 1.00 0.00 H new ATOM 0 HG3 LYS B 3 8.380 12.621 9.397 1.00 0.00 H new ATOM 0 HD2 LYS B 3 6.715 12.094 6.900 1.00 0.00 H new ATOM 0 HD3 LYS B 3 6.276 13.201 8.186 1.00 0.00 H new ATOM 0 HE2 LYS B 3 8.459 14.436 7.751 1.00 0.00 H new ATOM 0 HE3 LYS B 3 8.692 13.410 6.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 7.666 15.500 5.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 6.593 14.218 5.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 6.368 15.213 6.802 1.00 0.00 H new ATOM 1160 N THR B 4 10.084 8.206 6.891 1.00 0.00 N ATOM 1161 CA THR B 4 11.240 7.456 6.455 1.00 0.00 C ATOM 1162 C THR B 4 10.863 6.066 5.963 1.00 0.00 C ATOM 1163 O THR B 4 9.750 5.581 6.211 1.00 0.00 O ATOM 1164 CB THR B 4 12.284 7.321 7.578 1.00 0.00 C ATOM 1165 OG1 THR B 4 11.693 6.687 8.716 1.00 0.00 O ATOM 1166 CG2 THR B 4 12.830 8.681 7.978 1.00 0.00 C ATOM 0 H THR B 4 9.513 7.738 7.595 1.00 0.00 H new ATOM 0 HA THR B 4 11.672 8.019 5.628 1.00 0.00 H new ATOM 0 HB THR B 4 13.109 6.713 7.207 1.00 0.00 H new ATOM 0 HG1 THR B 4 11.941 5.739 8.728 1.00 0.00 H new ATOM 0 HG21 THR B 4 13.566 8.558 8.773 1.00 0.00 H new ATOM 0 HG22 THR B 4 13.303 9.151 7.116 1.00 0.00 H new ATOM 0 HG23 THR B 4 12.014 9.311 8.333 1.00 0.00 H new ATOM 1174 N LEU B 5 11.803 5.433 5.285 1.00 0.00 N ATOM 1175 CA LEU B 5 11.612 4.100 4.740 1.00 0.00 C ATOM 1176 C LEU B 5 11.262 3.115 5.855 1.00 0.00 C ATOM 1177 O LEU B 5 10.292 2.360 5.758 1.00 0.00 O ATOM 1178 CB LEU B 5 12.895 3.687 4.002 1.00 0.00 C ATOM 1179 CG LEU B 5 12.811 2.446 3.113 1.00 0.00 C ATOM 1180 CD1 LEU B 5 13.038 1.177 3.916 1.00 0.00 C ATOM 1181 CD2 LEU B 5 11.472 2.403 2.403 1.00 0.00 C ATOM 0 H LEU B 5 12.724 5.830 5.096 1.00 0.00 H new ATOM 0 HA LEU B 5 10.780 4.095 4.036 1.00 0.00 H new ATOM 0 HB2 LEU B 5 13.216 4.526 3.385 1.00 0.00 H new ATOM 0 HB3 LEU B 5 13.675 3.520 4.745 1.00 0.00 H new ATOM 0 HG LEU B 5 13.602 2.507 2.365 1.00 0.00 H new ATOM 0 HD11 LEU B 5 12.972 0.312 3.256 1.00 0.00 H new ATOM 0 HD12 LEU B 5 14.026 1.209 4.375 1.00 0.00 H new ATOM 0 HD13 LEU B 5 12.279 1.098 4.694 1.00 0.00 H new ATOM 0 HD21 LEU B 5 11.423 1.515 1.773 1.00 0.00 H new ATOM 0 HD22 LEU B 5 10.670 2.369 3.140 1.00 0.00 H new ATOM 0 HD23 LEU B 5 11.359 3.294 1.785 1.00 0.00 H new ATOM 1193 N HIS B 6 12.041 3.165 6.928 1.00 0.00 N ATOM 1194 CA HIS B 6 11.848 2.290 8.077 1.00 0.00 C ATOM 1195 C HIS B 6 10.420 2.370 8.604 1.00 0.00 C ATOM 1196 O HIS B 6 9.768 1.346 8.823 1.00 0.00 O ATOM 1197 CB HIS B 6 12.834 2.677 9.181 1.00 0.00 C ATOM 1198 CG HIS B 6 12.763 1.821 10.409 1.00 0.00 C ATOM 1199 ND1 HIS B 6 12.129 2.213 11.567 1.00 0.00 N ATOM 1200 CD2 HIS B 6 13.278 0.597 10.664 1.00 0.00 C ATOM 1201 CE1 HIS B 6 12.261 1.269 12.478 1.00 0.00 C ATOM 1202 NE2 HIS B 6 12.952 0.277 11.956 1.00 0.00 N ATOM 0 H HIS B 6 12.823 3.812 7.026 1.00 0.00 H new ATOM 0 HA HIS B 6 12.029 1.263 7.761 1.00 0.00 H new ATOM 0 HB2 HIS B 6 13.846 2.630 8.779 1.00 0.00 H new ATOM 0 HB3 HIS B 6 12.652 3.713 9.465 1.00 0.00 H new ATOM 0 HD1 HIS B 6 11.635 3.095 11.699 1.00 0.00 H new ATOM 0 HD2 HIS B 6 13.842 -0.015 9.976 1.00 0.00 H new ATOM 0 HE1 HIS B 6 11.868 1.304 13.483 1.00 0.00 H new ATOM 1211 N GLU B 7 9.934 3.588 8.782 1.00 0.00 N ATOM 1212 CA GLU B 7 8.612 3.801 9.344 1.00 0.00 C ATOM 1213 C GLU B 7 7.540 3.302 8.385 1.00 0.00 C ATOM 1214 O GLU B 7 6.490 2.818 8.805 1.00 0.00 O ATOM 1215 CB GLU B 7 8.394 5.281 9.652 1.00 0.00 C ATOM 1216 CG GLU B 7 9.465 5.888 10.543 1.00 0.00 C ATOM 1217 CD GLU B 7 9.661 5.136 11.840 1.00 0.00 C ATOM 1218 OE1 GLU B 7 10.683 4.428 11.969 1.00 0.00 O ATOM 1219 OE2 GLU B 7 8.799 5.251 12.739 1.00 0.00 O ATOM 0 H GLU B 7 10.436 4.444 8.545 1.00 0.00 H new ATOM 0 HA GLU B 7 8.540 3.237 10.274 1.00 0.00 H new ATOM 0 HB2 GLU B 7 8.358 5.836 8.714 1.00 0.00 H new ATOM 0 HB3 GLU B 7 7.423 5.403 10.132 1.00 0.00 H new ATOM 0 HG2 GLU B 7 10.409 5.913 9.999 1.00 0.00 H new ATOM 0 HG3 GLU B 7 9.199 6.921 10.767 1.00 0.00 H new ATOM 1226 N LEU B 8 7.820 3.419 7.093 1.00 0.00 N ATOM 1227 CA LEU B 8 6.899 2.963 6.064 1.00 0.00 C ATOM 1228 C LEU B 8 6.758 1.446 6.113 1.00 0.00 C ATOM 1229 O LEU B 8 5.647 0.912 6.072 1.00 0.00 O ATOM 1230 CB LEU B 8 7.395 3.426 4.690 1.00 0.00 C ATOM 1231 CG LEU B 8 6.416 3.265 3.520 1.00 0.00 C ATOM 1232 CD1 LEU B 8 6.426 1.845 2.985 1.00 0.00 C ATOM 1233 CD2 LEU B 8 5.012 3.659 3.943 1.00 0.00 C ATOM 0 H LEU B 8 8.682 3.828 6.733 1.00 0.00 H new ATOM 0 HA LEU B 8 5.914 3.395 6.243 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.670 4.478 4.763 1.00 0.00 H new ATOM 0 HB3 LEU B 8 8.305 2.875 4.452 1.00 0.00 H new ATOM 0 HG LEU B 8 6.741 3.929 2.719 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.722 1.763 2.157 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.428 1.595 2.636 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.135 1.156 3.778 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.331 3.539 3.101 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.688 3.022 4.766 1.00 0.00 H new ATOM 0 HD23 LEU B 8 5.008 4.700 4.267 1.00 0.00 H new ATOM 1245 N LEU B 9 7.884 0.758 6.205 1.00 0.00 N ATOM 1246 CA LEU B 9 7.884 -0.697 6.272 1.00 0.00 C ATOM 1247 C LEU B 9 7.154 -1.185 7.511 1.00 0.00 C ATOM 1248 O LEU B 9 6.382 -2.143 7.445 1.00 0.00 O ATOM 1249 CB LEU B 9 9.311 -1.242 6.252 1.00 0.00 C ATOM 1250 CG LEU B 9 9.927 -1.444 4.862 1.00 0.00 C ATOM 1251 CD1 LEU B 9 9.240 -2.583 4.136 1.00 0.00 C ATOM 1252 CD2 LEU B 9 9.839 -0.177 4.036 1.00 0.00 C ATOM 0 H LEU B 9 8.811 1.182 6.235 1.00 0.00 H new ATOM 0 HA LEU B 9 7.358 -1.070 5.393 1.00 0.00 H new ATOM 0 HB2 LEU B 9 9.948 -0.561 6.816 1.00 0.00 H new ATOM 0 HB3 LEU B 9 9.323 -2.197 6.777 1.00 0.00 H new ATOM 0 HG LEU B 9 10.979 -1.693 4.998 1.00 0.00 H new ATOM 0 HD11 LEU B 9 9.690 -2.711 3.152 1.00 0.00 H new ATOM 0 HD12 LEU B 9 9.355 -3.502 4.710 1.00 0.00 H new ATOM 0 HD13 LEU B 9 8.180 -2.356 4.023 1.00 0.00 H new ATOM 0 HD21 LEU B 9 10.283 -0.350 3.056 1.00 0.00 H new ATOM 0 HD22 LEU B 9 8.794 0.107 3.915 1.00 0.00 H new ATOM 0 HD23 LEU B 9 10.377 0.625 4.542 1.00 0.00 H new ATOM 1264 N GLU B 10 7.384 -0.522 8.637 1.00 0.00 N ATOM 1265 CA GLU B 10 6.695 -0.874 9.872 1.00 0.00 C ATOM 1266 C GLU B 10 5.200 -0.605 9.755 1.00 0.00 C ATOM 1267 O GLU B 10 4.388 -1.291 10.374 1.00 0.00 O ATOM 1268 CB GLU B 10 7.254 -0.098 11.059 1.00 0.00 C ATOM 1269 CG GLU B 10 8.702 -0.412 11.376 1.00 0.00 C ATOM 1270 CD GLU B 10 9.115 0.141 12.720 1.00 0.00 C ATOM 1271 OE1 GLU B 10 9.323 -0.658 13.659 1.00 0.00 O ATOM 1272 OE2 GLU B 10 9.217 1.374 12.855 1.00 0.00 O ATOM 0 H GLU B 10 8.037 0.257 8.721 1.00 0.00 H new ATOM 0 HA GLU B 10 6.858 -1.939 10.039 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.160 0.969 10.858 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.646 -0.312 11.938 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.850 -1.492 11.366 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.343 0.005 10.599 1.00 0.00 H new ATOM 1279 N ARG B 11 4.850 0.395 8.958 1.00 0.00 N ATOM 1280 CA ARG B 11 3.462 0.768 8.746 1.00 0.00 C ATOM 1281 C ARG B 11 2.722 -0.372 