USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 825 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 Single : A 688 GLN : amide:sc= -1.29 K(o=-1.3,f=-0.39) USER MOD Single : A 691 TYR OH : rot 5:sc= 0.039 USER MOD Single : A 698 GLN : amide:sc= -1.76 K(o=-1.8,f=-0.12) USER MOD Single : A 699 LYS NZ :NH3+ -179:sc= 1.23 (180deg=1.16) USER MOD Single : A 702 MET CE :methyl 158:sc= -4.45 (180deg=-6.21!) USER MOD Single : B 1 MET CE :methyl -166:sc= -0.0097 (180deg=-0.252) USER MOD Single : B 1 MET N :NH3+ -146:sc= 1.43 (180deg=0.389) USER MOD Single : B 2 GLN : amide:sc= -1.73 X(o=-1.7,f=-2) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.0103 USER MOD Single : B 9 THR OG1 : rot 180:sc=-0.00409 USER MOD Single : B 11 LYS NZ :NH3+ -118:sc= 0.394 (180deg=-0.254) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= -0.0025 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 73:sc= -0.0542 USER MOD Single : B 25 ASN : amide:sc= -1.23! K(o=-1.2!,f=-0.61) USER MOD Single : B 27 LYS NZ :NH3+ -134:sc= 0.415 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -164:sc= 1.15 (180deg=0.928) USER MOD Single : B 31 GLN : amide:sc= -0.613 K(o=-0.61,f=-1.4) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.748 K(o=-0.75,f=0) USER MOD Single : B 41 GLN : amide:sc= 0.176 K(o=0.18,f=-4.9!) USER MOD Single : B 48 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.028) USER MOD Single : B 49 GLN : amide:sc= 0.0251 K(o=0.025,f=-7.2!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 150:sc= -2.44 USER MOD Single : B 60 ASN : amide:sc= -0.245 X(o=-0.25,f=-0.34) USER MOD Single : B 62 GLN : amide:sc= 1.03 K(o=1,f=-0.08) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -120:sc= 0.497 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 18.084 -2.905 4.767 1.00 0.00 N ATOM 64 CA LEU A 679 16.788 -3.089 4.161 1.00 0.00 C ATOM 65 C LEU A 679 16.917 -3.465 2.678 1.00 0.00 C ATOM 66 O LEU A 679 18.011 -3.392 2.117 1.00 0.00 O ATOM 67 CB LEU A 679 15.975 -1.809 4.389 1.00 0.00 C ATOM 68 CG LEU A 679 16.223 -1.167 5.762 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.347 0.071 5.891 1.00 0.00 C ATOM 70 CD2 LEU A 679 15.877 -2.131 6.894 1.00 0.00 C ATOM 0 HA LEU A 679 16.262 -3.924 4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.220 -1.088 3.609 1.00 0.00 H new ATOM 0 HB3 LEU A 679 14.914 -2.038 4.289 1.00 0.00 H new ATOM 0 HG LEU A 679 17.279 -0.908 5.836 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.515 0.536 6.863 1.00 0.00 H new ATOM 0 HD12 LEU A 679 15.599 0.779 5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 679 14.299 -0.214 5.801 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.063 -1.648 7.853 1.00 0.00 H new ATOM 0 HD22 LEU A 679 14.825 -2.410 6.826 1.00 0.00 H new ATOM 0 HD23 LEU A 679 16.495 -3.025 6.812 1.00 0.00 H new ATOM 82 N PRO A 680 15.809 -3.871 2.038 1.00 0.00 N ATOM 83 CA PRO A 680 15.740 -4.369 0.671 1.00 0.00 C ATOM 84 C PRO A 680 16.139 -3.365 -0.415 1.00 0.00 C ATOM 85 O PRO A 680 15.851 -3.589 -1.588 1.00 0.00 O ATOM 86 CB PRO A 680 14.293 -4.831 0.474 1.00 0.00 C ATOM 87 CG PRO A 680 13.761 -5.011 1.895 1.00 0.00 C ATOM 88 CD PRO A 680 14.497 -3.905 2.645 1.00 0.00 C ATOM 0 HA PRO A 680 16.472 -5.168 0.555 1.00 0.00 H new ATOM 0 HB2 PRO A 680 13.711 -4.093 -0.079 1.00 0.00 H new ATOM 0 HB3 PRO A 680 14.245 -5.762 -0.090 1.00 0.00 H new ATOM 0 HG2 PRO A 680 12.679 -4.889 1.945 1.00 0.00 H new ATOM 0 HG3 PRO A 680 13.989 -5.999 2.295 1.00 0.00 H new ATOM 0 HD2 PRO A 680 13.987 -2.947 2.542 1.00 0.00 H new ATOM 0 HD3 PRO A 680 14.558 -4.121 3.712 1.00 0.00 H new ATOM 96 N PHE A 681 16.792 -2.265 -0.035 1.00 0.00 N ATOM 97 CA PHE A 681 17.203 -1.211 -0.951 1.00 0.00 C ATOM 98 C PHE A 681 18.261 -1.722 -1.936 1.00 0.00 C ATOM 99 O PHE A 681 18.891 -2.752 -1.682 1.00 0.00 O ATOM 100 CB PHE A 681 17.808 -0.057 -0.138 1.00 0.00 C ATOM 101 CG PHE A 681 16.849 0.718 0.745 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.496 0.370 0.825 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.332 1.804 1.495 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.633 1.099 1.650 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.464 2.537 2.316 1.00 0.00 C ATOM 106 CZ PHE A 681 15.112 2.177 2.399 1.00 0.00 C ATOM 0 H PHE A 681 17.052 -2.083 0.934 1.00 0.00 H new ATOM 0 HA PHE A 681 16.330 -0.878 -1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.602 -0.461 0.491 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.275 0.642 -0.832 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.118 -0.462 0.249 1.00 0.00 H new ATOM 0 HD2 PHE A 681 18.376 2.075 1.439 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.589 0.827 1.708 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.836 3.377 2.883 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.442 2.731 3.040 1.00 0.00 H new ATOM 116 N PRO A 682 18.474 -1.011 -3.056 1.00 0.00 N ATOM 117 CA PRO A 682 17.682 0.115 -3.529 1.00 0.00 C ATOM 118 C PRO A 682 16.444 -0.219 -4.390 1.00 0.00 C ATOM 119 O PRO A 682 15.670 0.704 -4.636 1.00 0.00 O ATOM 120 CB PRO A 682 18.669 0.899 -4.389 1.00 0.00 C ATOM 121 CG PRO A 682 19.480 -0.212 -5.055 1.00 0.00 C ATOM 122 CD PRO A 682 19.600 -1.251 -3.940 1.00 0.00 C ATOM 0 HA PRO A 682 17.260 0.631 -2.666 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.161 1.526 -5.122 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.298 1.557 -3.789 1.00 0.00 H new ATOM 0 HG2 PRO A 682 18.972 -0.615 -5.932 1.00 0.00 H new ATOM 0 HG3 PRO A 682 20.456 0.142 -5.386 1.00 0.00 H new ATOM 0 HD2 PRO A 682 19.572 -2.263 -4.343 1.00 0.00 H new ATOM 0 HD3 PRO A 682 20.545 -1.146 -3.407 1.00 0.00 H new ATOM 130 N PRO A 683 16.192 -1.452 -4.873 1.00 0.00 N ATOM 131 CA PRO A 683 15.110 -1.681 -5.818 1.00 0.00 C ATOM 132 C PRO A 683 13.727 -1.703 -5.161 1.00 0.00 C ATOM 133 O PRO A 683 13.604 -1.725 -3.938 1.00 0.00 O ATOM 134 CB PRO A 683 15.413 -3.040 -6.448 1.00 0.00 C ATOM 135 CG PRO A 683 16.060 -3.791 -5.291 1.00 0.00 C ATOM 136 CD PRO A 683 16.894 -2.701 -4.627 1.00 0.00 C ATOM 0 HA PRO A 683 15.068 -0.869 -6.544 1.00 0.00 H new ATOM 0 HB2 PRO A 683 14.509 -3.536 -6.801 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.083 -2.953 -7.303 1.00 0.00 H new ATOM 0 HG2 PRO A 683 15.318 -4.208 -4.610 1.00 0.00 H new ATOM 0 HG3 PRO A 683 16.676 -4.621 -5.638 1.00 0.00 H new ATOM 0 HD2 PRO A 683 16.998 -2.886 -3.558 1.00 0.00 H new ATOM 0 HD3 PRO A 683 17.901 -2.671 -5.044 1.00 0.00 H new ATOM 144 N ASP A 684 12.697 -1.698 -6.016 1.00 0.00 N ATOM 145 CA ASP A 684 11.274 -1.810 -5.698 1.00 0.00 C ATOM 146 C ASP A 684 10.684 -0.733 -4.782 1.00 0.00 C ATOM 147 O ASP A 684 9.465 -0.576 -4.762 1.00 0.00 O ATOM 148 CB ASP A 684 10.978 -3.213 -5.159 1.00 0.00 C ATOM 149 CG ASP A 684 11.395 -4.292 -6.155 1.00 0.00 C ATOM 150 OD1 ASP A 684 10.817 -4.307 -7.264 1.00 0.00 O ATOM 151 OD2 ASP A 684 12.286 -5.096 -5.800 1.00 0.00 O ATOM 0 H ASP A 684 12.851 -1.609 -7.020 1.00 0.00 H new ATOM 0 HA ASP A 684 10.764 -1.634 -6.645 1.00 0.00 H new ATOM 0 HB2 ASP A 684 11.506 -3.361 -4.217 1.00 0.00 H new ATOM 0 HB3 ASP A 684 9.913 -3.305 -4.945 1.00 0.00 H new ATOM 156 N ILE A 685 11.501 0.010 -4.030 1.00 0.00 N ATOM 157 CA ILE A 685 11.008 1.056 -3.141 1.00 0.00 C ATOM 158 C ILE A 685 12.064 2.126 -2.893 1.00 0.00 C ATOM 159 O ILE A 685 13.243 1.961 -3.203 1.00 0.00 O ATOM 160 CB ILE A 685 10.566 0.498 -1.771 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.300 -0.774 -1.335 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.053 0.287 -1.725 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.675 -0.398 -0.797 1.00 0.00 C ATOM 0 H ILE A 685 12.515 -0.098 -4.023 1.00 0.00 H new ATOM 0 HA ILE A 685 10.148 1.491 -3.650 1.00 0.00 H new ATOM 0 HB ILE A 685 10.849 1.264 -1.049 1.00 0.00 H new ATOM 0 HG12 ILE A 685 10.726 -1.295 -0.569 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.400 -1.458 -2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 685 8.770 -0.107 -0.749 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.548 1.238 -1.893 1.00 0.00 H new ATOM 0 HG23 ILE A 685 8.761 -0.421 -2.500 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.203 -1.299 -0.485 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.246 0.105 -1.577 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.561 0.270 0.057 1.00 0.00 H new ATOM 175 N ASP A 686 11.597 3.232 -2.316 1.00 0.00 N ATOM 176 CA ASP A 686 12.406 4.330 -1.824 1.00 0.00 C ATOM 177 C ASP A 686 11.679 4.853 -0.587 1.00 0.00 C ATOM 178 O ASP A 686 10.467 5.065 -0.645 1.00 0.00 O ATOM 179 CB ASP A 686 12.512 5.418 -2.894 1.00 0.00 C ATOM 180 CG ASP A 686 13.223 4.924 -4.151 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.471 4.828 -4.107 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.515 4.648 -5.147 1.00 0.00 O ATOM 0 H ASP A 686 10.599 3.388 -2.176 1.00 0.00 H new ATOM 0 HA ASP A 686 13.422 4.018 -1.583 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.513 5.765 -3.157 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.050 6.274 -2.487 1.00 0.00 H new ATOM 187 N PRO A 687 12.376 5.071 0.535 1.00 0.00 N ATOM 188 CA PRO A 687 11.730 5.468 1.775 1.00 0.00 C ATOM 189 C PRO A 687 11.094 6.845 1.630 1.00 0.00 C ATOM 190 O PRO A 687 10.150 7.176 2.341 1.00 0.00 O ATOM 191 CB PRO A 687 12.831 5.441 2.834 1.00 0.00 C ATOM 192 CG PRO A 687 14.122 5.608 2.035 1.00 0.00 C ATOM 193 CD PRO A 687 13.808 4.939 0.698 1.00 0.00 C ATOM 0 HA PRO A 687 10.915 4.800 2.053 1.00 0.00 H new ATOM 0 HB2 PRO A 687 12.705 6.244 3.560 1.00 0.00 H new ATOM 0 HB3 PRO A 687 12.825 4.504 3.391 1.00 0.00 H new ATOM 0 HG2 PRO A 687 14.380 6.659 1.906 1.00 0.00 H new ATOM 0 HG3 PRO A 687 14.966 5.131 2.533 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.344 5.422 -0.119 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.109 3.891 0.701 1.00 0.00 H new ATOM 201 N GLN A 688 11.614 7.643 0.699 1.00 0.00 N ATOM 202 CA GLN A 688 11.084 8.954 0.357 1.00 0.00 C ATOM 203 C GLN A 688 9.742 8.852 -0.373 1.00 0.00 C ATOM 204 O GLN A 688 9.246 9.864 -0.865 1.00 0.00 O ATOM 205 CB GLN A 688 12.108 9.696 -0.508 1.00 0.00 C ATOM 206 CG GLN A 688 12.632 8.795 -1.631 1.00 0.00 C ATOM 207 CD GLN A 688 14.119 8.509 -1.504 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.856 8.564 -2.486 1.00 0.00 O ATOM 209 NE2 GLN A 688 14.584 8.203 -0.298 1.00 0.00 N ATOM 0 H GLN A 688 12.435 7.386 0.151 1.00 0.00 H new ATOM 0 HA GLN A 688 10.905 9.507 1.279 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.650 10.588 -0.936 1.00 0.00 H new ATOM 0 HB3 GLN A 688 12.939 10.031 0.112 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.083 7.854 -1.623 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.438 9.269 -2.593 1.00 0.00 H new ATOM 0 HE21 GLN A 688 13.949 8.165 0.499 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.576 8.006 -0.169 1.00 0.00 H new ATOM 218 N VAL A 689 9.143 7.658 -0.460 1.00 0.00 N ATOM 219 CA VAL A 689 7.884 7.476 -1.158 1.00 0.00 C ATOM 220 C VAL A 689 6.890 6.748 -0.252 1.00 0.00 C ATOM 221 O VAL A 689 5.723 6.604 -0.609 1.00 0.00 O ATOM 222 CB VAL A 689 8.135 6.723 -2.471 1.00 0.00 C ATOM 223 CG1 VAL A 689 6.862 6.653 -3.309 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.181 7.447 -3.319 1.00 0.00 C ATOM 0 H VAL A 689 9.521 6.804 -0.050 1.00 0.00 H new ATOM 0 HA VAL A 689 7.446 8.442 -1.408 1.00 0.00 H new ATOM 0 HB VAL A 689 8.476 5.724 -2.201 1.00 0.00 H new ATOM 0 HG11 VAL A 689 7.065 6.115 -4.235 1.00 0.00 H new ATOM 0 HG12 VAL A 689 6.086 6.132 -2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.524 7.663 -3.543 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.343 6.896 -4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 689 8.829 8.452 -3.552 1.00 0.00 H new ATOM 0 HG23 VAL A 689 10.118 7.510 -2.765 1.00 0.00 H new ATOM 234 N PHE A 690 7.339 6.290 0.924 1.00 0.00 N ATOM 235 CA PHE A 690 6.441 5.690 1.898 1.00 0.00 C ATOM 236 C PHE A 690 6.561 6.333 3.283 1.00 0.00 C ATOM 237 O PHE A 690 5.720 6.085 4.142 1.00 0.00 O ATOM 238 CB PHE A 690 6.603 4.170 1.921 1.00 0.00 C ATOM 239 CG PHE A 690 7.938 3.627 2.362 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.230 3.504 3.727 1.00 0.00 C ATOM 241 CD2 PHE A 690 8.875 3.216 1.404 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.452 2.951 4.135 1.00 0.00 C ATOM 243 CE2 PHE A 690 10.099 2.673 1.808 1.00 0.00 C ATOM 244 CZ PHE A 690 10.386 2.542 3.175 1.00 0.00 C ATOM 0 H PHE A 690 8.316 6.327 1.216 1.00 0.00 H new ATOM 0 HA PHE A 690 5.419 5.896 1.580 1.00 0.00 H new ATOM 0 HB2 PHE A 690 5.837 3.758 2.578 1.00 0.00 H new ATOM 0 HB3 PHE A 690 6.399 3.793 0.919 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.514 3.835 4.465 1.00 0.00 H new ATOM 0 HD2 PHE A 690 8.652 3.319 0.352 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.672 2.841 5.187 1.00 0.00 H new ATOM 0 HE2 PHE A 690 10.821 2.356 1.070 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.331 