USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 672 GLN : amide:sc= 0.606 K(o=1.2,f=-5.6!) USER MOD Set 1.2: A 679 THR OG1 : rot -175:sc= 0.586 USER MOD Set 2.1: A 602 THR OG1 : rot 140:sc= 0 USER MOD Set 2.2: A 651 HIS : no HD1:sc= -5.79! C(o=-6.1!,f=-5.7!) USER MOD Set 2.3: A 652 SER OG : rot 180:sc= -0.317 USER MOD Single : A 573 LYS NZ :NH3+ 170:sc= -0.0132 (180deg=-0.177) USER MOD Single : A 577 HIS : no HD1:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 583 LYS NZ :NH3+ -170:sc=-0.00105 (180deg=-0.0878) USER MOD Single : A 584 LYS NZ :NH3+ -120:sc= 0.272 (180deg=0) USER MOD Single : A 586 GLN : amide:sc= -1.91 K(o=-1.9,f=-0.028) USER MOD Single : A 587 TYR OH : rot 90:sc= 0.191 USER MOD Single : A 588 LYS NZ :NH3+ -167:sc= -0.0451 (180deg=-0.246) USER MOD Single : A 594 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0175) USER MOD Single : A 596 SER OG : rot 180:sc= -0.0464 USER MOD Single : A 598 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 607 ASN : amide:sc= -0.408 X(o=-0.41,f=0) USER MOD Single : A 608 SER OG : rot 31:sc= 0.335 USER MOD Single : A 610 GLN : amide:sc= -6.68! K(o=-6.7!,f=-1.3) USER MOD Single : A 612 TYR OH : rot 180:sc= 0 USER MOD Single : A 613 HIS : no HD1:sc= -0.0268 X(o=-0.027,f=-0.033) USER MOD Single : A 617 SER OG : rot 160:sc= -2.17! USER MOD Single : A 624 LYS NZ :NH3+ -131:sc= 0.419 (180deg=-0.00332) USER MOD Single : A 626 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 628 GLN : amide:sc= -0.615 K(o=-0.62,f=-2.3!) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.044) USER MOD Single : A 640 ASN : amide:sc= -2.19 K(o=-2.2,f=-1.2) USER MOD Single : A 642 LYS NZ :NH3+ 180:sc= 2.27 (180deg=2.27) USER MOD Single : A 644 LYS NZ :NH3+ 161:sc= 0.622 (180deg=0.28) USER MOD Single : A 645 THR OG1 : rot 43:sc= 0.0843 USER MOD Single : A 646 LYS NZ :NH3+ 177:sc= 1.28 (180deg=1.15) USER MOD Single : A 649 TYR OH : rot -72:sc= 0.661 USER MOD Single : A 657 TYR OH : rot 7:sc= 0.796 USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= -0.0425 X(o=-0.043,f=-0.41) USER MOD Single : A 665 MET CE :methyl -112:sc= -0.725 (180deg=-4.67!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN : amide:sc= -0.763 K(o=-0.76,f=-5.5!) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N GLU A 568 25.019 -11.145 -2.126 1.00 0.00 N ATOM 85 CA GLU A 568 24.100 -10.648 -1.143 1.00 0.00 C ATOM 86 C GLU A 568 23.930 -9.111 -1.242 1.00 0.00 C ATOM 87 O GLU A 568 24.579 -8.451 -2.081 1.00 0.00 O ATOM 88 CB GLU A 568 24.506 -11.170 0.243 1.00 0.00 C ATOM 89 CG GLU A 568 23.376 -11.206 1.245 1.00 0.00 C ATOM 90 CD GLU A 568 23.686 -12.052 2.447 1.00 0.00 C ATOM 91 OE1 GLU A 568 24.375 -11.577 3.350 1.00 0.00 O ATOM 92 OE2 GLU A 568 23.217 -13.214 2.509 1.00 0.00 O ATOM 0 HA GLU A 568 23.099 -11.033 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 568 24.914 -12.175 0.135 1.00 0.00 