8.057 1.00 0.00 C ATOM 1282 O ARG B 11 1.695 -0.845 8.541 1.00 0.00 O ATOM 1283 CB ARG B 11 3.395 2.039 7.889 1.00 0.00 C ATOM 1284 CG ARG B 11 2.244 2.984 8.213 1.00 0.00 C ATOM 1285 CD ARG B 11 0.881 2.413 7.848 1.00 0.00 C ATOM 1286 NE ARG B 11 0.372 1.481 8.852 1.00 0.00 N ATOM 1287 CZ ARG B 11 -0.553 1.785 9.763 1.00 0.00 C ATOM 1288 NH1 ARG B 11 -1.074 3.004 9.819 1.00 0.00 N ATOM 1289 NH2 ARG B 11 -0.961 0.860 10.620 1.00 0.00 N ATOM 0 H ARG B 11 5.519 0.967 8.443 1.00 0.00 H new ATOM 0 HA ARG B 11 2.988 0.964 9.708 1.00 0.00 H new ATOM 0 HB2 ARG B 11 4.333 2.583 8.002 1.00 0.00 H new ATOM 0 HB3 ARG B 11 3.320 1.747 6.841 1.00 0.00 H new ATOM 0 HG2 ARG B 11 2.261 3.215 9.278 1.00 0.00 H new ATOM 0 HG3 ARG B 11 2.392 3.923 7.680 1.00 0.00 H new ATOM 0 HD2 ARG B 11 0.171 3.230 7.724 1.00 0.00 H new ATOM 0 HD3 ARG B 11 0.951 1.903 6.887 1.00 0.00 H new ATOM 0 HE ARG B 11 0.750 0.534 8.856 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -0.768 3.720 9.161 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -1.781 3.225 10.520 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -0.568 -0.080 10.581 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -1.668 1.088 11.318 1.00 0.00 H new ATOM 1303 N ILE B 12 3.268 -0.830 6.943 1.00 0.00 N ATOM 1304 CA ILE B 12 2.605 -1.842 6.135 1.00 0.00 C ATOM 1305 C ILE B 12 2.830 -3.246 6.685 1.00 0.00 C ATOM 1306 O ILE B 12 2.152 -4.195 6.289 1.00 0.00 O ATOM 1307 CB ILE B 12 3.058 -1.769 4.671 1.00 0.00 C ATOM 1308 CG1 ILE B 12 4.560 -2.030 4.537 1.00 0.00 C ATOM 1309 CG2 ILE B 12 2.707 -0.406 4.109 1.00 0.00 C ATOM 1310 CD1 ILE B 12 5.033 -2.073 3.101 1.00 0.00 C ATOM 0 H ILE B 12 4.168 -0.518 6.577 1.00 0.00 H new ATOM 0 HA ILE B 12 1.537 -1.631 6.180 1.00 0.00 H new ATOM 0 HB ILE B 12 2.540 -2.545 4.106 1.00 0.00 H new ATOM 0 HG12 ILE B 12 5.106 -1.251 5.069 1.00 0.00 H new ATOM 0 HG13 ILE B 12 4.802 -2.976 5.021 1.00 0.00 H new ATOM 0 HG21 ILE B 12 3.027 -0.348 3.069 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.629 -0.255 4.166 1.00 0.00 H new ATOM 0 HG23 ILE B 12 3.213 0.367 4.687 1.00 0.00 H new ATOM 0 HD11 ILE B 12 6.106 -2.261 3.077 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.513 -2.870 2.570 1.00 0.00 H new ATOM 0 HD13 ILE B 12 4.821 -1.118 2.620 1.00 0.00 H new ATOM 1322 N GLY B 13 3.780 -3.376 7.593 1.00 0.00 N ATOM 1323 CA GLY B 13 3.985 -4.641 8.265 1.00 0.00 C ATOM 1324 C GLY B 13 5.065 -5.480 7.627 1.00 0.00 C ATOM 1325 O GLY B 13 5.091 -6.699 7.793 1.00 0.00 O ATOM 0 H GLY B 13 4.414 -2.629 7.878 1.00 0.00 H new ATOM 0 HA2 GLY B 13 4.245 -4.455 9.307 1.00 0.00 H new ATOM 0 HA3 GLY B 13 3.050 -5.201 8.266 1.00 0.00 H new ATOM 1329 N LEU B 14 5.964 -4.832 6.906 1.00 0.00 N ATOM 1330 CA LEU B 14 7.063 -5.525 6.257 1.00 0.00 C ATOM 1331 C LEU B 14 8.386 -5.068 6.831 1.00 0.00 C ATOM 1332 O LEU B 14 9.401 -5.045 6.136 1.00 0.00 O ATOM 1333 CB LEU B 14 7.052 -5.306 4.742 1.00 0.00 C ATOM 1334 CG LEU B 14 6.063 -6.165 3.951 1.00 0.00 C ATOM 1335 CD1 LEU B 14 6.149 -7.612 4.389 1.00 0.00 C ATOM 1336 CD2 LEU B 14 4.645 -5.656 4.092 1.00 0.00 C ATOM 0 H LEU B 14 5.954 -3.823 6.755 1.00 0.00 H new ATOM 0 HA LEU B 14 6.935 -6.591 6.446 1.00 0.00 H new ATOM 0 HB2 LEU B 14 6.829 -4.257 4.547 1.00 0.00 H new ATOM 0 HB3 LEU B 14 8.055 -5.495 4.359 1.00 0.00 H new ATOM 0 HG LEU B 14 6.337 -6.097 2.898 1.00 0.00 H new ATOM 0 HD11 LEU B 14 5.439 -8.208 3.816 1.00 0.00 H new ATOM 0 HD12 LEU B 14 7.159 -7.985 4.216 1.00 0.00 H new ATOM 0 HD13 LEU B 14 5.912 -7.686 5.450 1.00 0.00 H new ATOM 0 HD21 LEU B 14 3.972 -6.291 3.517 1.00 0.00 H new ATOM 0 HD22 LEU B 14 4.354 -5.676 5.142 1.00 0.00 H new ATOM 0 HD23 LEU B 14 4.587 -4.634 3.719 1.00 0.00 H new ATOM 1348 N GLU B 15 8.369 -4.721 8.109 1.00 0.00 N ATOM 1349 CA GLU B 15 9.573 -4.292 8.806 1.00 0.00 C ATOM 1350 C GLU B 15 10.636 -5.388 8.787 1.00 0.00 C ATOM 1351 O GLU B 15 11.818 -5.122 8.995 1.00 0.00 O ATOM 1352 CB GLU B 15 9.241 -3.903 10.242 1.00 0.00 C ATOM 1353 CG GLU B 15 8.604 -5.022 11.044 1.00 0.00 C ATOM 1354 CD GLU B 15 8.381 -4.644 12.491 1.00 0.00 C ATOM 1355 OE1 GLU B 15 7.236 -4.311 12.855 1.00 0.00 O ATOM 1356 OE2 GLU B 15 9.351 -4.684 13.275 1.00 0.00 O ATOM 0 H GLU B 15 7.529 -4.728 8.688 1.00 0.00 H new ATOM 0 HA GLU B 15 9.974 -3.421 8.288 1.00 0.00 H new ATOM 0 HB2 GLU B 15 10.155 -3.583 10.743 1.00 0.00 H new ATOM 0 HB3 GLU B 15 8.567 -3.046 10.231 1.00 0.00 H new ATOM 0 HG2 GLU B 15 7.650 -5.291 10.591 1.00 0.00 H new ATOM 0 HG3 GLU B 15 9.240 -5.906 10.997 1.00 0.00 H new ATOM 1363 N GLU B 16 10.198 -6.614 8.518 1.00 0.00 N ATOM 1364 CA GLU B 16 11.092 -7.753 8.371 1.00 0.00 C ATOM 1365 C GLU B 16 12.014 -7.572 7.171 1.00 0.00 C ATOM 1366 O GLU B 16 13.069 -8.197 7.080 1.00 0.00 O ATOM 1367 CB GLU B 16 10.271 -9.027 8.184 1.00 0.00 C ATOM 1368 CG GLU B 16 9.397 -8.989 6.941 1.00 0.00 C ATOM 1369 CD GLU B 16 8.505 -10.197 6.802 1.00 0.00 C ATOM 1370 OE1 GLU B 16 7.518 -10.299 7.561 1.00 0.00 O ATOM 1371 OE2 GLU B 16 8.767 -11.030 5.912 1.00 0.00 O ATOM 0 H GLU B 16 9.212 -6.844 8.396 1.00 0.00 H new ATOM 0 HA GLU B 16 11.701 -7.828 9.272 1.00 0.00 H new ATOM 0 HB2 GLU B 16 10.945 -9.882 8.123 1.00 0.00 H new ATOM 0 HB3 GLU B 16 9.641 -9.180 9.061 1.00 0.00 H new ATOM 0 HG2 GLU B 16 8.780 -8.091 6.967 1.00 0.00 H new ATOM 0 HG3 GLU B 16 10.034 -8.913 6.060 1.00 0.00 H new ATOM 1378 N HIS B 17 11.606 -6.718 6.244 1.00 0.00 N ATOM 1379 CA HIS B 17 12.355 -6.510 5.020 1.00 0.00 C ATOM 1380 C HIS B 17 12.872 -5.086 4.916 1.00 0.00 C ATOM 1381 O HIS B 17 13.358 -4.685 3.863 1.00 0.00 O ATOM 1382 CB HIS B 17 11.499 -6.840 3.795 1.00 0.00 C ATOM 1383 CG HIS B 17 11.370 -8.309 3.525 1.00 0.00 C ATOM 1384 ND1 HIS B 17 12.458 -9.132 3.324 1.00 0.00 N ATOM 1385 CD2 HIS B 17 10.276 -9.101 3.415 1.00 0.00 C ATOM 1386 CE1 HIS B 17 12.039 -10.363 3.099 1.00 0.00 C ATOM 1387 NE2 HIS B 17 10.720 -10.373 3.148 1.00 0.00 N ATOM 0 H HIS B 17 10.757 -6.158 6.319 1.00 0.00 H new ATOM 0 HA HIS B 17 13.211 -7.184 5.049 1.00 0.00 H new ATOM 0 HB2 HIS B 17 10.504 -6.417 3.934 1.00 0.00 H new ATOM 0 HB3 HIS B 17 11.932 -6.356 2.920 1.00 0.00 H new ATOM 0 HD2 HIS B 17 9.247 -8.790 3.518 1.00 0.00 H new ATOM 0 HE1 HIS B 17 12.669 -11.219 2.907 1.00 0.00 H new ATOM 0 HE2 HIS B 17 10.127 -11.192 3.010 1.00 0.00 H new ATOM 1396 N THR B 18 12.777 -4.325 5.998 1.00 0.00 N ATOM 1397 CA THR B 18 13.284 -2.959 5.997 1.00 0.00 C ATOM 1398 C THR B 18 14.763 -2.942 5.648 1.00 0.00 C ATOM 1399 O THR B 18 15.211 -2.146 4.823 1.00 0.00 O ATOM 1400 CB THR B 18 13.097 -2.275 7.356 1.00 0.00 C ATOM 1401 OG1 THR B 18 11.773 -2.500 7.847 1.00 0.00 O ATOM 1402 CG2 THR B 18 13.348 -0.784 7.231 1.00 0.00 C ATOM 0 H THR B 18 12.359 -4.625 6.878 1.00 0.00 H new ATOM 0 HA THR B 18 12.711 -2.412 5.248 1.00 0.00 H new ATOM 0 HB THR B 18 13.814 -2.701 8.058 1.00 0.00 H new ATOM 0 HG1 THR B 18 11.667 -2.060 8.716 1.00 0.00 H new ATOM 0 HG21 THR B 18 13.212 -0.309 8.203 1.00 0.00 H new ATOM 0 HG22 THR B 18 14.367 -0.614 6.884 1.00 0.00 H new ATOM 0 HG23 THR B 18 12.645 -0.355 6.516 1.00 0.00 H new ATOM 1410 N SER B 19 15.508 -3.843 6.269 1.00 0.00 N ATOM 1411 CA SER B 19 16.925 -3.984 6.003 1.00 0.00 C ATOM 1412 C SER B 19 17.140 -4.407 4.555 1.00 0.00 C ATOM 1413 O SER B 19 18.077 -3.957 3.904 1.00 0.00 O ATOM 1414 CB SER B 19 17.539 -5.005 6.958 1.00 0.00 C ATOM 1415 OG SER B 19 18.943 -5.109 6.788 1.00 0.00 O ATOM 0 H SER B 19 15.147 -4.493 6.968 1.00 0.00 H new ATOM 0 HA SER B 19 17.417 -3.024 6.163 1.00 0.00 H new ATOM 0 HB2 SER B 19 17.318 -4.719 7.986 1.00 0.00 H new ATOM 0 HB3 SER B 19 17.080 -5.980 6.792 1.00 0.00 H new ATOM 0 HG SER B 19 19.301 -5.770 7.417 1.00 0.00 H new ATOM 1421 N THR B 20 16.248 -5.249 4.046 1.00 0.00 N ATOM 1422 CA THR B 20 16.331 -5.703 2.668 1.00 0.00 C ATOM 1423 C THR B 20 16.287 -4.512 1.720 1.00 0.00 C ATOM 1424 O THR B 20 17.160 -4.350 0.868 1.00 0.00 O ATOM 1425 CB THR B 20 15.173 -6.656 2.319 1.00 0.00 C ATOM 1426 OG1 THR B 20 14.979 -7.614 3.370 1.00 0.00 O ATOM 1427 CG2 THR B 20 15.459 -7.382 1.014 1.00 0.00 C ATOM 0 H THR B 20 15.460 -5.630 4.569 1.00 0.00 H new ATOM 0 HA THR B 20 17.274 -6.238 2.557 1.00 0.00 H new ATOM 0 HB THR B 20 14.266 -6.063 2.206 1.00 0.00 H new ATOM 0 HG1 THR B 20 14.111 -8.055 3.255 1.00 0.00 H new ATOM 0 HG21 THR B 20 14.631 -8.052 0.781 1.00 0.00 H new ATOM 0 HG22 THR B 20 15.574 -6.654 0.211 1.00 0.00 H new ATOM 0 HG23 THR B 20 16.377 -7.961 1.113 1.00 0.00 H new ATOM 1435 N LEU B 21 15.275 -3.671 1.890 1.00 0.00 N ATOM 1436 CA LEU B 21 15.145 -2.460 1.100 1.00 0.00 C ATOM 1437 C LEU B 21 16.354 -1.561 1.317 1.00 0.00 C ATOM 1438 O LEU B 21 17.032 -1.173 0.366 1.00 0.00 O ATOM 1439 CB LEU B 21 13.861 -1.701 1.473 1.00 0.00 C ATOM 1440 CG LEU B 21 12.561 -2.195 0.823 1.00 0.00 C ATOM 1441 CD1 LEU B 21 12.744 -2.391 -0.669 1.00 0.00 C ATOM 1442 CD2 LEU B 21 12.065 -3.475 1.468 1.00 0.00 C ATOM 0 H LEU B 21 14.530 -3.809 2.573 1.00 0.00 H new ATOM 0 HA LEU B 21 15.090 -2.743 0.049 1.00 0.00 H new ATOM 0 HB2 LEU B 21 13.740 -1.746 2.555 1.00 0.00 H new ATOM 0 HB3 LEU B 21 13.996 -0.652 1.211 1.00 0.00 H new ATOM 0 HG LEU B 21 11.805 -1.426 0.983 1.00 0.00 H new ATOM 0 HD11 LEU B 21 11.809 -2.741 -1.107 1.00 0.00 H new ATOM 0 HD12 LEU B 21 13.028 -1.444 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU B 21 13.527 -3.129 -0.846 1.00 0.00 H new ATOM 0 HD21 LEU B 21 11.143 -3.794 0.982 1.00 0.00 H new ATOM 0 HD22 LEU B 21 12.820 -4.253 1.360 1.00 0.00 H new ATOM 0 HD23 LEU B 21 11.874 -3.299 2.527 1.00 0.00 H new ATOM 1454 N LEU B 22 16.629 -1.283 2.583 1.00 0.00 N ATOM 1455 CA LEU B 22 17.698 -0.380 2.991 1.00 0.00 C ATOM 1456 C LEU B 22 19.033 -0.755 2.351 1.00 0.00 C ATOM 1457 O LEU B 22 19.717 0.089 1.772 1.00 0.00 O ATOM 1458 CB LEU B 22 17.824 -0.428 4.513 1.00 0.00 C ATOM 1459 CG LEU B 22 18.653 0.682 5.146 1.00 0.00 C ATOM 1460 CD1 LEU B 22 17.972 2.026 4.955 1.00 0.00 C ATOM 1461 CD2 LEU B 22 18.869 0.396 6.621 1.00 0.00 C ATOM 0 H LEU B 22 16.111 -1.682 3.366 1.00 0.00 H new ATOM 0 HA LEU B 22 17.447 0.627 2.657 1.00 0.00 H new ATOM 0 HB2 LEU B 22 16.823 -0.398 4.942 1.00 0.00 H new ATOM 0 HB3 LEU B 22 18.262 -1.386 4.792 1.00 0.00 H new ATOM 0 HG LEU B 22 19.625 0.719 4.654 1.00 0.00 H new ATOM 0 HD11 LEU B 22 18.577 2.809 5.413 1.00 0.00 H new ATOM 0 HD12 LEU B 22 17.861 2.230 3.890 1.00 0.00 H new ATOM 0 HD13 LEU B 22 16.989 2.006 5.425 1.00 0.00 H new ATOM 0 HD21 LEU B 22 19.463 1.196 7.064 1.00 0.00 H new ATOM 0 HD22 LEU B 22 17.904 0.338 7.125 1.00 0.00 H new ATOM 0 HD23 LEU B 22 19.395 -0.552 6.735 1.00 0.00 H new ATOM 1473 N LEU B 23 19.384 -2.030 2.441 1.00 0.00 N ATOM 1474 CA LEU B 23 20.664 -2.519 1.949 1.00 0.00 C ATOM 1475 C LEU B 23 20.698 -2.567 0.428 1.00 0.00 C ATOM 1476 O LEU B 23 21.769 -2.581 -0.181 1.00 0.00 O ATOM 1477 CB LEU B 23 20.945 -3.912 2.510 1.00 0.00 C ATOM 1478 CG LEU B 23 20.984 -4.009 4.038 1.00 0.00 C ATOM 1479 CD1 LEU B 23 21.285 -5.434 4.472 1.00 0.00 C ATOM 1480 CD2 LEU B 23 22.008 -3.043 4.613 1.00 0.00 C ATOM 0 H LEU B 23 18.793 -2.751 2.855 1.00 0.00 H new ATOM 0 HA LEU B 23 21.434 -1.824 2.285 1.00 0.00 H new ATOM 0 HB2 LEU B 23 20.181 -4.596 2.139 1.00 0.00 H new ATOM 0 HB3 LEU B 23 21.901 -4.258 2.116 1.00 0.00 H new ATOM 0 HG LEU B 23 20.003 -3.732 4.425 1.00 0.00 H new ATOM 0 HD11 LEU B 23 21.309 -5.485 5.561 1.00 0.00 H new ATOM 0 HD12 LEU B 23 20.510 -6.101 4.094 1.00 0.00 H new ATOM 0 HD13 LEU B 23 22.252 -5.739 4.073 1.00 0.00 H new ATOM 0 HD21 LEU B 23 22.019 -3.129 5.700 1.00 0.00 H new ATOM 0 HD22 LEU B 23 22.996 -3.284 4.220 1.00 0.00 H new ATOM 0 HD23 LEU B 23 21.744 -2.023 4.332 1.00 0.00 H new ATOM 1492 N ASN B 24 19.528 -2.600 -0.188 1.00 0.00 N ATOM 1493 CA ASN B 24 19.444 -2.667 -1.637 1.00 0.00 C ATOM 1494 C ASN B 24 19.253 -1.285 -2.241 1.00 0.00 C ATOM 1495 O ASN B 24 18.935 -1.148 -3.422 1.00 0.00 O ATOM 1496 CB ASN B 24 18.330 -3.616 -2.074 1.00 0.00 C ATOM 1497 CG ASN B 24 18.774 -5.068 -2.050 1.00 0.00 C ATOM 1498 OD1 ASN B 24 19.306 -5.584 -3.033 1.00 0.00 O ATOM 1499 ND2 ASN B 24 18.554 -5.737 -0.931 1.00 0.00 N ATOM 0 H ASN B 24 18.627 -2.582 0.290 1.00 0.00 H new ATOM 0 HA ASN B 24 20.389 -3.063 -2.009 1.00 0.00 H new ATOM 0 HB2 ASN B 24 17.469 -3.490 -1.418 1.00 0.00 H new ATOM 0 HB3 ASN B 24 18.005 -3.353 -3.081 1.00 0.00 H new ATOM 0 HD21 ASN B 24 18.828 -6.717 -0.860 1.00 0.00 H new ATOM 0 HD22 ASN B 24 18.110 -5.273 -0.138 1.00 0.00 H new ATOM 1506 N GLY B 25 19.439 -0.264 -1.420 1.00 0.00 N ATOM 1507 CA GLY B 25 19.449 1.096 -1.918 1.00 0.00 C ATOM 1508 C GLY B 25 18.171 1.840 -1.617 1.00 0.00 C ATOM 1509 O GLY B 25 18.082 3.048 -1.827 1.00 0.00 O ATOM 0 H GLY B 25 19.584 -0.353 -0.414 1.00 0.00 H new ATOM 0 HA2 GLY B 25 20.289 1.633 -1.477 1.00 0.00 H new ATOM 0 HA3 GLY B 25 19.610 1.082 -2.996 1.00 0.00 H new ATOM 1513 N TYR B 26 17.186 1.125 -1.111 1.00 0.00 N ATOM 1514 CA TYR B 26 15.905 1.720 -0.787 1.00 0.00 C ATOM 1515 C TYR B 26 15.934 2.253 0.627 1.00 0.00 C ATOM 1516 O TYR B 26 15.462 1.612 1.563 1.00 0.00 O ATOM 1517 CB TYR B 26 14.796 0.694 -0.954 1.00 0.00 C ATOM 1518 CG TYR B 26 14.703 0.166 -2.359 1.00 0.00 C ATOM 1519 CD1 TYR B 26 15.291 -1.042 -2.702 1.00 0.00 C ATOM 1520 CD2 TYR B 26 14.045 0.882 -3.343 1.00 0.00 C ATOM 1521 CE1 TYR B 26 15.222 -1.523 -3.991 1.00 0.00 C ATOM 1522 CE2 TYR B 26 13.969 0.409 -4.634 1.00 0.00 C ATOM 1523 CZ TYR B 26 14.559 -0.793 -4.953 1.00 0.00 C ATOM 1524 OH TYR B 26 14.490 -1.264 -6.240 1.00 0.00 O ATOM 0 H TYR B 26 17.249 0.126 -0.915 1.00 0.00 H new ATOM 0 HA TYR B 26 15.709 2.548 -1.468 1.00 0.00 H new ATOM 0 HB2 TYR B 26 14.968 -0.136 -0.269 1.00 0.00 H new ATOM 0 HB3 TYR B 26 13.844 1.145 -0.676 1.00 0.00 H new ATOM 0 HD1 TYR B 26 15.811 -1.614 -1.948 1.00 0.00 H new ATOM 0 HD2 TYR B 26 13.584 1.827 -3.095 1.00 0.00 H new ATOM 0 HE1 TYR B 26 15.684 -2.465 -4.246 1.00 0.00 H new ATOM 0 HE2 TYR B 26 13.450 0.977 -5.391 1.00 0.00 H new ATOM 0 HH TYR B 26 13.560 -1.238 -6.548 1.00 0.00 H new ATOM 1534 N GLN B 27 16.502 3.432 0.767 1.00 0.00 N ATOM 1535 CA GLN B 27 16.745 4.004 2.072 1.00 0.00 C ATOM 1536 C GLN B 27 15.738 5.092 2.375 1.00 0.00 C ATOM 1537 O GLN B 27 15.586 5.510 3.521 1.00 0.00 O ATOM 1538 CB GLN B 27 