2.124 3.488 1.00 0.00 H new ATOM 254 N TYR A 691 7.590 7.154 3.515 1.00 0.00 N ATOM 255 CA TYR A 691 7.659 8.042 4.671 1.00 0.00 C ATOM 256 C TYR A 691 6.666 9.193 4.473 1.00 0.00 C ATOM 257 O TYR A 691 6.445 9.995 5.377 1.00 0.00 O ATOM 258 CB TYR A 691 9.075 8.603 4.832 1.00 0.00 C ATOM 259 CG TYR A 691 10.112 7.622 5.340 1.00 0.00 C ATOM 260 CD1 TYR A 691 9.745 6.323 5.728 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.450 8.026 5.437 1.00 0.00 C ATOM 262 CE1 TYR A 691 10.703 5.446 6.247 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.417 7.149 5.949 1.00 0.00 C ATOM 264 CZ TYR A 691 12.045 5.856 6.363 1.00 0.00 C ATOM 265 OH TYR A 691 12.981 5.007 6.872 1.00 0.00 O ATOM 0 H TYR A 691 8.401 7.219 2.900 1.00 0.00 H new ATOM 0 HA TYR A 691 7.406 7.481 5.571 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.406 8.988 3.868 1.00 0.00 H new ATOM 0 HB3 TYR A 691 9.036 9.450 5.517 1.00 0.00 H new ATOM 0 HD1 TYR A 691 8.720 6.000 5.625 1.00 0.00 H new ATOM 0 HD2 TYR A 691 11.738 9.016 5.116 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.413 4.454 6.559 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.447 7.465 6.026 1.00 0.00 H new ATOM 0 HH TYR A 691 12.575 4.129 7.029 1.00 0.00 H new ATOM 275 N GLU A 692 6.061 9.269 3.280 1.00 0.00 N ATOM 276 CA GLU A 692 5.008 10.213 2.913 1.00 0.00 C ATOM 277 C GLU A 692 3.687 9.837 3.592 1.00 0.00 C ATOM 278 O GLU A 692 2.607 10.182 3.112 1.00 0.00 O ATOM 279 CB GLU A 692 4.848 10.200 1.389 1.00 0.00 C ATOM 280 CG GLU A 692 6.139 10.619 0.682 1.00 0.00 C ATOM 281 CD GLU A 692 6.545 12.045 1.055 1.00 0.00 C ATOM 282 OE1 GLU A 692 5.896 12.980 0.535 1.00 0.00 O ATOM 283 OE2 GLU A 692 7.495 12.190 1.854 1.00 0.00 O ATOM 0 H GLU A 692 6.307 8.644 2.513 1.00 0.00 H new ATOM 0 HA GLU A 692 5.281 11.214 3.247 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.561 9.201 1.061 1.00 0.00 H new ATOM 0 HB3 GLU A 692 4.040 10.873 1.102 1.00 0.00 H new ATOM 0 HG2 GLU A 692 6.941 9.930 0.948 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.003 10.549 -0.397 1.00 0.00 H new ATOM 290 N LEU A 693 3.782 9.120 4.713 1.00 0.00 N ATOM 291 CA LEU A 693 2.691 8.489 5.429 1.00 0.00 C ATOM 292 C LEU A 693 3.001 8.567 6.921 1.00 0.00 C ATOM 293 O LEU A 693 4.120 8.916 7.291 1.00 0.00 O ATOM 294 CB LEU A 693 2.654 7.018 5.005 1.00 0.00 C ATOM 295 CG LEU A 693 2.165 6.822 3.565 1.00 0.00 C ATOM 296 CD1 LEU A 693 2.244 5.342 3.191 1.00 0.00 C ATOM 297 CD2 LEU A 693 0.719 7.284 3.408 1.00 0.00 C ATOM 0 H LEU A 693 4.681 8.959 5.166 1.00 0.00 H new ATOM 0 HA LEU A 693 1.738 8.974 5.217 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.652 6.591 5.105 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.002 6.467 5.683 1.00 0.00 H new ATOM 0 HG LEU A 693 2.803 7.416 2.911 1.00 0.00 H new ATOM 0 HD11 LEU A 693 1.896 5.206 2.167 1.00 0.00 H new ATOM 0 HD12 LEU A 693 3.276 5.001 3.271 1.00 0.00 H new ATOM 0 HD13 LEU A 693 1.616 4.762 3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 693 0.399 7.133 2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 693 0.078 6.707 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 693 0.646 8.342 3.660 1.00 0.00 H new ATOM 309 N PRO A 694 2.038 8.251 7.789 1.00 0.00 N ATOM 310 CA PRO A 694 2.294 8.134 9.206 1.00 0.00 C ATOM 311 C PRO A 694 3.043 6.840 9.464 1.00 0.00 C ATOM 312 O PRO A 694 2.741 5.800 8.878 1.00 0.00 O ATOM 313 CB PRO A 694 0.916 8.106 9.861 1.00 0.00 C ATOM 314 CG PRO A 694 0.060 7.445 8.790 1.00 0.00 C ATOM 315 CD PRO A 694 0.649 7.970 7.486 1.00 0.00 C ATOM 0 HA PRO A 694 2.900 8.950 9.600 1.00 0.00 H new ATOM 0 HB2 PRO A 694 0.919 7.535 10.789 1.00 0.00 H new ATOM 0 HB3 PRO A 694 0.561 9.107 10.104 1.00 0.00 H new ATOM 0 HG2 PRO A 694 0.116 6.358 8.846 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -0.991 7.716 8.893 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.560 7.233 6.688 1.00 0.00 H new ATOM 0 HD3 PRO A 694 0.129 8.867 7.151 1.00 0.00 H new ATOM 323 N GLU A 695 4.026 6.932 10.354 1.00 0.00 N ATOM 324 CA GLU A 695 4.752 5.854 10.971 1.00 0.00 C ATOM 325 C GLU A 695 4.063 4.509 10.848 1.00 0.00 C ATOM 326 O GLU A 695 4.649 3.565 10.351 1.00 0.00 O ATOM 327 CB GLU A 695 4.896 6.215 12.446 1.00 0.00 C ATOM 328 CG GLU A 695 6.340 5.977 12.842 1.00 0.00 C ATOM 329 CD GLU A 695 6.551 6.118 14.347 1.00 0.00 C ATOM 330 OE1 GLU A 695 5.980 5.289 15.091 1.00 0.00 O ATOM 331 OE2 GLU A 695 7.280 7.053 14.743 1.00 0.00 O ATOM 0 H GLU A 695 4.353 7.841 10.681 1.00 0.00 H new ATOM 0 HA GLU A 695 5.711 5.744 10.464 1.00 0.00 H new ATOM 0 HB2 GLU A 695 4.621 7.256 12.613 1.00 0.00 H new ATOM 0 HB3 GLU A 695 4.227 5.607 13.055 1.00 0.00 H new ATOM 0 HG2 GLU A 695 6.643 4.979 12.525 1.00 0.00 H new ATOM 0 HG3 GLU A 695 6.981 6.686 12.318 1.00 0.00 H new ATOM 338 N GLU A 696 2.816 4.433 11.300 1.00 0.00 N ATOM 339 CA GLU A 696 2.008 3.238 11.417 1.00 0.00 C ATOM 340 C GLU A 696 2.008 2.367 10.156 1.00 0.00 C ATOM 341 O GLU A 696 1.654 1.190 10.228 1.00 0.00 O ATOM 342 CB GLU A 696 0.598 3.687 11.813 1.00 0.00 C ATOM 343 CG GLU A 696 -0.323 2.491 12.008 1.00 0.00 C ATOM 344 CD GLU A 696 -1.677 2.932 12.558 1.00 0.00 C ATOM 345 OE1 GLU A 696 -1.799 3.013 13.800 1.00 0.00 O ATOM 346 OE2 GLU A 696 -2.583 3.183 11.730 1.00 0.00 O ATOM 0 H GLU A 696 2.315 5.264 11.614 1.00 0.00 H new ATOM 0 HA GLU A 696 2.436 2.587 12.180 1.00 0.00 H new ATOM 0 HB2 GLU A 696 0.643 4.269 12.734 1.00 0.00 H new ATOM 0 HB3 GLU A 696 0.191 4.341 11.042 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -0.462 1.975 11.058 1.00 0.00 H new ATOM 0 HG3 GLU A 696 0.138 1.779 12.693 1.00 0.00 H new ATOM 353 N VAL A 697 2.404 2.919 9.007 1.00 0.00 N ATOM 354 CA VAL A 697 2.573 2.137 7.795 1.00 0.00 C ATOM 355 C VAL A 697 3.955 2.375 7.187 1.00 0.00 C ATOM 356 O VAL A 697 4.452 1.545 6.427 1.00 0.00 O ATOM 357 CB VAL A 697 1.422 2.421 6.822 1.00 0.00 C ATOM 358 CG1 VAL A 697 1.412 3.885 6.390 1.00 0.00 C ATOM 359 CG2 VAL A 697 1.521 1.529 5.585 1.00 0.00 C ATOM 0 H VAL A 697 2.613 3.911 8.897 1.00 0.00 H new ATOM 0 HA VAL A 697 2.528 1.074 8.034 1.00 0.00 H new ATOM 0 HB VAL A 697 0.493 2.202 7.348 1.00 0.00 H new ATOM 0 HG11 VAL A 697 0.585 4.055 5.701 1.00 0.00 H new ATOM 0 HG12 VAL A 697 1.291 4.522 7.266 1.00 0.00 H new ATOM 0 HG13 VAL A 697 2.353 4.125 5.894 1.00 0.00 H new ATOM 0 HG21 VAL A 697 0.694 1.749 4.910 1.00 0.00 H new ATOM 0 HG22 VAL A 697 2.465 1.718 5.075 1.00 0.00 H new ATOM 0 HG23 VAL A 697 1.475 0.483 5.886 1.00 0.00 H new ATOM 369 N GLN A 698 4.592 3.503 7.520 1.00 0.00 N ATOM 370 CA GLN A 698 5.964 3.776 7.100 1.00 0.00 C ATOM 371 C GLN A 698 6.948 2.917 7.899 1.00 0.00 C ATOM 372 O GLN A 698 8.106 2.774 7.514 1.00 0.00 O ATOM 373 CB GLN A 698 6.250 5.277 7.275 1.00 0.00 C ATOM 374 CG GLN A 698 7.304 5.612 8.333 1.00 0.00 C ATOM 375 CD GLN A 698 7.424 7.121 8.502 1.00 0.00 C ATOM 376 OE1 GLN A 698 8.517 7.667 8.627 1.00 0.00 O ATOM 377 NE2 GLN A 698 6.289 7.811 8.504 1.00 0.00 N ATOM 0 H GLN A 698 4.173 4.243 8.083 1.00 0.00 H new ATOM 0 HA GLN A 698 6.090 3.516 6.049 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.575 5.684 6.318 1.00 0.00 H new ATOM 0 HB3 GLN A 698 5.320 5.781 7.537 1.00 0.00 H new ATOM 0 HG2 GLN A 698 7.033 5.153 9.284 1.00 0.00 H new ATOM 0 HG3 GLN A 698 8.268 5.194 8.041 1.00 0.00 H new ATOM 0 HE21 GLN A 698 5.398 7.327 8.398 1.00 0.00 H new ATOM 0 HE22 GLN A 698 6.309 8.825 8.612 1.00 0.00 H new ATOM 386 N LYS A 699 6.478 2.346 9.013 1.00 0.00 N ATOM 387 CA LYS A 699 7.248 1.537 9.942 1.00 0.00 C ATOM 388 C LYS A 699 6.814 0.080 9.847 1.00 0.00 C ATOM 389 O LYS A 699 7.534 -0.832 10.253 1.00 0.00 O ATOM 390 CB LYS A 699 7.021 2.104 11.349 1.00 0.00 C ATOM 391 CG LYS A 699 5.790 1.553 12.088 1.00 0.00 C ATOM 392 CD LYS A 699 5.742 2.252 13.444 1.00 0.00 C ATOM 393 CE LYS A 699 4.322 2.575 13.891 1.00 0.00 C ATOM 394 NZ LYS A 699 4.306 3.071 15.280 1.00 0.00 N ATOM 0 H LYS A 699 5.504 2.445 9.298 1.00 0.00 H new ATOM 0 HA LYS A 699 8.311 1.570 9.704 1.00 0.00 H new ATOM 0 HB2 LYS A 699 7.907 1.902 11.952 1.00 0.00 H new ATOM 0 HB3 LYS A 699 6.926 3.187 11.275 1.00 0.00 H new ATOM 0 HG2 LYS A 699 4.880 1.746 11.521 1.00 0.00 H new ATOM 0 HG3 LYS A 699 5.865 0.473 12.212 1.00 0.00 H new ATOM 0 HD2 LYS A 699 6.218 1.618 14.192 1.00 0.00 H new ATOM 0 HD3 LYS A 699 6.321 3.174 13.393 1.00 0.00 H new ATOM 0 HE2 LYS A 699 3.890 3.325 13.228 1.00 0.00 H new ATOM 0 HE3 LYS A 699 3.700 1.683 13.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 3.326 3.268 15.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 4.713 2.351 15.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 4.867 3.944 15.343 1.00 0.00 H new ATOM 408 N GLU A 700 5.619 -0.135 9.300 1.00 0.00 N ATOM 409 CA GLU A 700 5.103 -1.472 9.111 1.00 0.00 C ATOM 410 C GLU A 700 5.911 -2.096 7.994 1.00 0.00 C ATOM 411 O GLU A 700 6.224 -3.280 8.032 1.00 0.00 O ATOM 412 CB GLU A 700 3.634 -1.394 8.714 1.00 0.00 C ATOM 413 CG GLU A 700 2.992 -2.767 8.835 1.00 0.00 C ATOM 414 CD GLU A 700 1.492 -2.706 8.547 1.00 0.00 C ATOM 415 OE1 GLU A 700 1.115 -2.068 7.538 1.00 0.00 O ATOM 416 OE2 GLU A 700 0.733 -3.303 9.343 1.00 0.00 O ATOM 0 H GLU A 700 4.995 0.607 8.982 1.00 0.00 H new ATOM 0 HA GLU A 700 5.180 -2.064 10.023 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.113 -0.682 9.353 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.544 -1.029 7.691 1.00 0.00 H new ATOM 0 HG2 GLU A 700 3.470 -3.457 8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 700 3.156 -3.160 9.838 1.00 0.00 H new ATOM 423 N LEU A 701 6.251 -1.270 7.000 1.00 0.00 N ATOM 424 CA LEU A 701 7.149 -1.632 5.922 1.00 0.00 C ATOM 425 C LEU A 701 8.522 -1.974 6.499 1.00 0.00 C ATOM 426 O LEU A 701 9.162 -2.924 6.054 1.00 0.00 O ATOM 427 CB LEU A 701 7.229 -0.440 4.965 1.00 0.00 C ATOM 428 CG LEU A 701 6.476 -0.703 3.659 1.00 0.00 C ATOM 429 CD1 LEU A 701 4.982 -0.905 3.924 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.655 0.487 2.721 1.00 0.00 C ATOM 0 H LEU A 701 5.898 -0.316 6.929 1.00 0.00 H new ATOM 0 HA LEU A 701 6.789 -2.508 5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 701 6.815 0.444 5.451 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.274 -0.222 4.744 1.00 0.00 H new ATOM 0 HG LEU A 701 6.880 -1.607 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.467 -1.090 2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 701 4.842 -1.758 4.588 1.00 0.00 H new ATOM 0 HD13 LEU A 701 4.571 -0.010 4.392 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.119 0.301 1.790 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.259 1.386 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 701 7.715 0.626 2.508 1.00 0.00 H new ATOM 442 N MET A 702 8.984 -1.205 7.495 1.00 0.00 N ATOM 443 CA MET A 702 10.268 -1.466 8.134 1.00 0.00 C ATOM 444 C MET A 702 10.229 -2.778 8.921 1.00 0.00 C ATOM 445 O MET A 702 11.283 -3.281 9.306 1.00 0.00 O ATOM 446 CB MET A 702 10.625 -0.324 9.091 1.00 0.00 C ATOM 447 CG MET A 702 10.676 1.062 8.445 1.00 0.00 C ATOM 448 SD MET A 702 12.247 1.529 7.668 1.00 0.00 S ATOM 449 CE MET A 702 12.038 0.782 6.033 1.00 0.00 C ATOM 0 H MET A 702 8.483 -0.400 7.871 1.00 0.00 H new ATOM 0 HA MET A 702 11.022 -1.541 7.350 1.00 0.00 H new ATOM 0 HB2 MET A 702 9.895 -0.306 9.900 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.595 -0.536 9.541 1.00 0.00 H new ATOM 0 HG2 MET A 702 9.891 1.117 7.690 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.437 1.804 9.207 1.00 0.00 H new ATOM 0 HE1 MET A 702 12.695 1.279 5.319 1.00 0.00 H new ATOM 0 HE2 MET A 702 12.291 -0.277 6.082 1.00 0.00 H new ATOM 0 HE3 MET A 702 11.002 0.894 5.712 1.00 0.00 H new ATOM 459 N ALA A 703 9.037 -3.342 9.166 1.00 0.00 N ATOM 460 CA ALA A 703 8.894 -4.602 9.881 1.00 0.00 C ATOM 461 C ALA A 703 8.453 -5.718 8.937 1.00 0.00 C ATOM 462 O ALA A 703 8.594 -6.902 9.236 1.00 0.00 O ATOM 463 CB ALA A 703 7.836 -4.435 10.966 1.00 0.00 C ATOM 0 H ALA A 703 8.151 -2.932 8.871 1.00 0.00 H new ATOM 0 HA ALA A 703 9.858 -4.868 10.315 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.720 -5.373 11.509 1.00 0.00 H new ATOM 0 HB2 ALA A 703 8.145 -3.651 11.658 1.00 0.00 H new ATOM 0 HB3 ALA A 703 6.886 -4.161 10.508 1.00 0.00 H new ATOM 469 N GLU A 704 7.912 -5.333 7.783 1.00 0.00 N ATOM 470 CA GLU A 704 7.420 -6.219 6.770 1.00 0.00 C ATOM 471 C GLU A 704 8.612 -6.808 6.031 1.00 0.00 C ATOM 472 O GLU A 704 8.532 -7.878 5.434 1.00 0.00 O ATOM 473 CB GLU A 704 6.599 -5.323 5.849 1.00 0.00 C ATOM 474 CG GLU A 704 6.132 -6.141 4.682 1.00 0.00 C ATOM 475 CD GLU A 704 5.128 -5.361 3.837 1.00 0.00 C ATOM 476 OE1 GLU A 704 3.926 -5.405 4.181 1.00 0.00 O ATOM 477 OE2 GLU A 704 5.576 -4.728 2.854 1.00 0.00 O ATOM 0 H GLU A 704 7.807 -4.350 7.533 1.00 0.00 H new ATOM 0 HA GLU A 704 6.825 -7.046 7.157 1.00 0.00 H new ATOM 0 HB2 GLU A 704 5.746 -4.908 6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.200 -4.481 5.505 1.00 0.00 H new ATOM 0 HG2 GLU A 704 6.986 -6.426 4.068 1.00 0.00 H new ATOM 0 HG3 GLU A 704 5.674 -7.063 5.039 1.00 0.00 H new ATOM 484 N TRP A 705 9.724 -6.078 6.089 1.00 0.00 N ATOM 485 CA TRP A 705 10.942 -6.394 5.382 1.00 0.00 C ATOM 486 C TRP A 705 11.812 -7.273 6.260 1.00 0.00 C ATOM 487 O TRP A 705 12.599 -8.079 5.771 1.00 0.00 O ATOM 488 CB TRP A 705 11.625 -5.067 5.087 1.00 0.00 C ATOM 489 CG TRP A 705 10.917 -4.223 4.081 1.00 0.00 C ATOM 490 CD1 TRP A 705 9.825 -4.571 3.366 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.246 -2.872 3.662 1.00 0.00 C ATOM 492 NE1 TRP A 705 9.460 -3.532 2.538 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.317 -2.460 2.667 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.253 -1.964 4.025 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.397 -1.208 2.052 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.362 -0.722 3.390 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.439 -0.345 2.404 1.00 0.00 C ATOM 0 H TRP A 705 9.794 -5.228 6.648 1.00 0.00 H new ATOM 0 HA TRP A 705 10.753 -6.936 4.455 1.00 0.00 H new ATOM 0 HB2 TRP A 705 11.717 -4.504 6.016 1.00 0.00 H new ATOM 0 HB3 TRP A 705 12.637 -5.263 4.732 1.00 0.00 H new ATOM 0 HD1 TRP A 705 9.315 -5.521 3.433 1.00 0.00 H new ATOM 0 HE1 TRP A 705 8.657 -3.553 1.909 1.00 0.00 H new ATOM 0 HE3 TRP A 705 12.953 -2.227 4.804 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.665 -0.911 1.