18.161 4.560 2.120 1.00 0.00 C ATOM 1539 CG GLN B 27 19.194 3.566 1.620 1.00 0.00 C ATOM 1540 CD GLN B 27 20.604 4.111 1.635 1.00 0.00 C ATOM 1541 OE1 GLN B 27 21.059 4.716 0.666 1.00 0.00 O ATOM 1542 NE2 GLN B 27 21.311 3.892 2.729 1.00 0.00 N ATOM 0 H GLN B 27 16.805 4.015 -0.013 1.00 0.00 H new ATOM 0 HA GLN B 27 16.636 3.227 2.829 1.00 0.00 H new ATOM 0 HB2 GLN B 27 18.212 5.467 1.517 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.401 4.845 3.144 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.152 2.668 2.237 1.00 0.00 H new ATOM 0 HG3 GLN B 27 18.938 3.267 0.604 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.896 3.386 3.511 1.00 0.00 H new ATOM 0 HE22 GLN B 27 22.272 4.229 2.791 1.00 0.00 H new ATOM 1551 N THR B 28 15.053 5.554 1.344 1.00 0.00 N ATOM 1552 CA THR B 28 14.053 6.588 1.503 1.00 0.00 C ATOM 1553 C THR B 28 12.750 6.182 0.837 1.00 0.00 C ATOM 1554 O THR B 28 12.695 5.183 0.114 1.00 0.00 O ATOM 1555 CB THR B 28 14.522 7.925 0.903 1.00 0.00 C ATOM 1556 OG1 THR B 28 14.683 7.795 -0.514 1.00 0.00 O ATOM 1557 CG2 THR B 28 15.834 8.366 1.528 1.00 0.00 C ATOM 0 H THR B 28 15.174 5.226 0.386 1.00 0.00 H new ATOM 0 HA THR B 28 13.896 6.717 2.574 1.00 0.00 H new ATOM 0 HB THR B 28 13.765 8.680 1.115 1.00 0.00 H new ATOM 0 HG1 THR B 28 15.510 7.305 -0.706 1.00 0.00 H new ATOM 0 HG21 THR B 28 16.146 9.313 1.088 1.00 0.00 H new ATOM 0 HG22 THR B 28 15.701 8.491 2.603 1.00 0.00 H new ATOM 0 HG23 THR B 28 16.598 7.611 1.342 1.00 0.00 H new ATOM 1565 N LEU B 29 11.709 6.959 1.071 1.00 0.00 N ATOM 1566 CA LEU B 29 10.439 6.749 0.403 1.00 0.00 C ATOM 1567 C LEU B 29 10.595 7.032 -1.086 1.00 0.00 C ATOM 1568 O LEU B 29 9.923 6.432 -1.926 1.00 0.00 O ATOM 1569 CB LEU B 29 9.379 7.662 1.013 1.00 0.00 C ATOM 1570 CG LEU B 29 9.188 7.505 2.520 1.00 0.00 C ATOM 1571 CD1 LEU B 29 8.178 8.515 3.036 1.00 0.00 C ATOM 1572 CD2 LEU B 29 8.751 6.092 2.857 1.00 0.00 C ATOM 0 H LEU B 29 11.719 7.744 1.722 1.00 0.00 H new ATOM 0 HA LEU B 29 10.123 5.714 0.533 1.00 0.00 H new ATOM 0 HB2 LEU B 29 9.646 8.697 0.801 1.00 0.00 H new ATOM 0 HB3 LEU B 29 8.427 7.471 0.518 1.00 0.00 H new ATOM 0 HG LEU B 29 10.143 7.694 3.010 1.00 0.00 H new ATOM 0 HD11 LEU B 29 8.054 8.389 4.112 1.00 0.00 H new ATOM 0 HD12 LEU B 29 8.534 9.524 2.828 1.00 0.00 H new ATOM 0 HD13 LEU B 29 7.220 8.358 2.540 1.00 0.00 H new ATOM 0 HD21 LEU B 29 8.620 5.999 3.935 1.00 0.00 H new ATOM 0 HD22 LEU B 29 7.808 5.874 2.357 1.00 0.00 H new ATOM 0 HD23 LEU B 29 9.511 5.386 2.522 1.00 0.00 H new ATOM 1584 N GLU B 30 11.525 7.930 -1.395 1.00 0.00 N ATOM 1585 CA GLU B 30 11.830 8.296 -2.770 1.00 0.00 C ATOM 1586 C GLU B 30 12.414 7.108 -3.518 1.00 0.00 C ATOM 1587 O GLU B 30 12.238 6.975 -4.726 1.00 0.00 O ATOM 1588 CB GLU B 30 12.808 9.470 -2.798 1.00 0.00 C ATOM 1589 CG GLU B 30 12.270 10.717 -2.118 1.00 0.00 C ATOM 1590 CD GLU B 30 13.264 11.857 -2.114 1.00 0.00 C ATOM 1591 OE1 GLU B 30 13.201 12.710 -3.027 1.00 0.00 O ATOM 1592 OE2 GLU B 30 14.103 11.920 -1.196 1.00 0.00 O ATOM 0 H GLU B 30 12.086 8.422 -0.700 1.00 0.00 H new ATOM 0 HA GLU B 30 10.906 8.596 -3.263 1.00 0.00 H new ATOM 0 HB2 GLU B 30 13.737 9.172 -2.312 1.00 0.00 H new ATOM 0 HB3 GLU B 30 13.052 9.706 -3.834 1.00 0.00 H new ATOM 0 HG2 GLU B 30 11.359 11.037 -2.624 1.00 0.00 H new ATOM 0 HG3 GLU B 30 11.996 10.476 -1.091 1.00 0.00 H new ATOM 1599 N ASP B 31 13.111 6.248 -2.792 1.00 0.00 N ATOM 1600 CA ASP B 31 13.656 5.034 -3.376 1.00 0.00 C ATOM 1601 C ASP B 31 12.581 3.969 -3.447 1.00 0.00 C ATOM 1602 O ASP B 31 12.423 3.291 -4.459 1.00 0.00 O ATOM 1603 CB ASP B 31 14.829 4.497 -2.554 1.00 0.00 C ATOM 1604 CG ASP B 31 15.963 5.483 -2.403 1.00 0.00 C ATOM 1605 OD1 ASP B 31 16.256 5.871 -1.252 1.00 0.00 O ATOM 1606 OD2 ASP B 31 16.564 5.873 -3.426 1.00 0.00 O ATOM 0 H ASP B 31 13.312 6.368 -1.799 1.00 0.00 H new ATOM 0 HA ASP B 31 14.012 5.279 -4.376 1.00 0.00 H new ATOM 0 HB2 ASP B 31 14.469 4.215 -1.564 1.00 0.00 H new ATOM 0 HB3 ASP B 31 15.207 3.590 -3.026 1.00 0.00 H new ATOM 1611 N PHE B 32 11.829 3.838 -2.364 1.00 0.00 N ATOM 1612 CA PHE B 32 10.846 2.774 -2.241 1.00 0.00 C ATOM 1613 C PHE B 32 9.712 2.926 -3.251 1.00 0.00 C ATOM 1614 O PHE B 32 9.121 1.942 -3.667 1.00 0.00 O ATOM 1615 CB PHE B 32 10.284 2.727 -0.824 1.00 0.00 C ATOM 1616 CG PHE B 32 9.466 1.494 -0.552 1.00 0.00 C ATOM 1617 CD1 PHE B 32 10.065 0.340 -0.076 1.00 0.00 C ATOM 1618 CD2 PHE B 32 8.103 1.488 -0.778 1.00 0.00 C ATOM 1619 CE1 PHE B 32 9.315 -0.793 0.170 1.00 0.00 C ATOM 1620 CE2 PHE B 32 7.352 0.362 -0.535 1.00 0.00 C ATOM 1621 CZ PHE B 32 7.957 -0.780 -0.061 1.00 0.00 C ATOM 0 H PHE B 32 11.882 4.458 -1.556 1.00 0.00 H new ATOM 0 HA PHE B 32 11.357 1.835 -2.455 1.00 0.00 H new ATOM 0 HB2 PHE B 32 11.108 2.773 -0.112 1.00 0.00 H new ATOM 0 HB3 PHE B 32 9.667 3.609 -0.655 1.00 0.00 H new ATOM 0 HD1 PHE B 32 11.130 0.326 0.105 1.00 0.00 H new ATOM 0 HD2 PHE B 32 7.621 2.380 -1.151 1.00 0.00 H new ATOM 0 HE1 PHE B 32 9.792 -1.687 0.543 1.00 0.00 H new ATOM 0 HE2 PHE B 32 6.287 0.374 -0.716 1.00 0.00 H new ATOM 0 HZ PHE B 32 7.368 -1.665 0.130 1.00 0.00 H new ATOM 1631 N LYS B 33 9.412 4.149 -3.658 1.00 0.00 N ATOM 1632 CA LYS B 33 8.374 4.366 -4.663 1.00 0.00 C ATOM 1633 C LYS B 33 8.821 3.845 -6.031 1.00 0.00 C ATOM 1634 O LYS B 33 8.044 3.815 -6.984 1.00 0.00 O ATOM 1635 CB LYS B 33 8.015 5.846 -4.759 1.00 0.00 C ATOM 1636 CG LYS B 33 9.184 6.723 -5.162 1.00 0.00 C ATOM 1637 CD LYS B 33 8.768 8.171 -5.339 1.00 0.00 C ATOM 1638 CE LYS B 33 8.232 8.767 -4.051 1.00 0.00 C ATOM 1639 NZ LYS B 33 7.947 10.217 -4.196 1.00 0.00 N ATOM 0 H LYS B 33 9.863 4.998 -3.316 1.00 0.00 H new ATOM 0 HA LYS B 33 7.489 3.811 -4.353 1.00 0.00 H new ATOM 0 HB2 LYS B 33 7.210 5.971 -5.483 1.00 0.00 H new ATOM 0 HB3 LYS B 33 7.632 6.183 -3.796 1.00 0.00 H new ATOM 0 HG2 LYS B 33 9.964 6.659 -4.404 1.00 0.00 H new ATOM 0 HG3 LYS B 33 9.613 6.352 -6.093 1.00 0.00 H new ATOM 0 HD2 LYS B 33 9.622 8.755 -5.681 1.00 0.00 H new ATOM 0 HD3 LYS B 33 8.005 8.237 -6.115 1.00 0.00 H new ATOM 0 HE2 LYS B 33 7.321 8.244 -3.759 1.00 0.00 H new ATOM 0 HE3 LYS B 33 8.957 8.616 -3.251 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 7.582 10.591 -3.