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 13.162 -0.049 3.661 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.533 0.614 1.916 1.00 0.00 H new ATOM 575 N MET B 1 -12.560 11.541 -16.368 1.00 0.00 N ATOM 576 CA MET B 1 -12.136 11.590 -14.953 1.00 0.00 C ATOM 577 C MET B 1 -11.148 10.471 -14.647 1.00 0.00 C ATOM 578 O MET B 1 -11.346 9.351 -15.105 1.00 0.00 O ATOM 579 CB MET B 1 -13.340 11.477 -14.011 1.00 0.00 C ATOM 580 CG MET B 1 -14.047 10.119 -14.123 1.00 0.00 C ATOM 581 SD MET B 1 -14.982 9.837 -15.650 1.00 0.00 S ATOM 582 CE MET B 1 -16.317 11.045 -15.426 1.00 0.00 C ATOM 0 H1 MET B 1 -12.719 12.508 -16.717 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.818 11.085 -16.937 1.00 0.00 H new ATOM 0 H3 MET B 1 -13.442 10.995 -16.447 1.00 0.00 H new ATOM 0 HA MET B 1 -11.651 12.552 -14.790 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.009 11.627 -12.983 1.00 0.00 H new ATOM 0 HB3 MET B 1 -14.050 12.273 -14.237 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.298 9.332 -14.028 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.728 10.015 -13.278 1.00 0.00 H new ATOM 0 HE1 MET B 1 -17.115 10.841 -16.140 1.00 0.00 H new ATOM 0 HE2 MET B 1 -16.709 10.970 -14.412 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.930 12.050 -15.592 1.00 0.00 H new ATOM 594 N GLN B 2 -10.095 10.763 -13.882 1.00 0.00 N ATOM 595 CA GLN B 2 -9.101 9.781 -13.482 1.00 0.00 C ATOM 596 C GLN B 2 -8.245 10.344 -12.347 1.00 0.00 C ATOM 597 O GLN B 2 -8.105 11.560 -12.237 1.00 0.00 O ATOM 598 CB GLN B 2 -8.244 9.443 -14.704 1.00 0.00 C ATOM 599 CG GLN B 2 -7.838 10.713 -15.457 1.00 0.00 C ATOM 600 CD GLN B 2 -6.965 10.456 -16.681 1.00 0.00 C ATOM 601 OE1 GLN B 2 -6.098 11.265 -17.004 1.00 0.00 O ATOM 602 NE2 GLN B 2 -7.167 9.342 -17.380 1.00 0.00 N ATOM 0 H GLN B 2 -9.912 11.700 -13.522 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.582 8.874 -13.117 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.352 8.902 -14.389 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.799 8.782 -15.370 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.739 11.241 -15.770 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -7.303 11.373 -14.774 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.892 8.685 -17.093 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.596 9.145 -18.202 1.00 0.00 H new ATOM 611 N ILE B 3 -7.675 9.470 -11.510 1.00 0.00 N ATOM 612 CA ILE B 3 -6.862 9.895 -10.371 1.00 0.00 C ATOM 613 C ILE B 3 -5.405 9.506 -10.579 1.00 0.00 C ATOM 614 O ILE B 3 -5.103 8.619 -11.373 1.00 0.00 O ATOM 615 CB ILE B 3 -7.403 9.352 -9.032 1.00 0.00 C ATOM 616 CG1 ILE B 3 -6.990 7.905 -8.750 1.00 0.00 C ATOM 617 CG2 ILE B 3 -8.927 9.466 -8.917 1.00 0.00 C ATOM 618 CD1 ILE B 3 -7.493 6.895 -9.781 1.00 0.00 C ATOM 0 H ILE B 3 -7.764 8.458 -11.603 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.923 10.982 -10.313 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.941 9.993 -8.281 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.902 7.852 -8.707 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.362 7.618 -7.766 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.250 9.069 -7.955 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.220 10.513 -8.994 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.396 8.898 -9.720 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.156 5.896 -9.506 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -8.582 6.916 -9.809 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.100 7.153 -10.764 1.00 0.00 H new ATOM 630 N PHE B 4 -4.502 10.177 -9.858 1.00 0.00 N ATOM 631 CA PHE B 4 -3.069 10.011 -10.030 1.00 0.00 C ATOM 632 C PHE B 4 -2.514 9.235 -8.845 1.00 0.00 C ATOM 633 O PHE B 4 -2.150 9.810 -7.822 1.00 0.00 O ATOM 634 CB PHE B 4 -2.386 11.376 -10.125 1.00 0.00 C ATOM 635 CG PHE B 4 -2.576 12.139 -11.420 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.796 12.115 -12.112 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.509 12.890 -11.938 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.944 12.806 -13.319 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.657 13.593 -13.144 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.874 13.548 -13.837 1.00 0.00 C ATOM 0 H PHE B 4 -4.753 10.853 -9.136 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.876 9.463 -10.952 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.750 11.997 -9.307 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.317 11.234 -9.966 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.629 11.558 -11.709 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.570 12.927 -11.406 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.883 12.768 -13.852 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.833 14.169 -13.538 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.987 14.084 -14.768 1.00 0.00 H new ATOM 650 N VAL B 5 -2.453 7.918 -8.989 1.00 0.00 N ATOM 651 CA VAL B 5 -1.962 7.043 -7.933 1.00 0.00 C ATOM 652 C VAL B 5 -0.436 6.983 -7.985 1.00 0.00 C ATOM 653 O VAL B 5 0.128 6.384 -8.898 1.00 0.00 O ATOM 654 CB VAL B 5 -2.555 5.642 -8.106 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.123 4.743 -6.948 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.083 5.704 -8.141 1.00 0.00 C ATOM 0 H VAL B 5 -2.741 7.428 -9.836 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.267 7.436 -6.963 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.189 5.234 -9.048 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -2.550 3.749 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.036 4.671 -6.929 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -2.475 5.167 -6.007 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.485 4.698 -8.265 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.451 6.130 -7.208 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.403 6.328 -8.976 1.00 0.00 H new ATOM 666 N LYS B 6 0.236 7.604 -7.010 1.00 0.00 N ATOM 667 CA LYS B 6 1.689 7.587 -6.923 1.00 0.00 C ATOM 668 C LYS B 6 2.153 6.256 -6.351 1.00 0.00 C ATOM 669 O LYS B 6 1.815 5.907 -5.219 1.00 0.00 O ATOM 670 CB LYS B 6 2.148 8.759 -6.055 1.00 0.00 C ATOM 671 CG LYS B 6 3.668 8.728 -5.898 1.00 0.00 C ATOM 672 CD LYS B 6 4.177 10.031 -5.292 1.00 0.00 C ATOM 673 CE LYS B 6 4.042 11.150 -6.320 1.00 0.00 C ATOM 674 NZ LYS B 6 4.577 12.425 -5.799 1.00 0.00 N ATOM 0 H LYS B 6 -0.217 8.130 -6.263 1.00 0.00 H new ATOM 0 HA LYS B 6 2.130 7.695 -7.914 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.840 9.701 -6.509 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.672 8.706 -5.076 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.955 7.890 -5.263 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.135 8.567 -6.870 1.00 0.00 H new ATOM 0 HD2 LYS B 6 3.608 10.275 -4.395 1.00 0.00 H new ATOM 0 HD3 LYS B 6 5.219 9.923 -4.990 1.00 0.00 H new ATOM 0 HE2 LYS B 6 4.573 10.876 -7.231 1.00 0.00 H new ATOM 0 HE3 LYS B 6 2.993 11.276 -6.588 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.471 13.167 -6.520 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.053 12.697 -4.943 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 5.584 12.310 -5.566 1.00 0.00 H new ATOM 688 N THR B 7 2.932 5.519 -7.141 1.00 0.00 N ATOM 689 CA THR B 7 3.477 4.234 -6.735 1.00 0.00 C ATOM 690 C THR B 7 4.677 4.442 -5.813 1.00 0.00 C ATOM 691 O THR B 7 5.145 5.565 -5.632 1.00 0.00 O ATOM 692 CB THR B 7 3.855 3.416 -7.971 1.00 0.00 C ATOM 693 OG1 THR B 7 3.992 2.061 -7.599 1.00 0.00 O ATOM 694 CG2 THR B 7 5.170 3.890 -8.575 1.00 0.00 C ATOM 0 H THR B 7 3.201 5.801 -8.083 1.00 0.00 H new ATOM 0 HA THR B 7 2.722 3.677 -6.180 1.00 0.00 H new ATOM 0 HB THR B 7 3.068 3.541 -8.715 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.233 1.529 -8.386 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.407 3.286 -9.451 1.00 0.00 H new ATOM 0 HG22 THR B 7 5.079 4.936 -8.869 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.967 3.788 -7.838 1.00 0.00 H new ATOM 702 N LEU B 8 5.172 3.346 -5.236 1.00 0.00 N ATOM 703 CA LEU B 8 6.269 3.321 -4.271 1.00 0.00 C ATOM 704 C LEU B 8 7.632 3.719 -4.854 1.00 0.00 C ATOM 705 O LEU B 8 8.658 3.432 -4.240 1.00 0.00 O ATOM 706 CB LEU B 8 6.324 1.910 -3.682 1.00 0.00 C ATOM 707 CG LEU B 8 5.207 1.658 -2.665 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.335 0.229 -2.143 1.00 0.00 C ATOM 709 CD2 LEU B 8 5.299 2.630 -1.487 1.00 0.00 C ATOM 0 H LEU B 8 4.804 2.416 -5.437 1.00 0.00 H new ATOM 0 HA LEU B 8 6.067 4.073 -3.508 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.250 1.180 -4.488 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.290 1.757 -3.202 1.00 0.00 H new ATOM 0 HG LEU B 8 4.246 1.808 -3.158 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.545 0.035 -1.417 1.00 0.00 H new ATOM 0 HD12 LEU B 8 5.245 -0.471 -2.973 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.306 0.102 -1.665 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.493 2.426 -0.783 1.00 0.00 H new ATOM 0 HD22 LEU B 8 6.259 2.505 -0.986 1.00 0.00 H new ATOM 0 HD23 LEU B 8 5.211 3.653 -1.852 1.00 0.00 H new ATOM 721 N THR B 9 7.670 4.374 -6.018 1.00 0.00 N ATOM 722 CA THR B 9 8.919 4.818 -6.633 1.00 0.00 C ATOM 723 C THR B 9 8.828 6.268 -7.106 1.00 0.00 C ATOM 724 O THR B 9 9.769 6.779 -7.715 1.00 0.00 O ATOM 725 CB THR B 9 9.299 3.905 -7.800 1.00 0.00 C ATOM 726 OG1 THR B 9 8.315 3.986 -8.806 1.00 0.00 O ATOM 727 CG2 THR B 9 9.436 2.449 -7.350 1.00 0.00 C ATOM 0 H THR B 9 6.837 4.610 -6.557 1.00 0.00 H new ATOM 0 HA THR B 9 9.697 4.762 -5.872 1.00 0.00 H new ATOM 0 HB THR B 9 10.262 4.239 -8.186 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.562 3.402 -9.553 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.707 1.828 -8.204 1.00 0.00 H new ATOM 0 HG22 THR B 9 10.211 2.375 -6.588 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.488 2.105 -6.937 1.00 0.00 H new ATOM 735 N GLY B 10 7.703 6.942 -6.834 1.00 0.00 N ATOM 736 CA GLY B 10 7.510 8.340 -7.200 1.00 0.00 C ATOM 737 C GLY B 10 6.815 8.481 -8.551 1.00 0.00 C ATOM 738 O GLY B 10 6.477 9.592 -8.960 1.00 0.00 O ATOM 0 H GLY B 10 6.904 6.528 -6.354 1.00 0.00 H new ATOM 0 HA2 GLY B 10 6.917 8.838 -6.433 1.00 0.00 H new ATOM 0 HA3 GLY B 10 8.476 8.844 -7.234 1.00 0.00 H new ATOM 742 N LYS B 11 6.602 7.358 -9.241 1.00 0.00 N ATOM 743 CA LYS B 11 5.924 7.323 -10.523 1.00 0.00 C ATOM 744 C LYS B 11 4.425 7.412 -10.264 1.00 0.00 C ATOM 745 O LYS B 11 3.970 7.121 -9.161 1.00 0.00 O ATOM 746 CB LYS B 11 6.360 6.036 -11.239 1.00 0.00 C ATOM 747 CG LYS B 11 5.540 5.658 -12.472 1.00 0.00 C ATOM 748 CD LYS B 11 4.360 4.742 -12.112 1.00 0.00 C ATOM 749 CE LYS B 11 3.587 4.358 -13.374 1.00 0.00 C ATOM 750 NZ LYS B 11 4.400 3.522 -14.278 1.00 0.00 N ATOM 0 H LYS B 11 6.902 6.440 -8.914 1.00 0.00 H new ATOM 0 HA LYS B 11 6.181 8.159 -11.173 1.00 0.00 H new ATOM 0 HB2 LYS B 11 7.403 6.142 -11.537 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.314 5.212 -10.527 1.00 0.00 H new ATOM 0 HG2 LYS B 11 5.165 6.563 -12.951 1.00 0.00 H new ATOM 0 HG3 LYS B 11 6.182 5.156 -13.196 1.00 0.00 H new ATOM 0 HD2 LYS B 11 4.726 3.844 -11.613 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.697 5.249 -11.411 1.00 0.00 H new ATOM 0 HE2 LYS B 11 2.681 3.819 -13.096 1.00 0.00 H new ATOM 0 HE3 LYS B 11 3.273 5.261 -13.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 4.532 4.017 -15.