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 8.822 10.719 -4.450 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 7.237 10.358 -4.943 1.00 0.00 H new ATOM 1653 N GLU B 34 10.083 3.447 -6.114 1.00 0.00 N ATOM 1654 CA GLU B 34 10.639 2.880 -7.332 1.00 0.00 C ATOM 1655 C GLU B 34 10.767 1.369 -7.175 1.00 0.00 C ATOM 1656 O GLU B 34 11.255 0.665 -8.060 1.00 0.00 O ATOM 1657 CB GLU B 34 12.008 3.500 -7.616 1.00 0.00 C ATOM 1658 CG GLU B 34 12.034 5.008 -7.435 1.00 0.00 C ATOM 1659 CD GLU B 34 13.364 5.629 -7.813 1.00 0.00 C ATOM 1660 OE1 GLU B 34 14.320 5.538 -7.016 1.00 0.00 O ATOM 1661 OE2 GLU B 34 13.453 6.230 -8.904 1.00 0.00 O ATOM 0 H GLU B 34 10.747 3.508 -5.342 1.00 0.00 H new ATOM 0 HA GLU B 34 9.977 3.097 -8.170 1.00 0.00 H new ATOM 0 HB2 GLU B 34 12.748 3.049 -6.955 1.00 0.00 H new ATOM 0 HB3 GLU B 34 12.304 3.258 -8.637 1.00 0.00 H new ATOM 0 HG2 GLU B 34 11.246 5.454 -8.041 1.00 0.00 H new ATOM 0 HG3 GLU B 34 11.810 5.247 -6.395 1.00 0.00 H new ATOM 1668 N LEU B 35 10.320 0.885 -6.029 1.00 0.00 N ATOM 1669 CA LEU B 35 10.387 -0.524 -5.698 1.00 0.00 C ATOM 1670 C LEU B 35 9.322 -1.289 -6.474 1.00 0.00 C ATOM 1671 O LEU B 35 8.140 -0.956 -6.425 1.00 0.00 O ATOM 1672 CB LEU B 35 10.210 -0.681 -4.179 1.00 0.00 C ATOM 1673 CG LEU B 35 10.389 -2.079 -3.592 1.00 0.00 C ATOM 1674 CD1 LEU B 35 9.152 -2.926 -3.829 1.00 0.00 C ATOM 1675 CD2 LEU B 35 11.630 -2.743 -4.169 1.00 0.00 C ATOM 0 H LEU B 35 9.899 1.462 -5.301 1.00 0.00 H new ATOM 0 HA LEU B 35 11.355 -0.938 -5.980 1.00 0.00 H new ATOM 0 HB2 LEU B 35 10.919 -0.016 -3.687 1.00 0.00 H new ATOM 0 HB3 LEU B 35 9.211 -0.331 -3.918 1.00 0.00 H new ATOM 0 HG LEU B 35 10.525 -1.987 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU B 35 9.303 -3.918 -3.402 1.00 0.00 H new ATOM 0 HD12 LEU B 35 8.291 -2.454 -3.355 1.00 0.00 H new ATOM 0 HD13 LEU B 35 8.972 -3.016 -4.900 1.00 0.00 H new ATOM 0 HD21 LEU B 35 11.743 -3.739 -3.740 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.530 -2.823 -5.251 1.00 0.00 H new ATOM 0 HD23 LEU B 35 12.508 -2.143 -3.930 1.00 0.00 H new ATOM 1687 N ARG B 36 9.751 -2.309 -7.198 1.00 0.00 N ATOM 1688 CA ARG B 36 8.848 -3.089 -8.026 1.00 0.00 C ATOM 1689 C ARG B 36 9.028 -4.572 -7.760 1.00 0.00 C ATOM 1690 O ARG B 36 9.983 -4.962 -7.086 1.00 0.00 O ATOM 1691 CB ARG B 36 9.084 -2.783 -9.507 1.00 0.00 C ATOM 1692 CG ARG B 36 8.820 -1.332 -9.876 1.00 0.00 C ATOM 1693 CD ARG B 36 7.400 -0.928 -9.519 1.00 0.00 C ATOM 1694 NE ARG B 36 7.131 0.480 -9.796 1.00 0.00 N ATOM 1695 CZ ARG B 36 6.023 1.102 -9.401 1.00 0.00 C ATOM 1696 NH1 ARG B 36 5.103 0.445 -8.715 1.00 0.00 N ATOM 1697 NH2 ARG B 36 5.835 2.383 -9.682 1.00 0.00 N ATOM 0 H ARG B 36 10.723 -2.617 -7.229 1.00 0.00 H new ATOM 0 HA ARG B 36 7.824 -2.814 -7.772 1.00 0.00 H new ATOM 0 HB2 ARG B 36 10.114 -3.033 -9.762 1.00 0.00 H new ATOM 0 HB3 ARG B 36 8.442 -3.425 -10.109 1.00 0.00 H new ATOM 0 HG2 ARG B 36 9.527 -0.686 -9.355 1.00 0.00 H new ATOM 0 HG3 ARG B 36 8.985 -1.189 -10.944 1.00 0.00 H new ATOM 0 HD2 ARG B 36 6.698 -1.545 -10.080 1.00 0.00 H new ATOM 0 HD3 ARG B 36 7.224 -1.127 -8.462 1.00 0.00 H new ATOM 0 HE ARG B 36 7.827 1.013 -10.318 1.00 0.00 H new ATOM 0 HH11 ARG B 36 5.242 -0.540 -8.488 1.00 0.00 H new ATOM 0 HH12 ARG B 36 4.254 0.923 -8.413 1.00 0.00 H new ATOM 0 HH21 ARG B 36 6.542 2.900 -10.205 1.00 0.00 H new ATOM 0 HH22 ARG B 36 4.983 2.853 -9.376 1.00 0.00 H new ATOM 1711 N GLU B 37 8.128 -5.396 -8.279 1.00 0.00 N ATOM 1712 CA GLU B 37 8.194 -6.830 -8.042 1.00 0.00 C ATOM 1713 C GLU B 37 9.490 -7.396 -8.603 1.00 0.00 C ATOM 1714 O GLU B 37 10.150 -8.219 -7.968 1.00 0.00 O ATOM 1715 CB GLU B 37 7.000 -7.543 -8.668 1.00 0.00 C ATOM 1716 CG GLU B 37 6.940 -9.018 -8.319 1.00 0.00 C ATOM 1717 CD GLU B 37 5.735 -9.713 -8.908 1.00 0.00 C ATOM 1718 OE1 GLU B 37 5.794 -10.116 -10.087 1.00 0.00 O ATOM 1719 OE2 GLU B 37 4.725 -9.873 -8.191 1.00 0.00 O ATOM 0 H GLU B 37 7.348 -5.097 -8.864 1.00 0.00 H new ATOM 0 HA GLU B 37 8.167 -6.997 -6.965 1.00 0.00 H new ATOM 0 HB2 GLU B 37 6.081 -7.059 -8.337 1.00 0.00 H new ATOM 0 HB3 GLU B 37 7.046 -7.433 -9.752 1.00 0.00 H new ATOM 0 HG2 GLU B 37 7.846 -9.508 -8.676 1.00 0.00 H new ATOM 0 HG3 GLU B 37 6.923 -9.129 -7.235 1.00 0.00 H new ATOM 1726 N THR B 38 9.863 -6.916 -9.783 1.00 0.00 N ATOM 1727 CA THR B 38 11.105 -7.315 -10.418 1.00 0.00 C ATOM 1728 C THR B 38 12.286 -7.022 -9.498 1.00 0.00 C ATOM 1729 O THR B 38 13.274 -7.751 -9.472 1.00 0.00 O ATOM 1730 CB THR B 38 11.290 -6.569 -11.751 1.00 0.00 C ATOM 1731 OG1 THR B 38 10.120 -6.728 -12.564 1.00 0.00 O ATOM 1732 CG2 THR B 38 12.505 -7.088 -12.499 1.00 0.00 C ATOM 0 H THR B 38 9.315 -6.244 -10.320 1.00 0.00 H new ATOM 0 HA THR B 38 11.062 -8.386 -10.614 1.00 0.00 H new ATOM 0 HB THR B 38 11.443 -5.512 -11.533 1.00 0.00 H new ATOM 0 HG1 THR B 38 10.242 -6.250 -13.411 1.00 0.00 H new ATOM 0 HG21 THR B 38 12.614 -6.545 -13.438 1.00 0.00 H new ATOM 0 HG22 THR B 38 13.397 -6.942 -11.890 1.00 0.00 H new ATOM 0 HG23 THR B 38 12.378 -8.150 -12.707 1.00 0.00 H new ATOM 1740 N HIS B 39 12.155 -5.958 -8.716 1.00 0.00 N ATOM 1741 CA HIS B 39 13.192 -5.575 -7.777 1.00 0.00 C ATOM 1742 C HIS B 39 13.153 -6.487 -6.564 1.00 0.00 C ATOM 1743 O HIS B 39 14.184 -6.909 -6.071 1.00 0.00 O ATOM 1744 CB HIS B 39 13.036 -4.110 -7.364 1.00 0.00 C ATOM 1745 CG HIS B 39 13.263 -3.153 -8.495 1.00 0.00 C ATOM 1746 ND1 HIS B 39 12.913 -1.821 -8.449 1.00 0.00 N ATOM 1747 CD2 HIS B 39 13.815 -3.351 -9.713 1.00 0.00 C ATOM 1748 CE1 HIS B 39 13.233 -1.247 -9.592 1.00 0.00 C ATOM 1749 NE2 HIS B 39 13.783 -2.154 -10.375 1.00 0.00 N ATOM 0 H HIS B 39 11.338 -5.347 -8.716 1.00 0.00 H new ATOM 0 HA HIS B 39 14.162 -5.682 -8.262 1.00 0.00 H new ATOM 0 HB2 HIS B 39 12.035 -3.957 -6.962 1.00 0.00 H new ATOM 0 HB3 HIS B 39 13.739 -3.888 -6.561 1.00 0.00 H new ATOM 0 HD2 HIS B 39 14.209 -4.282 -10.093 1.00 0.00 H new ATOM 0 HE1 HIS B 39 13.072 -0.209 -9.844 1.00 0.00 H new ATOM 0 HE2 HIS B 39 14.128 -1.990 -11.321 1.00 0.00 H new ATOM 1758 N LEU B 40 11.951 -6.813 -6.112 1.00 0.00 N ATOM 1759 CA LEU B 40 11.773 -7.751 -5.007 1.00 0.00 C ATOM 1760 C LEU B 40 12.366 -9.105 -5.344 1.00 0.00 C ATOM 1761 O LEU B 40 12.891 -9.793 -4.476 1.00 0.00 O ATOM 1762 CB LEU B 40 10.293 -7.900 -4.668 1.00 0.00 C ATOM 1763 CG LEU B 40 9.807 -7.111 -3.452 1.00 0.00 C ATOM 1764 CD1 LEU B 40 10.661 -5.880 -3.216 1.00 0.00 C ATOM 1765 CD2 LEU B 40 8.358 -6.708 -3.641 1.00 0.00 C ATOM 0 H LEU B 40 11.081 -6.442 -6.493 1.00 0.00 H new ATOM 0 HA LEU B 40 12.297 -7.351 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU B 40 9.708 -7.592 -5.535 1.00 0.00 H new ATOM 0 HB3 LEU B 40 10.082 -8.956 -4.500 1.00 0.00 H new ATOM 0 HG LEU B 40 9.893 -7.754 -2.576 1.00 0.00 H new ATOM 0 HD11 LEU B 40 10.289 -5.341 -2.345 1.00 0.00 H new ATOM 0 HD12 LEU B 40 11.694 -6.182 -3.043 1.00 0.00 H new ATOM 0 HD13 LEU B 40 10.614 -5.231 -4.091 1.00 0.00 H new ATOM 0 HD21 LEU B 40 8.020 -6.146 -2.770 1.00 0.00 H new ATOM 0 HD22 LEU B 40 8.266 -6.086 -4.532 1.00 0.00 H new ATOM 0 HD23 LEU B 40 7.744 -7.601 -3.757 1.00 0.00 H new ATOM 1777 N ASN B 41 12.282 -9.476 -6.609 1.00 0.00 N ATOM 1778 CA ASN B 41 12.904 -10.700 -7.084 1.00 0.00 C ATOM 1779 C ASN B 41 14.413 -10.628 -6.895 1.00 0.00 C ATOM 1780 O ASN B 41 15.057 -11.613 -6.537 1.00 0.00 O ATOM 1781 CB ASN B 41 12.559 -10.945 -8.553 1.00 0.00 C ATOM 1782 CG ASN B 41 11.095 -11.282 -8.754 1.00 0.00 C ATOM 1783 OD1 ASN B 41 10.438 -11.808 -7.856 1.00 0.00 O ATOM 1784 ND2 ASN B 41 10.579 -10.998 -9.939 1.00 0.00 N ATOM 0 H ASN B 41 11.788 -8.946 -7.327 1.00 0.00 H new ATOM 0 HA ASN B 41 12.518 -11.535 -6.500 1.00 0.00 H new ATOM 0 HB2 ASN B 41 12.808 -10.058 -9.135 1.00 0.00 H new ATOM 0 HB3 ASN B 41 13.173 -11.760 -8.937 1.00 0.00 H new ATOM 0 HD21 ASN B 41 9.602 -11.215 -10.135 1.00 0.00 H new ATOM 0 HD22 ASN B 41 11.158 -10.562 -10.656 1.00 0.00 H new ATOM 1791 N GLU B 42 14.960 -9.442 -7.105 1.00 0.00 N ATOM 1792 CA GLU B 42 16.385 -9.201 -6.923 1.00 0.00 C ATOM 