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 5.327 3.341 -13.843 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.914 2.618 -14.446 1.00 0.00 H new ATOM 764 N THR B 12 3.653 7.810 -11.274 1.00 0.00 N ATOM 765 CA THR B 12 2.224 8.014 -11.117 1.00 0.00 C ATOM 766 C THR B 12 1.473 7.183 -12.144 1.00 0.00 C ATOM 767 O THR B 12 1.930 7.003 -13.273 1.00 0.00 O ATOM 768 CB THR B 12 1.927 9.506 -11.273 1.00 0.00 C ATOM 769 OG1 THR B 12 2.542 10.212 -10.219 1.00 0.00 O ATOM 770 CG2 THR B 12 0.430 9.793 -11.239 1.00 0.00 C ATOM 0 H THR B 12 4.002 7.997 -12.214 1.00 0.00 H new ATOM 0 HA THR B 12 1.894 7.693 -10.129 1.00 0.00 H new ATOM 0 HB THR B 12 2.317 9.824 -12.240 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.357 11.170 -10.315 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.262 10.864 -11.353 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.061 9.260 -12.053 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.017 9.460 -10.287 1.00 0.00 H new ATOM 778 N ILE B 13 0.309 6.680 -11.733 1.00 0.00 N ATOM 779 CA ILE B 13 -0.569 5.871 -12.561 1.00 0.00 C ATOM 780 C ILE B 13 -1.870 6.650 -12.696 1.00 0.00 C ATOM 781 O ILE B 13 -2.280 7.313 -11.746 1.00 0.00 O ATOM 782 CB ILE B 13 -0.830 4.525 -11.873 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.454 3.874 -11.348 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.516 3.586 -12.863 1.00 0.00 C ATOM 785 CD1 ILE B 13 0.134 2.727 -10.390 1.00 0.00 C ATOM 0 H ILE B 13 -0.053 6.831 -10.791 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.128 5.670 -13.537 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.470 4.711 -11.010 1.00 0.00 H new ATOM 0 HG12 ILE B 13 1.045 3.500 -12.184 1.00 0.00 H new ATOM 0 HG13 ILE B 13 1.062 4.621 -10.837 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.706 2.626 -12.383 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.461 4.024 -13.185 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.872 3.437 -13.729 1.00 0.00 H new ATOM 0 HD11 ILE B 13 1.062 2.282 -10.032 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.436 3.109 -9.543 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.453 1.971 -10.911 1.00 0.00 H new ATOM 797 N THR B 14 -2.521 6.578 -13.856 1.00 0.00 N ATOM 798 CA THR B 14 -3.707 7.384 -14.097 1.00 0.00 C ATOM 799 C THR B 14 -4.781 6.575 -14.810 1.00 0.00 C ATOM 800 O THR B 14 -4.636 6.230 -15.981 1.00 0.00 O ATOM 801 CB THR B 14 -3.325 8.635 -14.890 1.00 0.00 C ATOM 802 OG1 THR B 14 -2.206 9.263 -14.304 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.492 9.616 -14.870 1.00 0.00 C ATOM 0 H THR B 14 -2.248 5.976 -14.633 1.00 0.00 H new ATOM 0 HA THR B 14 -4.126 7.696 -13.140 1.00 0.00 H new ATOM 0 HB THR B 14 -3.085 8.343 -15.912 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.971 10.061 -14.822 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.226 10.510 -15.434 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.367 9.149 -15.322 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.719 9.891 -13.840 1.00 0.00 H new ATOM 811 N LEU B 15 -5.860 6.277 -14.080 1.00 0.00 N ATOM 812 CA LEU B 15 -6.981 5.474 -14.541 1.00 0.00 C ATOM 813 C LEU B 15 -8.274 6.091 -14.037 1.00 0.00 C ATOM 814 O LEU B 15 -8.286 6.835 -13.057 1.00 0.00 O ATOM 815 CB LEU B 15 -6.824 3.991 -14.139 1.00 0.00 C ATOM 816 CG LEU B 15 -6.447 3.647 -12.685 1.00 0.00 C ATOM 817 CD1 LEU B 15 -5.107 4.230 -12.245 1.00 0.00 C ATOM 818 CD2 LEU B 15 -7.526 4.060 -11.692 1.00 0.00 C ATOM 0 H LEU B 15 -5.974 6.602 -13.120 1.00 0.00 H new ATOM 0 HA LEU B 15 -7.007 5.476 -15.631 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.765 3.488 -14.363 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.066 3.553 -14.788 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.354 2.561 -12.681 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -4.909 3.946 -11.211 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -4.314 3.844 -12.886 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -5.140 5.317 -12.323 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.212 3.796 -10.682 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.683 5.137 -11.753 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.456 3.543 -11.929 1.00 0.00 H new ATOM 830 N GLU B 16 -9.368 5.780 -14.725 1.00 0.00 N ATOM 831 CA GLU B 16 -10.629 6.453 -14.525 1.00 0.00 C ATOM 832 C GLU B 16 -11.440 5.770 -13.438 1.00 0.00 C ATOM 833 O GLU B 16 -11.336 4.564 -13.234 1.00 0.00 O ATOM 834 CB GLU B 16 -11.411 6.403 -15.836 1.00 0.00 C ATOM 835 CG GLU B 16 -10.605 7.020 -16.981 1.00 0.00 C ATOM 836 CD GLU B 16 -9.417 6.172 -17.431 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.610 4.949 -17.616 1.00 0.00 O ATOM 838 OE2 GLU B 16 -8.326 6.757 -17.587 1.00 0.00 O ATOM 0 H GLU B 16 -9.396 5.050 -15.437 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.442 7.483 -14.220 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.658 5.369 -16.077 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.354 6.938 -15.721 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -11.267 7.181 -17.832 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -10.242 8.000 -16.670 1.00 0.00 H new ATOM 845 N VAL B 17 -12.253 6.560 -12.741 1.00 0.00 N ATOM 846 CA VAL B 17 -13.065 6.086 -11.624 1.00 0.00 C ATOM 847 C VAL B 17 -14.349 6.897 -11.529 1.00 0.00 C ATOM 848 O VAL B 17 -14.526 7.873 -12.256 1.00 0.00 O ATOM 849 CB VAL B 17 -12.292 6.184 -10.300 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.077 5.260 -10.284 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.835 7.622 -10.036 1.00 0.00 C ATOM 0 H VAL B 17 -12.367 7.554 -12.937 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.310 5.039 -11.805 1.00 0.00 H new ATOM 0 HB VAL B 17 -12.978 5.871 -9.512 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.557 5.359 -9.331 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.403 4.228 -10.414 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.402 5.532 -11.095 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.290 7.663 -9.093 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.184 7.951 -10.846 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.705 8.276 -9.981 1.00 0.00 H new ATOM 861 N GLU B 18 -15.246 6.495 -10.628 1.00 0.00 N ATOM 862 CA GLU B 18 -16.527 7.163 -10.460 1.00 0.00 C ATOM 863 C GLU B 18 -16.887 7.202 -8.979 1.00 0.00 C ATOM 864 O GLU B 18 -16.363 6.411 -8.196 1.00 0.00 O ATOM 865 CB GLU B 18 -17.601 6.401 -11.243 1.00 0.00 C ATOM 866 CG GLU B 18 -17.257 6.363 -12.728 1.00 0.00 C ATOM 867 CD GLU B 18 -18.384 5.738 -13.548 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.439 6.398 -13.684 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.186 4.601 -14.033 1.00 0.00 O ATOM 0 H GLU B 18 -15.103 5.703 -10.001 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.465 8.184 -10.838 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.687 5.385 -10.858 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.570 6.879 -11.101 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.065 7.375 -13.084 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.339 5.794 -12.876 1.00 0.00 H new ATOM 876 N PRO B 19 -17.779 8.117 -8.584 1.00 0.00 N ATOM 877 CA PRO B 19 -18.254 8.229 -7.218 1.00 0.00 C ATOM 878 C PRO B 19 -19.148 7.047 -6.850 1.00 0.00 C ATOM 879 O PRO B 19 -19.727 7.026 -5.767 1.00 0.00 O ATOM 880 CB PRO B 19 -19.020 9.542 -7.157 1.00 0.00 C ATOM 881 CG PRO B 19 -19.499 9.751 -8.591 1.00 0.00 C ATOM 882 CD PRO B 19 -18.401 9.113 -9.439 1.00 0.00 C ATOM 0 HA PRO B 19 -17.431 8.216 -6.504 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.856 9.485 -6.460 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.383 10.362 -6.824 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.465 9.276 -8.763 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.619 10.809 -8.822 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.815 8.655 -10.337 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.675 9.858 -9.766 1.00 0.00 H new ATOM 890 N SER B 20 -19.259 6.066 -7.749 1.00 0.00 N ATOM 891 CA SER B 20 -20.046 4.869 -7.536 1.00 0.00 C ATOM 892 C SER B 20 -19.160 3.631 -7.641 1.00 0.00 C ATOM 893 O SER B 20 -19.637 2.512 -7.443 1.00 0.00 O ATOM 894 CB SER B 20 -21.195 4.834 -8.542 1.00 0.00 C ATOM 895 OG SER B 20 -20.691 4.891 -9.860 1.00 0.00 O ATOM 0 H SER B 20 -18.794 6.090 -8.656 1.00 0.00 H new ATOM 0 HA SER B 20 -20.473 4.878 -6.533 1.00 0.00 H new ATOM 0 HB2 SER B 20 -21.779 3.923 -8.407 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.868 5.673 -8.366 1.00 0.00 H new ATOM 0 HG SER B 20 -21.436 4.866 -10.496 1.00 0.00 H new ATOM 901 N ASP B 21 -17.872 3.821 -7.949 1.00 0.00 N ATOM 902 CA ASP B 21 -16.892 2.770 -7.849 1.00 0.00 C ATOM 903 C ASP B 21 -16.457 2.724 -6.394 1.00 0.00 C ATOM 904 O ASP B 21 -16.832 3.560 -5.574 1.00 0.00 O ATOM 905 CB ASP B 21 -15.683 3.037 -8.752 1.00 0.00 C ATOM 906 CG ASP B 21 -15.997 2.919 -10.243 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.192 2.839 -10.595 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.017 2.908 -11.020 1.00 0.00 O ATOM 0 H ASP B 21 -17.495 4.712 -8.273 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.321 1.822 -8.174 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.301 4.037 -8.547 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -14.889 2.334 -8.499 1.00 0.00 H new ATOM 913 N THR B 22 -15.653 1.721 -6.092 1.00 0.00 N ATOM 914 CA THR B 22 -15.185 1.400 -4.753 1.00 0.00 C ATOM 915 C THR B 22 -13.687 1.148 -4.808 1.00 0.00 C ATOM 916 O THR B 22 -13.120 1.018 -5.891 1.00 0.00 O ATOM 917 CB THR B 22 -15.954 0.181 -4.225 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.401 -0.261 -3.003 1.00 0.00 O ATOM 919 CG2 THR B 22 -15.907 -0.979 -5.221 1.00 0.00 C ATOM 0 H THR B 22 -15.293 1.081 -6.800 1.00 0.00 H new ATOM 0 HA THR B 22 -15.367 2.227 -4.067 1.00 0.00 H new ATOM 0 HB THR B 22 -16.989 0.492 -4.080 1.00 0.00 H new ATOM 0 HG1 THR B 22 -15.636 0.369 -2.291 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.461 -1.827 -4.818 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.356 -0.667 -6.164 1.00 0.00 H new ATOM 0 HG23 THR B 22 -14.871 -1.270 -5.392 1.00 0.00 H new ATOM 927 N ILE B 23 -13.035 1.076 -3.648 1.00 0.00 N ATOM 928 CA ILE B 23 -11.603 0.850 -3.587 1.00 0.00 C ATOM 929 C ILE B 23 -11.238 -0.450 -4.301 1.00 0.00 C ATOM 930 O ILE B 23 -10.144 -0.567 -4.851 1.00 0.00 O ATOM 931 CB ILE B 23 -11.172 0.830 -2.116 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.545 2.137 -1.404 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.665 0.605 -2.018 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.115 3.402 -2.153 1.00 0.00 C ATOM 0 H ILE B 23 -13.484 1.172 -2.737 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.073 1.654 -4.098 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.699 0.012 -1.624 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.625 2.163 -1.258 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.090 2.142 -0.414 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.366 0.592 -0.970 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.409 -0.348 -2.480 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.143 1.410 -2.534 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.416 4.282 -1.584 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.032 3.402 -2.276 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.591 3.424 -3.133 1.00 0.00 H new ATOM 946 N GLU B 24 -12.143 -1.432 -4.303 1.00 0.00 N ATOM 947 CA GLU B 24 -11.918 -2.683 -5.012 1.00 0.00 C ATOM 948 C GLU B 24 -11.802 -2.436 -6.517 1.00 0.00 C ATOM 949 O GLU B 24 -11.051 -3.124 -7.203 1.00 0.00 O ATOM 950 CB GLU B 24 -13.064 -3.647 -4.696 1.00 0.00 C ATOM 951 CG GLU B 24 -12.991 -4.871 -5.605 1.00 0.00 C ATOM 952 CD GLU B 24 -13.922 -5.977 -5.120 1.00 0.00 C ATOM 953 OE1 GLU B 24 -15.108 -5.951 -5.517 1.00 0.00 O ATOM 954 OE2 GLU B 24 -13.443 -6.846 -4.356 1.00 0.00 O ATOM 0 H GLU B 24 -13.039 -1.379 -3.819 1.00 0.00 H new ATOM 0 HA GLU B 24 -10.979 -3.127 -4.682 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -13.011 -3.957 -3.652 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -14.021 -3.142 -4.830 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -13.259 -4.587 -6.623 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -11.967 -5.243 -5.637 1.00 0.00 H new ATOM 961 N ASN B 25 -12.545 -1.453 -7.028 1.00 0.00 N ATOM 962 CA ASN B 25 -12.505 -1.102 -8.436 1.00 0.00 C ATOM 963 C ASN B 25 -11.206 -0.360 -8.734 1.00 0.00 C ATOM 964 O ASN B 25 -10.611 -0.560 -9.790 1.00 0.00 O ATOM 965 CB ASN B 25 -13.701 -0.208 -8.780 1.00 0.00 C ATOM 966 CG ASN B 25 -14.600 -0.830 -9.839 1.00 0.00 C ATOM 967 OD1 ASN B 25 -14.802 -2.039 -9.866 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.144 -0.002 -10.720 1.00 0.00 N ATOM 0 H ASN B 25 -13.186 -0.884 -6.475 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.553 -2.009 -9.039 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -14.283 -0.020 -7.878 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.340 0.758 -9.134 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -15.754 -0.365 -11.452 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -14.953 0.998 -10.666 1.00 0.00 H new ATOM 975 N VAL B 26 -10.764 0.494 -7.805 1.00 0.00 N ATOM 976 CA VAL B 26 -9.539 1.252 -7.986 1.00 0.00 C ATOM 977 C VAL B 26 -8.355 0.294 -8.041 1.00 0.00 C ATOM 978 O VAL B 26 -7.436 0.501 -8.830 1.00 0.00 O ATOM 979 CB VAL B 26 -9.382 2.278 -6.857 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.126 3.119 -7.081 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.584 3.225 -6.837 1.00 0.00 C ATOM 0 H VAL B 26 -11.243 0.672 -6.922 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.580 1.801 -8.927 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.311 1.736 -5.914 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.025 3.844 -6.273 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.251 2.469 -7.097 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.205 3.645 -8.033 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.463 3.950 -6.032 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.650 3.749 -7.790 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.496 2.651 -6.675 1.00 0.00 H new ATOM 991 N LYS B 27 -8.365 -0.759 -7.217 1.00 0.00 N ATOM 992 CA LYS B 27 -7.304 -1.753 -7.251 1.00 0.00 C ATOM 993 C LYS B 27 -7.356 -2.542 -8.553 1.00 0.00 C ATOM 994 O LYS B 27 -6.316 -2.940 -9.073 1.00 0.00 O ATOM 995 CB LYS B 27 -7.426 -2.713 -6.065 1.00 0.00 C ATOM 996 CG LYS B 27 -7.148 -2.012 -4.737 1.00 0.00 C ATOM 997 CD LYS B 27 -7.346 -3.003 -3.588 1.00 0.00 C ATOM 998 CE LYS B 27 -7.009 -2.333 -2.254 1.00 0.00 C ATOM 999 NZ LYS B 27 -7.120 -3.284 -1.133 1.00 0.00 N ATOM 0 H LYS B 27 -9.093 -0.938 -6.526 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.349 -1.231 -7.187 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -8.428 -3.142 -6.047 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -6.727 -3.540 -6.193 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.130 -1.623 -4.725 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -7.817 -1.160 -4.616 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -8.377 -3.357 -3.576 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -6.711 -3.876 -3.736 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -5.997 -1.930 -2.293 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -7.681 -1.491 -2.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -7.643 -2.840 -0.351 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -7.627 -4.135 -1.449 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -6.169 -3.549 -0.807 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.556 -2.770 -9.091 1.00 0.00 N ATOM 1014 CA ALA B 28 -8.724 -3.511 -10.330 1.00 0.00 C ATOM 1015 C ALA B 28 -8.274 -2.687 -11.537 1.00 0.00 C ATOM 1016 O ALA B 28 -7.837 -3.255 -12.538 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.202 -3.886 -10.464 1.00 0.00 C ATOM 0 H ALA B 28 -9.430 -2.446 -8.678 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.104 -4.407 -10.303 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.353 -4.444 -11.388 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.499 -4.502 -9.615 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -10.807 -2.980 -10.484 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.373 -1.355 -11.457 1.00 0.00 N ATOM 1024 CA LYS B 29 -7.894 -0.480 -12.520 1.00 0.00 C ATOM 1025 C LYS B 29 -6.377 -0.354 -12.451 1.00 0.00 C ATOM 1026 O LYS B 29 -5.720 -0.225 -13.481 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.540 0.897 -12.371 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.042 0.836 -12.649 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.790 1.813 -11.749 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.300 1.630 -11.879 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.797 2.155 -13.166 1.00 0.00 N ATOM 0 H LYS B 29 -8.783 -0.864 -10.663 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.165 -0.905 -13.487 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.369 1.275 -11.363 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.068 1.599 -13.059 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.235 1.075 -13.695 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.408 -0.177 -12.481 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.490 1.661 -10.712 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.520 2.836 -12.013 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.548 0.572 -11.796 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.802 2.141 -11.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.830 2.268 -13.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.356 3.077 -13.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.556 1.490 -13.929 1.00 0.00 H new ATOM 1045 N ILE B 30 -5.811 -0.397 -11.242 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.366 -0.394 -11.062 1.00 0.00 C ATOM 1047 C ILE B 30 -3.801 -1.751 -11.464 1.00 0.00 C ATOM 1048 O ILE B 30 -2.665 -1.844 -11.927 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.044 -0.077 -9.598 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.447 1.370 -9.305 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.553 -0.263 -9.298 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.525 1.615 -7.799 1.00 0.00 C ATOM 0 H ILE B 30 -6.340 -0.434 -10.371 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.909 0.368 -11.693 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.602 -0.766 -8.964 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.724 2.052 -9.752 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.412 1.584 -9.764 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.361 -0.030 -8.251 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.268 -1.296 -9.498 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.968 0.404 -9.932 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.813 2.650 -7.613 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.266 0.947 -7.360 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.551 1.423 -7.348 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.590 -2.817 -11.297 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.191 -4.143 -11.729 1.00 0.00 C ATOM 1066 C GLN B 31 -4.156 -4.211 -13.255 1.00 0.00 C ATOM 1067 O GLN B 31 -3.601 -5.133 -13.846 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.155 -5.180 -11.147 1.00 0.00 C ATOM 1069 CG GLN B 31 -4.646 -6.546 -11.594 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.163 -7.711 -10.773 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.310 -7.725 -10.334 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.303 -8.704 -10.566 1.00 0.00 N ATOM 0 H GLN B 31 -5.512 -2.778 -10.862 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.187 -4.362 -11.364 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.185 -5.114 -10.059 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.170 -5.009 -11.504 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -4.926 -6.700 -12.636 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.557 -6.545 -11.553 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.360 -8.650 -10.950 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -4.587 -9.520 -10.023 1.00 0.00 H new ATOM 1081 N ASP B 32 -4.756 -3.218 -13.900 1.00 0.00 N ATOM 1082 CA ASP B 32 -4.774 -3.104 -15.349 1.00 0.00 C ATOM 1083 C ASP B 32 -3.564 -2.312 -15.820 1.00 0.00 C ATOM 1084 O ASP B 32 -2.960 -2.615 -16.847 1.00 0.00 O ATOM 1085 CB ASP B 32 -6.030 -2.335 -15.753 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.565 -2.806 -17.101 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.172 -3.899 -17.133 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.363 -2.069 -18.092 1.00 0.00 O ATOM 0 H ASP B 32 -5.249 -2.462 -13.424 1.00 0.00 H new ATOM 0 HA ASP B 32 -4.759 -4.099 -15.794 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -6.798 -2.464 -14.990 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.805 -1.269 -15.802 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.224 -1.285 -15.038 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.145 -0.363 -15.339 1.00 0.00 C ATOM 1095 C LYS B 33 -0.769 -0.929 -15.005 1.00 0.00 C ATOM 1096 O LYS B 33 0.207 -0.586 -15.666 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.377 0.897 -14.516 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.543 1.731 -15.049 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.211 2.338 -16.410 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.270 3.386 -16.746 1.00 0.00 C ATOM 1101 NZ LYS B 33 -4.108 3.909 -18.114 1.00 0.00 N ATOM 0 H LYS B 33 -3.704 -1.074 -14.163 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.152 -0.164 -16.411 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.574 0.621 -13.480 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.470 1.502 -14.517 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.432 1.106 -15.134 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.779 2.526 -14.341 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.221 2.793 -16.390 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.190 1.562 -17.175 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.262 2.947 -16.640 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.207 4.208 -16.033 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.845 4.618 -18.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.171 4.350 -18.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.193 3.129 -18.796 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.683 -1.788 -13.988 1.00 0.00 N ATOM 1116 CA GLU B 34 0.592 -2.342 -13.549 1.00 0.00 C ATOM 1117 C GLU B 34 0.555 -3.853 -13.322 1.00 0.00 C ATOM 1118 O GLU B 34 1.605 -4.473 -13.169 1.00 0.00 O ATOM 1119 CB GLU B 34 0.971 -1.665 -12.234 1.00 0.00 C ATOM 1120 CG GLU B 34 1.321 -0.185 -12.410 1.00 0.00 C ATOM 1121 CD GLU B 34 2.566 0.033 -13.272 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.425 -0.874 -13.304 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.648 1.114 -13.897 1.00 0.00 O ATOM 0 H GLU B 34 -1.488 -2.114 -13.453 1.00 0.00 H new ATOM 0 HA GLU B 34 1.319 -2.158 -14.340 1.00 0.00 H new ATOM 0 HB2 GLU B 34 0.143 -1.757 -11.531 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.822 -2.185 -11.794 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.476 0.332 -12.864 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.480 0.265 -11.430 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.635 -4.455 -13.297 1.00 0.00 N ATOM 1131 CA GLY B 35 -0.762 -5.893 -13.065 1.00 0.00 C ATOM 1132 C GLY B 35 -0.551 -6.247 -11.597 1.00 0.00 C ATOM 1133 O GLY B 35 -0.303 -7.407 -11.275 1.00 0.00 O ATOM 0 H GLY B 35 -1.522 -3.970 -13.434 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -1.750 -6.227 -13.382 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.034 -6.426 -13.676 1.00 0.00 H new ATOM 1137 N ILE B 36 -0.647 -5.253 -10.709 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.433 -5.469 -9.285 1.00 0.00 C ATOM 1139 C ILE B 36 -1.655 -6.181 -8.717 1.00 0.00 C ATOM 1140 O ILE B 36 -2.784 -5.800 -9.028 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.223 -4.124 -8.583 1.00 0.00 C ATOM 1142 CG1 ILE B 36 1.091 -3.502 -9.054 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.164 -4.303 -7.064 1.00 0.00 C ATOM 1144 CD1 ILE B 36 1.102 -1.997 -8.793 1.00 0.00 C ATOM 0 H ILE B 36 -0.873 -4.290 -10.958 1.00 0.00 H new ATOM 0 HA ILE B 36 0.455 -6.081 -9.124 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.063 -3.475 -8.832 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.927 -3.972 -8.536 1.00 0.00 H new ATOM 0 HG13 ILE B 36 1.228 -3.692 -10.119 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.014 -3.333 -6.589 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.099 -4.739 -6.712 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.664 -4.964 -6.807 1.00 0.00 H new ATOM 0 HD11 ILE B 36 2.047 -1.575 -9.136 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.278 -1.528 -9.332 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.989 -1.812 -7.725 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.452 -7.205 -7.884 1.00 0.00 N ATOM 1157 CA PRO B 37 -2.539 -7.958 -7.296 1.00 0.00 C ATOM 1158 C PRO B 37 -3.278 -7.111 -6.270 1.00 0.00 C ATOM 1159 O PRO B 37 -2.649 -6.541 -5.379 1.00 0.00 O ATOM 1160 CB PRO B 37 -1.878 -9.155 -6.616 1.00 0.00 C ATOM 1161 CG PRO B 37 -0.452 -8.690 -6.336 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.159 -7.708 -7.466 1.00 0.00 C ATOM 0 HA PRO B 37 -3.271 -8.265 -8.043 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -2.396 -9.426 -5.696 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -1.890 -10.035 -7.259 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -0.372 -8.212 -5.360 1.00 0.00 H new ATOM 0 HG3 PRO B 37 0.249 -9.525 -6.340 1.00 0.00 H new ATOM 0 HD2 PRO B 37 0.486 -6.898 -7.125 1.00 0.00 H new ATOM 0 HD3 PRO B 37 0.356 -8.200 -8.291 1.00 0.00 H new ATOM 1170 N PRO B 38 -4.610 -7.019 -6.370 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.443 -6.423 -5.341 1.00 0.00 C ATOM 1172 C PRO B 38 -5.202 -7.096 -3.987 1.00 0.00 C ATOM 1173 O PRO B 38 -5.478 -6.503 -2.945 1.00 0.00 O ATOM 1174 CB PRO B 38 -6.884 -6.620 -5.816 1.00 0.00 C ATOM 1175 CG PRO B 38 -6.794 -7.711 -6.882 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.419 -7.479 -7.481 1.00 0.00 C ATOM 0 HA PRO B 38 -5.216 -5.367 -5.195 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.534 -6.921 -4.995 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.295 -5.698 -6.227 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -6.885 -8.708 -6.450 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -7.582 -7.614 -7.628 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.015 -8.394 -7.913 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -5.454 -6.738 -8.280 1.00 0.00 H new ATOM 1184 N ASP B 39 -4.682 -8.328 -4.007 1.00 0.00 N ATOM 1185 CA ASP B 39 -4.289 -9.072 -2.822 1.00 0.00 C ATOM 1186 C ASP B 39 -3.064 -8.458 -2.132 1.00 0.00 C ATOM 1187 O ASP B 39 -2.693 -8.898 -1.045 1.00 0.00 O ATOM 1188 CB ASP B 39 -3.995 -10.511 -3.232 1.00 0.00 C ATOM 1189 CG ASP B 39 -5.216 -11.178 -3.860 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -6.057 -11.691 -3.089 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -5.297 -11.168 -5.110 1.00 0.00 O ATOM 0 H ASP B 39 -4.522 -8.842 -4.873 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.107 -9.036 -2.102 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -3.167 -10.526 -3.941 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -3.677 -11.081 -2.359 1.00 0.00 H new ATOM 1196 N GLN B 40 -2.434 -7.451 -2.743 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.348 -6.714 -2.103 1.00 0.00 C ATOM 1198 C GLN B 40 -1.584 -5.211 -2.110 1.00 0.00 C ATOM 1199 O GLN B 40 -0.905 -4.498 -1.377 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.021 -7.009 -2.798 1.00 0.00 C ATOM 1201 CG GLN B 40 0.345 -8.476 -2.596 1.00 0.00 C ATOM 1202 CD GLN B 40 1.676 -8.867 -3.242 1.00 0.00 C ATOM 1203 OE1 GLN B 40 1.900 -10.037 -3.530 1.00 0.00 O ATOM 1204 NE2 GLN B 40 2.566 -7.907 -3.473 1.00 0.00 N ATOM 0 H GLN B 40 -2.661 -7.129 -3.684 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.314 -7.049 -1.066 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.098 -6.786 -3.862 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.763 -6.369 -2.394 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.393 -8.687 -1.528 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -0.447 -9.100 -3.009 1.00 0.00 H new ATOM 0 HE21 GLN B 40 2.352 -6.942 -3.223 1.00 0.00 H new ATOM 0 HE22 GLN B 40 3.463 -8.136 -3.901 1.00 0.00 H new ATOM 1213 N GLN B 41 -2.519 -4.708 -2.915 1.00 0.00 N ATOM 1214 CA GLN B 41 -2.727 -3.270 -2.982 1.00 0.00 C ATOM 1215 C GLN B 41 -3.330 -2.715 -1.696 1.00 0.00 C ATOM 1216 O GLN B 41 -4.143 -3.358 -1.033 1.00 0.00 O ATOM 1217 CB GLN B 41 -3.629 -2.906 -4.157 1.00 0.00 C ATOM 1218 CG GLN B 41 -2.899 -3.133 -5.479 1.00 0.00 C ATOM 1219 CD GLN B 41 -3.708 -2.597 -6.648 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.137 -1.450 -6.621 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -3.924 -3.415 -7.673 1.00 0.00 N ATOM 0 H GLN B 41 -3.129 -5.263 -3.515 1.00 0.00 H new ATOM 0 HA GLN B 41 -1.744 -2.820 -3.121 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -4.537 -3.509 -4.127 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -3.936 -1.863 -4.078 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -1.926 -2.642 -5.450 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -2.714 -4.198 -5.618 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -3.549 -4.363 -7.656 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.465 -3.094 -8.476 1.00 0.00 H new ATOM 1230 N ARG B 42 -2.909 -1.494 -1.375 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.452 -0.667 -0.309 1.00 0.00 C ATOM 1232 C ARG B 42 -3.473 0.759 -0.839 1.00 0.00 C ATOM 1233 O ARG B 42 -2.567 1.146 -1.578 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.553 -0.756 0.929 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.611 -2.144 1.566 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.596 -2.260 2.702 1.00 0.00 C ATOM 1237 NE ARG B 42 -1.858 -1.318 3.791 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.160 -1.312 4.932 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -0.153 -2.160 5.112 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.460 -0.457 5.903 1.00 0.00 N ATOM 0 H ARG B 42 -2.146 -1.037 -1.875 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.451 -0.995 -0.020 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.525 -0.525 0.650 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -2.861 -0.007 1.658 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.614 -2.333 1.948 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -2.409 -2.904 0.812 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.611 -3.277 3.095 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.595 -2.085 2.309 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.607 -0.635 3.675 1.00 0.00 H new ATOM 0 HH11 ARG B 42 0.093 -2.823 4.377 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.374 -2.148 5.985 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.229 0.203 5.782 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -0.922 -0.460 6.770 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.489 1.537 -0.475 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.689 2.873 -1.021 1.00 0.00 C ATOM 1256 C LEU B 43 -4.946 3.851 0.118 1.00 0.00 C ATOM 1257 O LEU B 43 -5.570 3.506 1.121 1.00 0.00 O ATOM 1258 CB LEU B 43 -5.864 2.842 -2.001 1.00 0.00 C ATOM 1259 CG LEU B 43 -5.487 2.200 -3.335 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -6.748 1.809 -4.103 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -4.697 3.192 -4.183 1.00 0.00 C ATOM 0 H LEU B 43 -5.195 1.258 0.206 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.799 3.202 -1.558 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -6.692 2.290 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.216 3.859 -2.176 1.00 0.00 H new ATOM 0 HG LEU B 43 -4.884 1.315 -3.133 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -6.469 1.352 -5.052 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.327 1.097 -3.514 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -7.350 2.698 -4.291 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -4.431 2.728 -5.133 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -5.305 4.077 -4.369 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -3.789 3.481 -3.654 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.452 5.077 -0.051 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.466 6.098 0.984 1.00 0.00 C ATOM 1275 C ILE B 44 -4.647 7.466 0.330 1.00 0.00 C ATOM 1276 O ILE B 44 -4.225 7.659 -0.810 1.00 0.00 O ATOM 1277 CB ILE B 44 -3.131 6.033 1.746 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -2.931 4.637 2.359 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.103 7.110 2.828 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.703 4.563 3.267 1.00 0.00 C ATOM 0 H ILE B 44 -4.026 5.388 -0.924 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.287 5.934 1.682 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.313 6.215 1.050 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.818 4.365 2.931 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.831 3.904 1.559 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.156 7.061 3.366 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.208 8.092 2.367 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.925 6.947 3.525 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.610 3.555 3.672 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.810 4.806 2.692 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.812 5.275 4.085 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.266 8.416 1.042 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.482 9.751 0.500 1.00 0.00 C ATOM 1294 C PHE B 45 -5.132 10.868 1.481 1.00 0.00 C ATOM 1295 O PHE B 45 -5.213 12.047 1.141 1.00 0.00 O ATOM 1296 CB PHE B 45 -6.928 9.825 -0.006 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.405 11.186 -0.459 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.704 11.887 -1.449 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.554 11.749 0.113 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -7.150 13.148 -1.865 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -9.004 13.011 -0.304 1.00 0.00 C ATOM 1302 CZ PHE B 45 -8.301 13.711 -1.295 1.00 0.00 C ATOM 0 H PHE B 45 -5.622 8.280 1.988 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.796 9.917 -0.331 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -7.036 9.129 -0.838 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.588 9.477 0.789 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -5.819 11.455 -1.892 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -9.095 11.210 0.877 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.606 13.688 -2.626 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -9.890 13.442 0.138 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.645 14.682 -1.619 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.739 10.491 2.696 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.376 11.412 3.768 1.00 0.00 C ATOM 1314 C ALA B 46 -3.940 10.625 5.007 1.00 0.00 C ATOM 1315 O ALA B 46 -4.040 11.110 6.133 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.577 12.302 4.084 1.00 0.00 C ATOM 0 H ALA B 46 -4.663 9.511 2.968 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.541 12.038 3.455 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -5.316 12.994 4.884 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.857 12.865 3.194 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.416 11.682 4.400 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.460 9.398 4.797 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.248 8.410 5.852 1.00 0.00 C ATOM 1324 C GLY B 47 -4.586 7.774 6.213 1.00 0.00 C ATOM 1325 O GLY B 47 -4.635 6.812 6.976 1.00 0.00 O ATOM 0 H GLY B 47 -3.203 9.058 3.870 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.546 7.646 5.517 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.808 8.884 6.729 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.670 8.321 5.651 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.000 7.744 5.688 1.00 0.00 C ATOM 1331 C LYS B 48 -6.985 6.499 4.811 1.00 0.00 C ATOM 1332 O LYS B 48 -7.486 6.523 3.688 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.029 8.753 5.170 1.00 0.00 C ATOM 1334 CG LYS B 48 -9.420 8.132 5.319 1.00 0.00 C ATOM 1335 CD LYS B 48 -10.305 8.425 4.111 1.00 0.00 C ATOM 1336 CE LYS B 48 -10.513 9.915 3.856 1.00 0.00 C ATOM 1337 NZ LYS B 48 -11.194 10.575 4.987 1.00 0.00 N ATOM 0 H LYS B 48 -5.634 9.205 5.144 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.277 7.484 6.710 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -7.966 9.684 5.733 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -7.831 8.997 4.126 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.325 7.054 5.446 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.896 8.519 6.220 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -9.859 7.972 3.226 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -11.275 7.951 4.258 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.548 10.392 3.684 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.102 10.050 2.949 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -11.393 11.566 4.742 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.087 10.082 5.190 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -10.582 10.542 5.827 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.403 5.416 5.315 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.292 4.192 4.547 1.00 0.00 C ATOM 1353 C GLN B 49 -7.695 3.699 4.188 1.00 0.00 C ATOM 1354 O GLN B 49 -8.461 3.279 5.055 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.446 3.171 5.309 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.271 3.858 6.029 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.129 2.885 6.318 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -3.257 1.677 6.135 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -1.996 3.411 6.772 1.00 0.00 N ATOM 0 H GLN B 49 -6.003 5.366 6.252 1.00 0.00 H new ATOM 0 HA GLN B 49 -5.770 4.364 3.606 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.067 2.648 6.036 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.065 