1793 C GLU B 42 16.735 -9.153 -5.436 1.00 0.00 C ATOM 1794 O GLU B 42 17.803 -9.598 -5.016 1.00 0.00 O ATOM 1795 CB GLU B 42 16.772 -7.888 -7.595 1.00 0.00 C ATOM 1796 CG GLU B 42 16.525 -7.877 -9.093 1.00 0.00 C ATOM 1797 CD GLU B 42 17.304 -8.954 -9.818 1.00 0.00 C ATOM 1798 OE1 GLU B 42 16.697 -9.969 -10.215 1.00 0.00 O ATOM 1799 OE2 GLU B 42 18.531 -8.790 -9.989 1.00 0.00 O ATOM 0 H GLU B 42 14.433 -8.622 -7.405 1.00 0.00 H new ATOM 0 HA GLU B 42 16.942 -10.018 -7.381 1.00 0.00 H new ATOM 0 HB2 GLU B 42 16.209 -7.075 -7.136 1.00 0.00 H new ATOM 0 HB3 GLU B 42 17.827 -7.691 -7.408 1.00 0.00 H new ATOM 0 HG2 GLU B 42 15.460 -8.013 -9.283 1.00 0.00 H new ATOM 0 HG3 GLU B 42 16.799 -6.902 -9.496 1.00 0.00 H new ATOM 1806 N LEU B 43 15.818 -8.610 -4.648 1.00 0.00 N ATOM 1807 CA LEU B 43 15.985 -8.520 -3.201 1.00 0.00 C ATOM 1808 C LEU B 43 15.700 -9.862 -2.533 1.00 0.00 C ATOM 1809 O LEU B 43 15.846 -10.010 -1.318 1.00 0.00 O ATOM 1810 CB LEU B 43 15.056 -7.447 -2.626 1.00 0.00 C ATOM 1811 CG LEU B 43 15.581 -6.009 -2.674 1.00 0.00 C ATOM 1812 CD1 LEU B 43 15.813 -5.541 -4.099 1.00 0.00 C ATOM 1813 CD2 LEU B 43 14.620 -5.077 -1.970 1.00 0.00 C ATOM 0 H LEU B 43 14.940 -8.220 -4.990 1.00 0.00 H new ATOM 0 HA LEU B 43 17.020 -8.246 -2.998 1.00 0.00 H new ATOM 0 HB2 LEU B 43 14.110 -7.486 -3.167 1.00 0.00 H new ATOM 0 HB3 LEU B 43 14.840 -7.700 -1.588 1.00 0.00 H new ATOM 0 HG LEU B 43 16.542 -5.992 -2.159 1.00 0.00 H new ATOM 0 HD11 LEU B 43 16.185 -4.517 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU B 43 16.546 -6.189 -4.580 1.00 0.00 H new ATOM 0 HD13 LEU B 43 14.875 -5.581 -4.652 1.00 0.00 H new ATOM 0 HD21 LEU B 43 15.005 -4.058 -2.011 1.00 0.00 H new ATOM 0 HD22 LEU B 43 13.648 -5.118 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU B 43 14.513 -5.383 -0.929 1.00 0.00 H new ATOM 1825 N ASN B 44 15.279 -10.822 -3.351 1.00 0.00 N ATOM 1826 CA ASN B 44 14.987 -12.185 -2.910 1.00 0.00 C ATOM 1827 C ASN B 44 13.776 -12.203 -1.981 1.00 0.00 C ATOM 1828 O ASN B 44 13.649 -13.049 -1.098 1.00 0.00 O ATOM 1829 CB ASN B 44 16.212 -12.817 -2.241 1.00 0.00 C ATOM 1830 CG ASN B 44 16.145 -14.336 -2.202 1.00 0.00 C ATOM 1831 OD1 ASN B 44 16.517 -15.009 -3.167 1.00 0.00 O ATOM 1832 ND2 ASN B 44 15.693 -14.887 -1.089 1.00 0.00 N ATOM 0 H ASN B 44 15.129 -10.676 -4.349 1.00 0.00 H new ATOM 0 HA ASN B 44 14.744 -12.784 -3.787 1.00 0.00 H new ATOM 0 HB2 ASN B 44 17.111 -12.511 -2.777 1.00 0.00 H new ATOM 0 HB3 ASN B 44 16.302 -12.436 -1.224 1.00 0.00 H new ATOM 0 HD21 ASN B 44 15.643 -15.902 -1.007 1.00 0.00 H new ATOM 0 HD22 ASN B 44 15.395 -14.297 -0.312 1.00 0.00 H new ATOM 1839 N ILE B 45 12.881 -11.260 -2.196 1.00 0.00 N ATOM 1840 CA ILE B 45 11.627 -11.220 -1.475 1.00 0.00 C ATOM 1841 C ILE B 45 10.584 -11.997 -2.259 1.00 0.00 C ATOM 1842 O ILE B 45 9.779 -11.430 -2.990 1.00 0.00 O ATOM 1843 CB ILE B 45 11.149 -9.776 -1.226 1.00 0.00 C ATOM 1844 CG1 ILE B 45 12.238 -8.995 -0.487 1.00 0.00 C ATOM 1845 CG2 ILE B 45 9.848 -9.772 -0.429 1.00 0.00 C ATOM 1846 CD1 ILE B 45 11.878 -7.554 -0.205 1.00 0.00 C ATOM 0 H ILE B 45 13.002 -10.505 -2.871 1.00 0.00 H new ATOM 0 HA ILE B 45 11.777 -11.676 -0.496 1.00 0.00 H new ATOM 0 HB ILE B 45 10.957 -9.294 -2.185 1.00 0.00 H new ATOM 0 HG12 ILE B 45 12.453 -9.496 0.457 1.00 0.00 H new ATOM 0 HG13 ILE B 45 13.154 -9.021 -1.078 1.00 0.00 H new ATOM 0 HG21 ILE B 45 9.526 -8.744 -0.263 1.00 0.00 H new ATOM 0 HG22 ILE B 45 9.079 -10.308 -0.985 1.00 0.00 H new ATOM 0 HG23 ILE B 45 10.008 -10.262 0.532 1.00 0.00 H new ATOM 0 HD11 ILE B 45 12.701 -7.070 0.321 1.00 0.00 H new ATOM 0 HD12 ILE B 45 11.692 -7.035 -1.145 1.00 0.00 H new ATOM 0 HD13 ILE B 45 10.981 -7.517 0.413 1.00 0.00 H new ATOM 1858 N MET B 46 10.649 -13.308 -2.132 1.00 0.00 N ATOM 1859 CA MET B 46 9.776 -14.203 -2.876 1.00 0.00 C ATOM 1860 C MET B 46 8.397 -14.248 -2.239 1.00 0.00 C ATOM 1861 O MET B 46 7.445 -14.763 -2.828 1.00 0.00 O ATOM 1862 CB MET B 46 10.383 -15.604 -2.913 1.00 0.00 C ATOM 1863 CG MET B 46 11.804 -15.658 -3.465 1.00 0.00 C ATOM 1864 SD MET B 46 11.890 -15.473 -5.259 1.00 0.00 S ATOM 1865 CE MET B 46 11.901 -13.692 -5.450 1.00 0.00 C ATOM 0 H MET B 46 11.305 -13.784 -1.513 1.00 0.00 H new ATOM 0 HA MET B 46 9.675 -13.830 -3.895 1.00 0.00 H new ATOM 0 HB2 MET B 46 10.382 -16.014 -1.903 1.00 0.00 H new ATOM 0 HB3 MET B 46 9.746 -16.248 -3.519 1.00 0.00 H new ATOM 0 HG2 MET B 46 12.396 -14.871 -2.998 1.00 0.00 H new ATOM 0 HG3 MET B 46 12.258 -16.608 -3.184 1.00 0.00 H new ATOM 0 HE1 MET B 46 10.919 -13.356 -5.783 1.00 0.00 H new ATOM 0 HE2 MET B 46 12.139 -13.225 -4.494 1.00 0.00 H new ATOM 0 HE3 MET B 46 12.651 -13.410 -6.189 1.00 0.00 H new ATOM 1875 N ASP B 47 8.318 -13.693 -1.034 1.00 0.00 N ATOM 1876 CA ASP B 47 7.078 -13.594 -0.269 1.00 0.00 C ATOM 1877 C ASP B 47 5.998 -12.892 -1.085 1.00 0.00 C ATOM 1878 O ASP B 47 6.020 -11.675 -1.220 1.00 0.00 O ATOM 1879 CB ASP B 47 7.329 -12.779 0.996 1.00 0.00 C ATOM 1880 CG ASP B 47 8.413 -13.336 1.890 1.00 0.00 C ATOM 1881 OD1 ASP B 47 8.421 -14.557 2.138 1.00 0.00 O ATOM 1882 OD2 ASP B 47 9.253 -12.536 2.367 1.00 0.00 O ATOM 0 H ASP B 47 9.124 -13.293 -0.554 1.00 0.00 H new ATOM 0 HA ASP B 47 6.746 -14.602 -0.019 1.00 0.00 H new ATOM 0 HB2 ASP B 47 7.596 -11.761 0.711 1.00 0.00 H new ATOM 0 HB3 ASP B 47 6.401 -12.718 1.565 1.00 0.00 H new ATOM 1887 N PRO B 48 5.019 -13.652 -1.603 1.00 0.00 N ATOM 1888 CA PRO B 48 4.019 -13.146 -2.554 1.00 0.00 C ATOM 1889 C PRO B 48 3.141 -12.034 -1.990 1.00 0.00 C ATOM 1890 O PRO B 48 2.982 -10.988 -2.617 1.00 0.00 O ATOM 1891 CB PRO B 48 3.166 -14.373 -2.883 1.00 0.00 C ATOM 1892 CG PRO B 48 3.987 -15.539 -2.467 1.00 0.00 C ATOM 1893 CD PRO B 48 4.805 -15.074 -1.304 1.00 0.00 C ATOM 0 HA PRO B 48 4.507 -12.696 -3.419 1.00 0.00 H new ATOM 0 HB2 PRO B 48 2.217 -14.348 -2.348 1.00 0.00 H new ATOM 0 HB3 PRO B 48 2.931 -14.416 -3.946 1.00 0.00 H new ATOM 0 HG2 PRO B 48 3.355 -16.381 -2.187 1.00 0.00 H new ATOM 0 HG3 PRO B 48 4.626 -15.877 -3.283 1.00 0.00 H new ATOM 0 HD2 PRO B 48 4.280 -15.214 -0.359 1.00 0.00 H new ATOM 0 HD3 PRO B 48 5.747 -15.618 -1.229 1.00 0.00 H new ATOM 1901 N GLN B 49 2.559 -12.259 -0.820 1.00 0.00 N ATOM 1902 CA GLN B 49 1.712 -11.252 -0.198 1.00 0.00 C ATOM 1903 C GLN B 49 2.551 -10.069 0.252 1.00 0.00 C ATOM 1904 O GLN B 49 2.125 -8.923 0.160 1.00 0.00 O ATOM 1905 CB GLN B 49 0.942 -11.832 0.987 1.00 0.00 C ATOM 1906 CG GLN B 49 -0.224 -12.717 0.578 1.00 0.00 C ATOM 1907 CD GLN B 49 -0.932 -13.333 1.765 1.00 0.00 C ATOM 1908 OE1 GLN B 49 -0.564 -14.409 2.231 1.00 0.00 O ATOM 1909 NE2 GLN B 49 -1.962 -12.664 2.255 1.00 0.00 N ATOM 0 H GLN B 49 2.657 -13.123 -0.286 1.00 0.00 H new ATOM 0 HA GLN B 49 0.987 -10.916 -0.939 1.00 0.00 H new ATOM 0 HB2 GLN B 49 1.627 -12.411 1.607 1.00 0.00 H new ATOM 0 HB3 GLN B 49 0.568 -11.014 1.603 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -0.937 -12.129 0.000 1.00 0.00 H new ATOM 0 HG3 GLN B 49 0.139 -13.510 -0.076 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -2.236 -11.774 1.840 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -2.482 -13.038 3.048 1.00 0.00 H new ATOM 1918 N HIS B 50 3.758 -10.355 0.709 1.00 0.00 N ATOM 1919 CA HIS B 50 4.666 -9.304 1.146 1.00 0.00 C ATOM 1920 C HIS B 50 5.070 -8.448 -0.042 1.00 0.00 C ATOM 1921 O HIS B 50 5.128 -7.225 0.055 1.00 0.00 O ATOM 1922 CB HIS B 50 5.901 -9.899 1.819 1.00 0.00 C ATOM 1923 CG HIS B 50 5.596 -10.664 3.076 1.00 0.00 C ATOM 1924 ND1 HIS B 50 6.563 -11.260 3.858 1.00 0.00 N ATOM 1925 CD2 HIS B 50 4.416 -10.924 3.683 1.00 0.00 C ATOM 1926 CE1 HIS B 50 5.987 -11.852 4.887 1.00 0.00 C ATOM 1927 NE2 HIS B 50 4.686 -11.662 4.804 1.00 0.00 N ATOM 0 H HIS B 50 4.132 -11.301 0.788 1.00 0.00 H new ATOM 0 HA HIS B 50 4.152 -8.680 1.877 1.00 0.00 H new ATOM 0 HB2 HIS B 50 6.404 -10.561 1.114 1.00 0.00 H new ATOM 0 HB3 HIS B 50 6.598 -9.095 2.054 1.00 0.00 H new ATOM 0 HD2 HIS B 50 3.440 -10.608 3.346 1.00 0.00 H new ATOM 0 HE1 HIS B 50 6.496 -12.400 5.666 1.00 0.00 H new ATOM 0 HE2 HIS B 50 3.993 -12.008 5.467 1.00 0.00 H new ATOM 1936 N ARG B 51 5.345 -9.112 -1.162 1.00 0.00 N ATOM 1937 CA ARG B 51 5.569 -8.440 -2.433 1.00 0.00 C ATOM 1938 C ARG B 51 4.409 -7.518 -2.742 1.00 0.00 C ATOM 1939 O ARG B 51 4.591 -6.326 -2.980 1.00 0.00 O ATOM 1940 CB ARG B 51 5.703 -9.468 -3.558 1.00 0.00 C ATOM 1941 CG ARG B 51 7.047 -10.164 -3.609 1.00 0.00 C ATOM 1942 CD ARG B 51 6.946 -11.522 -4.287 1.00 0.00 C ATOM 1943 NE ARG B 51 6.208 -11.471 -5.549 1.00 0.00 N ATOM 1944 CZ ARG B 51 5.752 -12.552 -6.182 1.00 0.00 C ATOM 1945 NH1 ARG B 51 5.975 -13.761 -5.679 1.00 0.00 N ATOM 1946 NH2 ARG B 51 5.071 -12.423 -7.313 1.00 0.00 N ATOM 0 H ARG B 51 5.418 -10.128 -1.211 1.00 0.00 H new ATOM 0 HA ARG B 51 6.489 -7.860 -2.360 1.00 0.00 H new ATOM 0 HB2 ARG B 51 4.922 -10.219 -3.443 1.00 0.00 H new ATOM 0 HB3 ARG B 51 5.528 -8.970 -4.512 1.00 0.00 H new ATOM 0 HG2 ARG B 51 7.761 -9.540 -4.147 1.00 0.00 H new ATOM 0 HG3 ARG B 51 7.432 -10.289 -2.597 1.00 0.00 H new ATOM 0 HD2 ARG B 51 7.949 -11.906 -4.473 1.00 0.00 H new ATOM 0 HD3 ARG B 51 6.456 -12.224 -3.613 1.00 0.00 H new ATOM 0 HE ARG B 51 6.033 -10.558 -5.968 1.00 0.00 H new ATOM 0 HH11 ARG B 51 6.495 -13.863 -4.808 1.00 0.00 H new ATOM 0 HH12 ARG B 51 5.626 -14.588 -6.164 1.00 0.00 H new ATOM 0 HH21 ARG B 51 4.896 -11.496 -7.700 1.00 0.00 H new ATOM 0 HH22 ARG B 51 4.723 -13.251 -7.796 1.00 0.00 H new ATOM 1960 N ALA B 52 3.214 -8.091 -2.707 1.00 0.00 N ATOM 1961 CA ALA B 52 1.993 -7.371 -3.003 1.00 0.00 C ATOM 1962 C ALA B 52 1.875 -6.109 -2.155 1.00 0.00 C ATOM 1963 O ALA B 52 1.534 -5.040 -2.663 1.00 0.00 O ATOM 1964 CB ALA B 52 0.805 -8.289 -2.779 1.00 0.00 C ATOM 0 H ALA B 52 3.068 -9.073 -2.471 1.00 0.00 H new ATOM 0 HA ALA B 52 2.012 -7.056 -4.046 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -0.117 -7.751 -3.001 1.00 0.00 H new ATOM 0 HB2 ALA B 52 0.886 -9.156 -3.435 1.00 0.00 H new ATOM 0 HB3 ALA B 52 0.792 -8.620 -1.740 1.00 0.00 H new ATOM 1970 N LYS B 53 2.173 -6.233 -0.866 1.00 0.00 N ATOM 1971 CA LYS B 53 2.134 -5.090 0.036 1.00 0.00 C ATOM 1972 C LYS B 53 3.189 -4.061 -0.349 1.00 0.00 C ATOM 1973 O LYS B 53 2.882 -2.883 -0.526 1.00 0.00 O ATOM 1974 CB LYS B 53 2.339 -5.527 1.490 1.00 0.00 C ATOM 1975 CG LYS B 53 1.348 -6.588 1.942 1.00 0.00 C ATOM 1976 CD LYS B 53 1.176 -6.633 3.454 1.00 0.00 C ATOM 1977 CE LYS B 53 0.260 -5.523 3.941 1.00 0.00 C ATOM 1978 NZ LYS B 53 0.005 -5.605 5.404 1.00 0.00 N ATOM 0 H LYS B 53 2.443 -7.112 -0.424 1.00 0.00 H new ATOM 0 HA LYS B 53 1.148 -4.634 -0.053 1.00 0.00 H new ATOM 0 HB2 LYS B 53 3.352 -5.912 1.608 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.251 -4.656 2.140 1.00 0.00 H new ATOM 0 HG2 LYS B 53 0.381 -6.396 1.477 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.683 -7.564 1.590 1.00 0.00 H new ATOM 0 HD2 LYS B 53 0.766 -7.600 3.746 1.00 0.00 H new ATOM 0 HD3 LYS B 53 2.150 -6.541 3.935 1.00 0.00 H new ATOM 0 HE2 LYS B 53 0.706 -4.557 3.705 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -0.688 -5.575 3.405 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -0.938 -5.220 5.614 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 0.049 -6.598 5.709 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 0.725 -5.054 5.913 1.00 0.00 H new ATOM 1992 N LEU B 54 4.424 -4.520 -0.497 1.00 0.00 N ATOM 1993 CA LEU B 54 5.544 -3.649 -0.831 1.00 0.00 C ATOM 1994 C LEU B 54 5.272 -2.859 -2.110 1.00 0.00 C ATOM 1995 O LEU B 54 5.501 -1.649 -2.164 1.00 0.00 O ATOM 1996 CB LEU B 54 6.816 -4.480 -0.989 1.00 0.00 C ATOM 1997 CG LEU B 54 7.305 -5.162 0.291 1.00 0.00 C ATOM 1998 CD1 LEU B 54 8.402 -6.160 -0.021 1.00 0.00 C ATOM 1999 CD2 LEU B 54 7.799 -4.131 1.288 1.00 0.00 C ATOM 0 H LEU B 54 4.678 -5.502 -0.390 1.00 0.00 H new ATOM 0 HA LEU B 54 5.674 -2.935 -0.018 1.00 0.00 H new ATOM 0 HB2 LEU B 54 6.641 -5.244 -1.746 1.00 0.00 H new ATOM 0 HB3 LEU B 54 7.610 -3.834 -1.365 1.00 0.00 H new ATOM 0 HG LEU B 54 6.466 -5.699 0.734 1.00 0.00 H new ATOM 0 HD11 LEU B 54 8.736 -6.634 0.902 1.00 0.00 H new ATOM 0 HD12 LEU B 54 8.019 -6.921 -0.702 1.00 0.00 H new ATOM 0 HD13 LEU B 54 9.241 -5.644 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU B 54 8.143 -4.634 2.192 1.00 0.00 H new ATOM 0 HD22 LEU B 54 8.623 -3.568 0.851 1.00 0.00 H new ATOM 0 HD23 LEU B 54 6.986 -3.449 1.539 1.00 0.00 H new ATOM 2011 N LEU B 55 4.763 -3.542 -3.127 1.00 0.00 N ATOM 2012 CA LEU B 55 4.456 -2.901 -4.401 1.00 0.00 C ATOM 2013 C LEU B 55 3.377 -1.844 -4.230 1.00 0.00 C ATOM 2014 O LEU B 55 3.477 -0.755 -4.783 1.00 0.00 O ATOM 2015 CB LEU B 55 4.011 -3.935 -5.445 1.00 0.00 C ATOM 2016 CG LEU B 55 5.131 -4.733 -6.132 1.00 0.00 C ATOM 2017 CD1 LEU B 55 6.494 -4.369 -5.576 1.00 0.00 C ATOM 2018 CD2 LEU B 55 4.884 -6.226 -5.998 1.00 0.00 C ATOM 0 H LEU B 55 4.554 -4.540 -3.096 1.00 0.00 H new ATOM 0 HA LEU B 55 5.368 -2.419 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU B 55 3.335 -4.640 -4.962 1.00 0.00 H new ATOM 0 HB3 LEU B 55 3.437 -3.419 -6.214 1.00 0.00 H new ATOM 0 HG LEU B 55 5.122 -4.471 -7.190 1.00 0.00 H new ATOM 0 HD11 LEU B 55 7.262 -4.952 -6.084 1.00 0.00 H new ATOM 0 HD12 LEU B 55 6.680 -3.307 -5.735 1.00 0.00 H new ATOM 0 HD13 LEU B 55 6.521 -4.586 -4.508 1.00 0.00 H new ATOM 0 HD21 LEU B 55 5.688 -6.773 -6.491 1.00 0.00 H new ATOM 0 HD22 LEU B 55 4.855 -6.497 -4.943 1.00 0.00 H new ATOM 0 HD23 LEU B 55 3.932 -6.481 -6.465 1.00 0.00 H new ATOM 2030 N THR B 56 2.358 -2.166 -3.446 1.00 0.00 N ATOM 2031 CA THR B 56 1.259 -1.243 -3.201 1.00 0.00 C ATOM 2032 C THR B 56 1.745 -0.008 -2.465 1.00 0.00 C ATOM 2033 O THR B 56 1.334 1.117 -2.764 1.00 0.00 O ATOM 2034 CB THR B 56 0.164 -1.912 -2.370 1.00 0.00 C ATOM 2035 OG1 THR B 56 -0.213 -3.134 -2.991 1.00 0.00 O ATOM 2036 CG2 THR B 56 -1.048 -1.009 -2.240 1.00 0.00 C ATOM 0 H THR B 56 2.269 -3.062 -2.967 1.00 0.00 H new ATOM 0 HA THR B 56 0.855 -0.952 -4.171 1.00 0.00 H new ATOM 0 HB THR B 56 0.553 -2.106 -1.370 1.00 0.00 H new ATOM 0 HG1 THR B 56 0.466 -3.817 -2.808 1.00 0.00 H new ATOM 0 HG21 THR B 56 -1.812 -1.509 -1.644 1.00 0.00 H new ATOM 0 HG22 THR B 56 -0.758 -0.079 -1.751 1.00 0.00 H new ATOM 0 HG23 THR B 56 -1.446 -0.790 -3.231 1.00 