2.420 4.617 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -3.901 4.680 5.416 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -4.623 4.292 6.965 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -1.922 4.418 6.913 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.200 2.807 6.979 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.014 3.763 2.893 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.355 3.558 2.368 1.00 0.00 C ATOM 1370 C LEU B 50 -9.851 2.127 2.594 1.00 0.00 C ATOM 1371 O LEU B 50 -9.057 1.213 2.821 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.345 3.924 0.878 1.00 0.00 C ATOM 1373 CG LEU B 50 -8.763 5.323 0.620 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -8.591 5.568 -0.875 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -9.687 6.400 1.169 1.00 0.00 C ATOM 0 H LEU B 50 -7.326 3.964 2.167 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.054 4.200 2.903 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -8.762 3.184 0.329 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.362 3.880 0.489 1.00 0.00 H new ATOM 0 HG LEU B 50 -7.796 5.369 1.121 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -8.178 6.564 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -7.913 4.823 -1.290 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.559 5.493 -1.370 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -9.256 7.382 0.976 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -10.659 6.328 0.682 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -9.808 6.262 2.243 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.174 1.931 2.530 1.00 0.00 N ATOM 1388 CA GLU B 51 -11.799 0.643 2.785 1.00 0.00 C ATOM 1389 C GLU B 51 -12.560 0.099 1.593 1.00 0.00 C ATOM 1390 O GLU B 51 -13.018 0.821 0.711 1.00 0.00 O ATOM 1391 CB GLU B 51 -12.753 0.749 3.970 1.00 0.00 C ATOM 1392 CG GLU B 51 -11.893 1.023 5.186 1.00 0.00 C ATOM 1393 CD GLU B 51 -12.722 1.115 6.465 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -13.193 2.233 6.776 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -12.878 0.066 7.126 1.00 0.00 O ATOM 0 H GLU B 51 -11.837 2.670 2.298 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.987 -0.051 3.000 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -13.476 1.550 3.817 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.321 -0.173 4.095 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -11.151 0.231 5.291 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.346 1.955 5.041 1.00 0.00 H new ATOM 1402 N ASP B 52 -12.675 -1.223 1.616 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.213 -2.039 0.535 1.00 0.00 C ATOM 1404 C ASP B 52 -14.746 -2.020 0.461 1.00 0.00 C ATOM 1405 O ASP B 52 -15.330 -2.816 -0.273 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.706 -3.474 0.703 1.00 0.00 C ATOM 1407 CG ASP B 52 -13.203 -4.099 2.008 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -12.679 -3.709 3.075 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -14.105 -4.964 1.926 1.00 0.00 O ATOM 0 H ASP B 52 -12.384 -1.778 2.421 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.864 -1.612 -0.405 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -13.039 -4.079 -0.140 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -11.616 -3.479 0.689 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.399 -1.126 1.208 1.00 0.00 N ATOM 1415 CA GLY B 53 -16.857 -1.049 1.267 1.00 0.00 C ATOM 1416 C GLY B 53 -17.347 0.391 1.135 1.00 0.00 C ATOM 1417 O GLY B 53 -18.469 0.703 1.527 1.00 0.00 O ATOM 0 H GLY B 53 -14.928 -0.434 1.790 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -17.287 -1.655 0.470 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.207 -1.468 2.210 1.00 0.00 H new ATOM 1421 N ARG B 54 -16.500 1.266 0.583 1.00 0.00 N ATOM 1422 CA ARG B 54 -16.760 2.687 0.428 1.00 0.00 C ATOM 1423 C ARG B 54 -16.744 3.090 -1.046 1.00 0.00 C ATOM 1424 O ARG B 54 -16.729 2.231 -1.926 1.00 0.00 O ATOM 1425 CB ARG B 54 -15.640 3.401 1.167 1.00 0.00 C ATOM 1426 CG ARG B 54 -15.721 3.184 2.669 1.00 0.00 C ATOM 1427 CD ARG B 54 -16.970 3.881 3.204 1.00 0.00 C ATOM 1428 NE ARG B 54 -16.717 4.520 4.497 1.00 0.00 N ATOM 1429 CZ ARG B 54 -16.704 3.893 5.675 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -16.939 2.586 5.756 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -16.454 4.580 6.785 1.00 0.00 N ATOM 0 H ARG B 54 -15.587 0.988 0.223 1.00 0.00 H new ATOM 0 HA ARG B 54 -17.743 2.946 0.822 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -14.678 3.043 0.800 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -15.686 4.469 0.952 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -15.759 2.118 2.894 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -14.830 3.581 3.156 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -17.305 4.630 2.487 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -17.777 3.155 3.308 1.00 0.00 H new ATOM 0 HE ARG B 54 -16.536 5.524 4.497 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -17.132 2.049 4.910 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -16.926 2.121 6.664 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -16.273 5.583 6.734 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -16.443 4.105 7.687 1.00 0.00 H new ATOM 1445 N THR B 55 -16.745 4.399 -1.310 1.00 0.00 N ATOM 1446 CA THR B 55 -16.721 4.927 -2.673 1.00 0.00 C ATOM 1447 C THR B 55 -15.881 6.188 -2.744 1.00 0.00 C ATOM 1448 O THR B 55 -15.630 6.821 -1.724 1.00 0.00 O ATOM 1449 CB THR B 55 -18.133 5.262 -3.161 1.00 0.00 C ATOM 1450 OG1 THR B 55 -18.767 6.127 -2.244 1.00 0.00 O ATOM 1451 CG2 THR B 55 -18.976 4.005 -3.329 1.00 0.00 C ATOM 0 H THR B 55 -16.762 5.119 -0.587 1.00 0.00 H new ATOM 0 HA THR B 55 -16.289 4.154 -3.309 1.00 0.00 H new ATOM 0 HB THR B 55 -18.042 5.750 -4.132 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.669 6.338 -2.564 1.00 0.00 H new ATOM 0 HG21 THR B 55 -19.972 4.279 -3.676 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.505 3.346 -4.059 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.055 3.489 -2.372 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.440 6.558 -3.950 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.569 7.714 -4.146 1.00 0.00 C ATOM 1461 C LEU B 56 -15.241 8.958 -3.574 1.00 0.00 C ATOM 1462 O LEU B 56 -14.603 9.804 -2.952 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.326 7.929 -5.643 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.412 6.904 -6.325 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -11.972 7.092 -5.865 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -13.822 5.452 -6.083 1.00 0.00 C ATOM 0 H LEU B 56 -15.677 6.066 -4.812 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.620 7.536 -3.640 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.290 7.924 -6.153 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.896 8.921 -5.783 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.508 7.091 -7.395 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -11.334 6.358 -6.357 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.636 8.096 -6.123 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -11.914 6.957 -4.785 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.128 4.787 -6.597 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -13.801 5.241 -5.014 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.830 5.290 -6.465 1.00 0.00 H new ATOM 1478 N SER B 57 -16.551 9.051 -3.799 1.00 0.00 N ATOM 1479 CA SER B 57 -17.389 10.125 -3.288 1.00 0.00 C ATOM 1480 C SER B 57 -17.358 10.196 -1.764 1.00 0.00 C ATOM 1481 O SER B 57 -17.438 11.280 -1.188 1.00 0.00 O ATOM 1482 CB SER B 57 -18.826 9.872 -3.738 1.00 0.00 C ATOM 1483 OG SER B 57 -19.601 11.040 -3.574 1.00 0.00 O ATOM 0 H SER B 57 -17.066 8.366 -4.353 1.00 0.00 H new ATOM 0 HA SER B 57 -17.009 11.070 -3.677 1.00 0.00 H new ATOM 0 HB2 SER B 57 -18.838 9.562 -4.783 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.258 9.056 -3.159 1.00 0.00 H new ATOM 0 HG SER B 57 -20.520 10.867 -3.867 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.239 9.036 -1.111 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.211 8.965 0.347 1.00 0.00 C ATOM 1491 C ASP B 58 -16.006 9.696 0.942 1.00 0.00 C ATOM 1492 O ASP B 58 -16.014 10.029 2.127 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.218 7.508 0.803 1.00 0.00 C ATOM 1494 CG ASP B 58 -17.503 7.405 2.299 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -18.673 7.640 2.679 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -16.559 7.089 3.056 1.00 0.00 O ATOM 0 H ASP B 58 -17.160 8.131 -1.575 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.107 9.467 0.712 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -17.973 6.952 0.246 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.255 7.049 0.580 1.00 0.00 H new ATOM 1501 N TYR B 59 -14.969 9.953 0.137 1.00 0.00 N ATOM 1502 CA TYR B 59 -13.790 10.670 0.594 1.00 0.00 C ATOM 1503 C TYR B 59 -13.694 12.041 -0.078 1.00 0.00 C ATOM 1504 O TYR B 59 -12.666 12.712 0.025 1.00 0.00 O ATOM 1505 CB TYR B 59 -12.535 9.849 0.294 1.00 0.00 C ATOM 1506 CG TYR B 59 -12.749 8.364 0.118 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -12.913 7.522 1.225 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -12.776 7.829 -1.177 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.118 6.151 1.042 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -12.950 6.454 -1.371 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.145 5.617 -0.260 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.357 4.290 -0.454 1.00 0.00 O ATOM 0 H TYR B 59 -14.930 9.669 -0.842 1.00 0.00 H new ATOM 0 HA TYR B 59 -13.872 10.822 1.670 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.075 10.241 -0.613 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -11.822 10.001 1.104 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -12.881 7.933 2.223 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.662 8.481 -2.030 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.255 5.504 1.896 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -12.934 6.039 -2.368 1.00 0.00 H new ATOM 0 HH TYR B 59 -13.807 4.153 -1.314 1.00 0.00 H new ATOM 1522 N ASN B 60 -14.765 12.452 -0.766 1.00 0.00 N ATOM 1523 CA ASN B 60 -14.816 13.659 -1.574 1.00 0.00 C ATOM 1524 C ASN B 60 -13.645 13.725 -2.557 1.00 0.00 C ATOM 1525 O ASN B 60 -13.209 14.805 -2.952 1.00 0.00 O ATOM 1526 CB ASN B 60 -14.911 14.882 -0.664 1.00 0.00 C ATOM 1527 CG ASN B 60 -15.315 16.123 -1.456 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -16.356 16.137 -2.107 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -14.500 17.170 -1.408 1.00 0.00 N ATOM 0 H ASN B 60 -15.643 11.933 -0.771 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.713 13.643 -2.193 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.640 14.697 0.125 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -13.951 15.053 -0.178 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.731 18.020 -1.922 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -13.643 17.124 -0.857 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.136 12.557 -2.953 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.078 12.449 -3.944 1.00 0.00 C ATOM 1538 C ILE B 61 -12.605 12.866 -5.314 1.00 0.00 C ATOM 1539 O ILE B 61 -13.625 12.358 -5.782 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.537 11.014 -3.945 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.472 10.928 -2.845 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -10.938 10.635 -5.301 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -9.956 9.504 -2.645 1.00 0.00 C ATOM 0 H ILE B 61 -13.452 11.658 -2.590 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.256 13.120 -3.697 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.350 10.313 -3.758 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.638 11.582 -3.099 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -10.891 11.295 -1.908 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.566 9.611 -5.261 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.705 10.712 -6.072 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.116 11.311 -5.537 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.204 9.497 -1.856 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -10.784 8.853 -2.364 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.511 9.145 -3.573 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.893 13.799 -5.949 1.00 0.00 N ATOM 1556 CA GLN B 62 -12.151 14.234 -7.310 1.00 0.00 C ATOM 1557 C GLN B 62 -11.195 13.497 -8.245 1.00 0.00 C ATOM 1558 O GLN B 62 -10.555 12.532 -7.831 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.963 15.747 -7.394 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.705 16.441 -6.251 1.00 0.00 C ATOM 1561 CD GLN B 62 -14.188 16.093 -6.206 