0.00 H new ATOM 2044 N ALA B 57 2.619 -0.229 -1.499 1.00 0.00 N ATOM 2045 CA ALA B 57 3.204 0.858 -0.756 1.00 0.00 C ATOM 2046 C ALA B 57 4.005 1.751 -1.691 1.00 0.00 C ATOM 2047 O ALA B 57 3.902 2.970 -1.633 1.00 0.00 O ATOM 2048 CB ALA B 57 4.065 0.323 0.371 1.00 0.00 C ATOM 0 H ALA B 57 2.936 -1.156 -1.215 1.00 0.00 H new ATOM 0 HA ALA B 57 2.410 1.458 -0.310 1.00 0.00 H new ATOM 0 HB1 ALA B 57 4.500 1.156 0.923 1.00 0.00 H new ATOM 0 HB2 ALA B 57 3.452 -0.278 1.043 1.00 0.00 H new ATOM 0 HB3 ALA B 57 4.863 -0.295 -0.042 1.00 0.00 H new ATOM 2054 N ALA B 58 4.772 1.131 -2.578 1.00 0.00 N ATOM 2055 CA ALA B 58 5.520 1.867 -3.587 1.00 0.00 C ATOM 2056 C ALA B 58 4.579 2.686 -4.466 1.00 0.00 C ATOM 2057 O ALA B 58 4.854 3.846 -4.776 1.00 0.00 O ATOM 2058 CB ALA B 58 6.337 0.910 -4.436 1.00 0.00 C ATOM 0 H ALA B 58 4.892 0.119 -2.619 1.00 0.00 H new ATOM 0 HA ALA B 58 6.198 2.554 -3.080 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.892 1.473 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA B 58 7.036 0.366 -3.801 1.00 0.00 H new ATOM 0 HB3 ALA B 58 5.671 0.203 -4.931 1.00 0.00 H new ATOM 2064 N GLU B 59 3.463 2.070 -4.844 1.00 0.00 N ATOM 2065 CA GLU B 59 2.443 2.725 -5.656 1.00 0.00 C ATOM 2066 C GLU B 59 1.927 3.988 -4.974 1.00 0.00 C ATOM 2067 O GLU B 59 1.922 5.074 -5.560 1.00 0.00 O ATOM 2068 CB GLU B 59 1.274 1.767 -5.900 1.00 0.00 C ATOM 2069 CG GLU B 59 1.635 0.544 -6.724 1.00 0.00 C ATOM 2070 CD GLU B 59 1.940 0.865 -8.172 1.00 0.00 C ATOM 2071 OE1 GLU B 59 1.280 0.285 -9.060 1.00 0.00 O ATOM 2072 OE2 GLU B 59 2.842 1.684 -8.431 1.00 0.00 O ATOM 0 H GLU B 59 3.241 1.106 -4.597 1.00 0.00 H new ATOM 0 HA GLU B 59 2.897 3.003 -6.607 1.00 0.00 H new ATOM 0 HB2 GLU B 59 0.880 1.440 -4.938 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.474 2.309 -6.405 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.501 0.056 -6.277 1.00 0.00 H new ATOM 0 HG3 GLU B 59 0.812 -0.169 -6.683 1.00 0.00 H new ATOM 2079 N LEU B 60 1.499 3.846 -3.729 1.00 0.00 N ATOM 2080 CA LEU B 60 0.924 4.965 -3.005 1.00 0.00 C ATOM 2081 C LEU B 60 1.984 5.970 -2.563 1.00 0.00 C ATOM 2082 O LEU B 60 1.665 7.116 -2.315 1.00 0.00 O ATOM 2083 CB LEU B 60 0.096 4.486 -1.812 1.00 0.00 C ATOM 2084 CG LEU B 60 -1.394 4.284 -2.100 1.00 0.00 C ATOM 2085 CD1 LEU B 60 -1.608 3.295 -3.231 1.00 0.00 C ATOM 2086 CD2 LEU B 60 -2.112 3.830 -0.847 1.00 0.00 C ATOM 0 H LEU B 60 1.539 2.973 -3.203 1.00 0.00 H new ATOM 0 HA LEU B 60 0.258 5.481 -3.697 1.00 0.00 H new ATOM 0 HB2 LEU B 60 0.513 3.545 -1.454 1.00 0.00 H new ATOM 0 HB3 LEU B 60 0.200 5.209 -1.003 1.00 0.00 H new ATOM 0 HG LEU B 60 -1.812 5.240 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -2.676 3.174 -3.411 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -1.128 3.667 -4.136 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -1.174 2.333 -2.960 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -3.171 3.690 -1.065 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -1.684 2.888 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -1.999 4.585 -0.069 1.00 0.00 H new ATOM 2098 N LEU B 61 3.239 5.557 -2.464 1.00 0.00 N ATOM 2099 CA LEU B 61 4.311 6.515 -2.204 1.00 0.00 C ATOM 2100 C LEU B 61 4.597 7.332 -3.454 1.00 0.00 C ATOM 2101 O LEU B 61 5.027 8.483 -3.382 1.00 0.00 O ATOM 2102 CB LEU B 61 5.593 5.818 -1.760 1.00 0.00 C ATOM 2103 CG LEU B 61 5.529 5.106 -0.413 1.00 0.00 C ATOM 2104 CD1 LEU B 61 6.911 4.621 -0.031 1.00 0.00 C ATOM 2105 CD2 LEU B 61 4.967 6.026 0.657 1.00 0.00 C ATOM 0 H LEU B 61 3.540 4.587 -2.557 1.00 0.00 H new ATOM 0 HA LEU B 61 3.976 7.169 -1.399 1.00 0.00 H new ATOM 0 HB2 LEU B 61 5.871 5.090 -2.522 1.00 0.00 H new ATOM 0 HB3 LEU B 61 6.392 6.558 -1.721 1.00 0.00 H new ATOM 0 HG LEU B 61 4.862 4.248 -0.497 1.00 0.00 H new ATOM 0 HD11 LEU B 61 6.865 4.112 0.932 1.00 0.00 H new ATOM 0 HD12 LEU B 61 7.276 3.929 -0.790 1.00 0.00 H new ATOM 0 HD13 LEU B 61 7.588 5.472 0.041 1.00 0.00 H new ATOM 0 HD21 LEU B 61 4.931 5.497 1.609 1.00 0.00 H new ATOM 0 HD22 LEU B 61 5.606 6.904 0.754 1.00 0.00 H new ATOM 0 HD23 LEU B 61 3.961 6.338 0.377 1.00 0.00 H new ATOM 2117 N LEU B 62 4.364 6.716 -4.600 1.00 0.00 N ATOM 2118 CA LEU B 62 4.564 7.370 -5.879 1.00 0.00 C ATOM 2119 C LEU B 62 3.482 8.415 -6.114 1.00 0.00 C ATOM 2120 O LEU B 62 3.754 9.512 -6.601 1.00 0.00 O ATOM 2121 CB LEU B 62 4.541 6.323 -6.991 1.00 0.00 C ATOM 2122 CG LEU B 62 4.812 6.849 -8.398 1.00 0.00 C ATOM 2123 CD1 LEU B 62 6.225 7.406 -8.498 1.00 0.00 C ATOM 2124 CD2 LEU B 62 4.593 5.742 -9.416 1.00 0.00 C ATOM 0 H LEU B 62 4.033 5.754 -4.669 1.00 0.00 H new ATOM 0 HA LEU B 62 5.531 7.874 -5.878 1.00 0.00 H new ATOM 0 HB2 LEU B 62 5.282 5.557 -6.760 1.00 0.00 H new ATOM 0 HB3 LEU B 62 3.566 5.835 -6.986 1.00 0.00 H new ATOM 0 HG LEU B 62 4.116 7.660 -8.612 1.00 0.00 H new ATOM 0 HD11 LEU B 62 6.400 7.776 -9.508 1.00 0.00 H new ATOM 0 HD12 LEU B 62 6.345 8.223 -7.786 1.00 0.00 H new ATOM 0 HD13 LEU B 62 6.943 6.618 -8.271 1.00 0.00 H new ATOM 0 HD21 LEU B 62 4.788 6.125 -10.418 1.00 0.00 H new ATOM 0 HD22 LEU B 62 5.271 4.915 -9.205 1.00 0.00 H new ATOM 0 HD23 LEU B 62 3.563 5.391 -9.356 1.00 0.00 H new ATOM 2136 N ASP B 63 2.255 8.065 -5.764 1.00 0.00 N ATOM 2137 CA ASP B 63 1.119 8.960 -5.959 1.00 0.00 C ATOM 2138 C ASP B 63 0.882 9.868 -4.755 1.00 0.00 C ATOM 2139 O ASP B 63 0.692 11.075 -4.901 1.00 0.00 O ATOM 2140 CB ASP B 63 -0.140 8.151 -6.255 1.00 0.00 C ATOM 2141 CG ASP B 63 -0.249 7.748 -7.712 1.00 0.00 C ATOM 2142 OD1 ASP B 63 0.487 6.840 -8.141 1.00 0.00 O ATOM 2143 OD2 ASP B 63 -1.085 8.328 -8.434 1.00 0.00 O ATOM 0 H ASP B 63 2.017 7.167 -5.343 1.00 0.00 H new ATOM 0 HA ASP B 63 1.355 9.600 -6.809 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -0.146 7.256 -5.634 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -1.016 8.737 -5.978 1.00 0.00 H new ATOM 2148 N TYR B 64 0.902 9.289 -3.566 1.00 0.00 N ATOM 2149 CA TYR B 64 0.598 10.022 -2.344 1.00 0.00 C ATOM 2150 C TYR B 64 1.875 10.490 -1.663 1.00 0.00 C ATOM 2151 O TYR B 64 2.086 10.248 -0.474 1.00 0.00 O ATOM 2152 CB TYR B 64 -0.213 9.153 -1.381 1.00 0.00 C ATOM 2153 CG TYR B 64 -1.573 8.779 -1.910 1.00 0.00 C ATOM 2154 CD1 TYR B 64 -2.694 9.517 -1.567 1.00 0.00 C ATOM 2155 CD2 TYR B 64 -1.732 7.694 -2.757 1.00 0.00 C ATOM 2156 CE1 TYR B 64 -3.939 9.186 -2.053 1.00 0.00 C ATOM 2157 CE2 TYR B 64 -2.971 7.353 -3.247 1.00 0.00 C ATOM 2158 CZ TYR B 64 -4.074 8.102 -2.894 1.00 0.00 C ATOM 2159 OH TYR B 64 -5.313 7.764 -3.384 1.00 0.00 O ATOM 0 H TYR B 64 1.127 8.305 -3.419 1.00 0.00 H new ATOM 0 HA TYR B 64 0.005 10.895 -2.617 1.00 0.00 H new ATOM 0 HB2 TYR B 64 0.347 8.243 -1.166 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -0.333 9.685 -0.437 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -2.590 10.366 -0.908 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -0.870 7.107 -3.037 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -4.804 9.771 -1.777 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -3.080 6.503 -3.905 1.00 0.00 H new ATOM 0 HH TYR B 64 -5.735 8.555 -3.781 1.00 0.00 H new