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -14.871 16.083 -7.227 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.695 15.803 -5.012 1.00 0.00 N ATOM 0 H GLN B 62 -11.105 14.280 -5.516 1.00 0.00 H new ATOM 0 HA GLN B 62 -13.174 14.004 -7.608 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.902 15.991 -7.348 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -12.333 16.113 -8.352 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.243 16.163 -5.304 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -12.594 17.520 -6.355 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -14.097 15.822 -4.186 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.682 15.562 -4.922 1.00 0.00 H new ATOM 1572 N LYS B 63 -11.087 13.934 -9.503 1.00 0.00 N ATOM 1573 CA LYS B 63 -10.222 13.279 -10.477 1.00 0.00 C ATOM 1574 C LYS B 63 -8.740 13.352 -10.085 1.00 0.00 C ATOM 1575 O LYS B 63 -8.245 12.473 -9.390 1.00 0.00 O ATOM 1576 CB LYS B 63 -10.550 13.786 -11.884 1.00 0.00 C ATOM 1577 CG LYS B 63 -10.367 15.291 -12.099 1.00 0.00 C ATOM 1578 CD LYS B 63 -11.222 15.733 -13.280 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.678 15.895 -12.848 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.517 16.391 -13.957 1.00 0.00 N ATOM 0 H LYS B 63 -11.592 14.742 -9.868 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.427 12.208 -10.483 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -9.921 13.255 -12.599 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -11.583 13.526 -12.114 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.655 15.837 -11.201 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -9.318 15.519 -12.288 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.846 16.676 -13.677 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -11.153 14.999 -14.083 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.064 14.938 -12.498 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.735 16.588 -12.009 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.500 16.490 -13.631 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -13.162 17.316 -14.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -13.481 15.717 -14.748 1.00 0.00 H new ATOM 1594 N GLU B 64 -8.010 14.384 -10.507 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.579 14.537 -10.247 1.00 0.00 C ATOM 1596 C GLU B 64 -6.249 14.772 -8.765 1.00 0.00 C ATOM 1597 O GLU B 64 -5.186 15.307 -8.452 1.00 0.00 O ATOM 1598 CB GLU B 64 -6.032 15.664 -11.127 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.734 16.986 -10.825 1.00 0.00 C ATOM 1600 CD GLU B 64 -6.172 18.115 -11.689 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -6.691 18.295 -12.813 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -5.227 18.788 -11.222 1.00 0.00 O ATOM 0 H GLU B 64 -8.405 15.152 -11.050 1.00 0.00 H new ATOM 0 HA GLU B 64 -6.091 13.596 -10.501 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -4.960 15.772 -10.961 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -6.168 15.408 -12.178 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.804 16.883 -11.006 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.611 17.234 -9.771 1.00 0.00 H new ATOM 1609 N SER B 65 -7.142 14.381 -7.846 1.00 0.00 N ATOM 1610 CA SER B 65 -6.935 14.549 -6.413 1.00 0.00 C ATOM 1611 C SER B 65 -5.669 13.854 -5.915 1.00 0.00 C ATOM 1612 O SER B 65 -5.192 14.177 -4.828 1.00 0.00 O ATOM 1613 CB SER B 65 -8.147 14.003 -5.665 1.00 0.00 C ATOM 1614 OG SER B 65 -9.240 14.883 -5.818 1.00 0.00 O ATOM 0 H SER B 65 -8.030 13.938 -8.083 1.00 0.00 H new ATOM 0 HA SER B 65 -6.811 15.615 -6.222 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.407 13.016 -6.047 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.910 13.883 -4.608 1.00 0.00 H new ATOM 0 HG SER B 65 -9.529 15.202 -4.938 1.00 0.00 H new ATOM 1620 N THR B 66 -5.129 12.914 -6.703 1.00 0.00 N ATOM 1621 CA THR B 66 -3.921 12.153 -6.387 1.00 0.00 C ATOM 1622 C THR B 66 -4.097 11.264 -5.152 1.00 0.00 C ATOM 1623 O THR B 66 -4.808 11.600 -4.208 1.00 0.00 O ATOM 1624 CB THR B 66 -2.732 13.111 -6.229 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.603 13.890 -7.400 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.406 12.383 -6.001 1.00 0.00 C ATOM 0 H THR B 66 -5.535 12.658 -7.603 1.00 0.00 H new ATOM 0 HA THR B 66 -3.721 11.477 -7.218 1.00 0.00 H new ATOM 0 HB THR B 66 -2.938 13.725 -5.352 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.846 14.504 -7.302 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.603 13.113 -5.897 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.471 11.784 -5.093 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.197 11.733 -6.851 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.429 10.106 -5.170 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.422 9.142 -4.077 1.00 0.00 C ATOM 1636 C LEU B 67 -2.040 8.498 -4.006 1.00 0.00 C ATOM 1637 O LEU B 67 -1.148 8.847 -4.780 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.493 8.059 -4.279 1.00 0.00 C ATOM 1639 CG LEU B 67 -5.896 8.550 -3.907 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.643 9.069 -5.133 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.701 7.386 -3.329 1.00 0.00 C ATOM 0 H LEU B 67 -2.866 9.811 -5.967 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.649 9.661 -3.146 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.488 7.736 -5.320 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.243 7.187 -3.674 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.787 9.356 -3.181 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.635 9.410 -4.837 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.090 9.899 -5.572 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.738 8.269 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.700 7.731 -3.063 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.777 6.592 -4.072 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.200 7.004 -2.439 1.00 0.00 H new ATOM 1653 N HIS B 68 -1.860 7.555 -3.079 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.600 6.855 -2.914 1.00 0.00 C ATOM 1655 C HIS B 68 -0.848 5.358 -2.927 1.00 0.00 C ATOM 1656 O HIS B 68 -1.976 4.903 -2.735 1.00 0.00 O ATOM 1657 CB HIS B 68 0.032 7.256 -1.582 1.00 0.00 C ATOM 1658 CG HIS B 68 0.463 8.697 -1.536 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.277 9.750 -0.996 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.644 9.172 -2.027 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.483 10.842 -1.175 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.641 10.527 -1.787 1.00 0.00 N ATOM 0 H HIS B 68 -2.587 7.261 -2.426 1.00 0.00 H new ATOM 0 HA HIS B 68 0.073 7.118 -3.730 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.682 7.072 -0.779 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.896 6.620 -1.392 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.424 8.600 -2.507 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.204 11.839 -0.869 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.386 11.180 -2.030 1.00 0.00 H new ATOM 1670 N LEU B 69 0.222 4.598 -3.150 1.00 0.00 N ATOM 1671 CA LEU B 69 0.158 3.150 -3.152 1.00 0.00 C ATOM 1672 C LEU B 69 1.236 2.616 -2.218 1.00 0.00 C ATOM 1673 O LEU B 69 2.333 3.164 -2.157 1.00 0.00 O ATOM 1674 CB LEU B 69 0.347 2.657 -4.591 1.00 0.00 C ATOM 1675 CG LEU B 69 -0.359 1.326 -4.850 1.00 0.00 C ATOM 1676 CD1 LEU B 69 -1.873 1.514 -4.788 1.00 0.00 C ATOM 1677 CD2 LEU B 69 0.010 0.835 -6.246 1.00 0.00 C ATOM 0 H LEU B 69 1.152 4.974 -3.333 1.00 0.00 H new ATOM 0 HA LEU B 69 -0.807 2.790 -2.795 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.035 3.408 -5.282 1.00 0.00 H new ATOM 0 HB3 LEU B 69 1.412 2.546 -4.797 1.00 0.00 H new ATOM 0 HG LEU B 69 -0.050 0.605 -4.093 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -2.366 0.560 -4.974 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -2.154 1.881 -3.801 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -2.181 2.235 -5.545 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -0.488 -0.114 -6.441 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.307 1.570 -6.986 1.00 0.00 H new ATOM 0 HD23 LEU B 69 1.089 0.698 -6.310 1.00 0.00 H new ATOM 1689 N VAL B 70 0.914 1.543 -1.497 1.00 0.00 N ATOM 1690 CA VAL B 70 1.796 0.980 -0.485 1.00 0.00 C ATOM 1691 C VAL B 70 1.508 -0.514 -0.358 1.00 0.00 C ATOM 1692 O VAL B 70 0.903 -0.976 0.606 1.00 0.00 O ATOM 1693 CB VAL B 70 1.670 1.790 0.817 1.00 0.00 C ATOM 1694 CG1 VAL B 70 0.225 1.940 1.300 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.544 1.206 1.928 1.00 0.00 C ATOM 0 H VAL B 70 0.032 1.041 -1.601 1.00 0.00 H new ATOM 0 HA VAL B 70 2.846 1.058 -0.766 1.00 0.00 H new ATOM 0 HB VAL B 70 2.029 2.791 0.575 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.208 2.521 2.222 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.362 2.452 0.537 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.201 0.954 1.485 1.00 0.00 H new ATOM 0 HG21 VAL B 70 2.430 1.803 2.833 1.00 0.00 H new ATOM 0 HG22 VAL B 70 2.238 0.179 2.130 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.588 1.218 1.614 1.00 0.00 H new ATOM 1705 N LEU B 71 1.956 -1.270 -1.365 1.00 0.00 N ATOM 1706 CA LEU B 71 1.691 -2.694 -1.506 1.00 0.00 C ATOM 1707 C LEU B 71 2.137 -3.502 -0.284 1.00 0.00 C ATOM 1708 O LEU B 71 2.998 -3.068 0.481 1.00 0.00 O ATOM 1709 CB LEU B 71 2.412 -3.215 -2.753 1.00 0.00 C ATOM 1710 CG LEU B 71 2.111 -2.401 -4.020 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.759 -3.087 -5.222 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.608 -2.295 -4.246 1.00 0.00 C ATOM 0 H LEU B 71 2.527 -0.893 -2.121 1.00 0.00 H new ATOM 0 HA LEU B 71 0.612 -2.821 -1.598 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.487 -3.206 -2.572 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.126 -4.253 -2.921 1.00 0.00 H new ATOM 0 HG LEU B 71 2.516 -1.396 -3.899 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.549 -2.514 -6.125 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.837 -3.144 -5.071 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.354 -4.093 -5.329 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.416 -1.715 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU B 71 0.186 -3.293 -4.360 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.146 -1.801 -3.392 1.00 0.00 H new ATOM 1724 N ARG B 72 1.545 -4.691 -0.107 1.00 0.00 N ATOM 1725 CA ARG B 72 1.915 -5.605 0.965 1.00 0.00 C ATOM 1726 C ARG B 72 3.240 -6.311 0.669 1.00 0.00 C ATOM 1727 O ARG B 72 3.724 -7.058 1.515 1.00 0.00 O ATOM 1728 CB ARG B 72 0.795 -6.616 1.202 1.00 0.00 C ATOM 1729 CG ARG B 72 -0.410 -5.907 1.826 1.00 0.00 C ATOM 1730 CD ARG B 72 -1.257 -6.892 2.629 1.00 0.00 C ATOM 1731 NE ARG B 72 -1.687 -8.032 1.815 1.00 0.00 N ATOM 1732 CZ ARG B 72 -2.417 -9.046 2.286 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -2.768 -9.096 3.569 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -2.801 -10.023 1.470 1.00 0.00 N ATOM 0 H ARG B 72 0.797 -5.040 -0.707 1.00 0.00 H new ATOM 0 HA ARG B 72 2.058 -5.022 1.875 1.00 0.00 H new ATOM 0 HB2 ARG B 72 0.508 -7.084 0.260 1.00 0.00 H new ATOM 0 HB3 ARG B 72 1.143 -7.412 1.860 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.068 -5.100 2.474 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.016 -5.452 1.043 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -0.684 -7.252 3.483 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.133 -6.378 3.026 1.00 0.00 H new ATOM 0 HE ARG B 72 -1.413 -8.052 0.833 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -2.479 -8.354 4.206 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -3.326 -9.877 3.915 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -2.538 -9.998 0.485 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -3.359 -10.798 1.829 1.00 0.00 H new ATOM 1748 N LEU B 73 3.804 -6.063 -0.519 1.00 0.00 N ATOM 1749 CA LEU B 73 5.063 -6.606 -1.026 1.00 0.00 C ATOM 1750 C LEU B 73 5.219 -8.118 -0.862 1.00 0.00 C ATOM 1751 O LEU B 73 5.081 -8.865 -1.831 1.00 0.00 O ATOM 1752 CB LEU B 73 6.211 -5.871 -0.334 1.00 0.00 C ATOM 1753 CG LEU B 73 7.574 -6.114 -0.988 1.00 0.00 C ATOM 1754 CD1 LEU B 73 7.607 -5.602 -2.427 1.00 0.00 C ATOM 1755 CD2 LEU B 73 8.638 -5.372 -0.185 1.00 0.00 C ATOM 0 H LEU B 73 3.362 -5.437 -1.193 1.00 0.00 H new ATOM 0 HA LEU B 73 5.073 -6.443 -2.104 1.00 0.00 H new ATOM 0 HB2 LEU B 73 6.001 -4.801 -0.337 1.00 0.00 H new ATOM 0 HB3 LEU B 73 6.256 -6.184 0.709 1.00 0.00 H new ATOM 0 HG LEU B 73 7.761 -7.188 -1.001 1.00 0.00 H new ATOM 0 HD11 LEU B 73 8.590 -5.792 -2.858 1.00 0.00 H new ATOM 0 HD12 LEU B 73 6.847 -6.118 -3.014 1.00 0.00 H new ATOM 0 HD13 LEU B 73 7.407 -4.530 -2.437 1.00 0.00 H new ATOM 0 HD21 LEU B 73 9.616 -5.535 -0.638 1.00 0.00 H new ATOM 0 HD22 LEU B 73 8.413 -4.305 -0.181 1.00 0.00 H new ATOM 0 HD23 LEU B 73 8.646 -5.745 0.839 1.00 0.00 H new