H new ATOM 0 HB3 GLU A 568 25.306 -10.542 0.636 1.00 0.00 H new ATOM 0 HG2 GLU A 568 23.153 -10.190 1.570 1.00 0.00 H new ATOM 0 HG3 GLU A 568 22.479 -11.589 0.759 1.00 0.00 H new ATOM 99 N CYS A 569 23.074 -8.545 -0.418 1.00 0.00 N ATOM 100 CA CYS A 569 22.653 -7.186 -0.595 1.00 0.00 C ATOM 101 C CYS A 569 23.143 -6.228 0.463 1.00 0.00 C ATOM 102 O CYS A 569 23.410 -6.603 1.599 1.00 0.00 O ATOM 103 CB CYS A 569 21.150 -7.169 -0.540 1.00 0.00 C ATOM 104 SG CYS A 569 20.341 -8.291 -1.696 1.00 0.00 S ATOM 0 H CYS A 569 22.657 -9.016 0.385 1.00 0.00 H new ATOM 0 HA CYS A 569 23.073 -6.853 -1.544 1.00 0.00 H new ATOM 0 HB2 CYS A 569 20.834 -7.422 0.472 1.00 0.00 H new ATOM 0 HB3 CYS A 569 20.804 -6.154 -0.737 1.00 0.00 H new ATOM 109 N GLU A 570 23.248 -4.994 0.057 1.00 0.00 N ATOM 110 CA GLU A 570 23.425 -3.862 0.921 1.00 0.00 C ATOM 111 C GLU A 570 22.360 -2.880 0.507 1.00 0.00 C ATOM 112 O GLU A 570 21.974 -2.890 -0.656 1.00 0.00 O ATOM 113 CB GLU A 570 24.794 -3.210 0.750 1.00 0.00 C ATOM 114 CG GLU A 570 25.967 -4.079 1.130 1.00 0.00 C ATOM 115 CD GLU A 570 27.265 -3.357 0.950 1.00 0.00 C ATOM 116 OE1 GLU A 570 27.781 -3.332 -0.182 1.00 0.00 O ATOM 117 OE2 GLU A 570 27.787 -2.779 1.922 1.00 0.00 O ATOM 0 H GLU A 570 23.211 -4.739 -0.930 1.00 0.00 H new ATOM 0 HA GLU A 570 23.354 -4.168 1.965 1.00 0.00 H new ATOM 0 HB2 GLU A 570 24.908 -2.907 -0.291 1.00 0.00 H new ATOM 0 HB3 GLU A 570 24.825 -2.301 1.351 1.00 0.00 H new ATOM 0 HG2 GLU A 570 25.866 -4.395 2.168 1.00 0.00 H new ATOM 0 HG3 GLU A 570 25.964 -4.983 0.520 1.00 0.00 H new ATOM 124 N LEU A 571 21.840 -2.119 1.448 1.00 0.00 N ATOM 125 CA LEU A 571 20.834 -1.088 1.198 1.00 0.00 C ATOM 126 C LEU A 571 21.361 -0.148 0.100 1.00 0.00 C ATOM 127 O LEU A 571 22.402 0.510 0.282 1.00 0.00 O ATOM 128 CB LEU A 571 20.592 -0.291 2.511 1.00 0.00 C ATOM 129 CG LEU A 571 19.191 0.348 2.749 1.00 0.00 C ATOM 130 CD1 LEU A 571 19.160 1.061 4.085 1.00 0.00 C ATOM 131 CD2 LEU A 571 18.773 1.303 1.644 1.00 0.00 C ATOM 0 H LEU A 571 22.105 -2.196 2.430 1.00 0.00 H new ATOM 0 HA LEU A 571 19.895 -1.537 0.874 1.00 0.00 H new ATOM 0 HB2 LEU A 571 20.797 -0.960 3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 571 21.332 0.508 2.554 1.00 0.00 H new ATOM 0 HG LEU A 571 18.473 -0.472 2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 571 18.176 1.503 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 571 19.366 0.348 4.883 1.00 0.00 H new ATOM 0 HD13 LEU A 571 19.916 1.846 4.096 1.00 0.00 H new ATOM 0 HD21 LEU A 571 17.789 1.713 1.871 1.00 0.00 H new ATOM 0 HD22 LEU A 571 19.497 2.115 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 571 18.733 0.767 0.696 1.00 0.00 H new ATOM 143 N PRO A 572 20.691 -0.123 -1.069 1.00 0.00 N ATOM 144 CA PRO A 572 21.095 0.723 -2.186 1.00 0.00 C ATOM 145 C PRO A 572 20.777 2.192 -1.921 1.00 0.00 C ATOM 146 O PRO A 572 20.404 2.579 -0.804 1.00 0.00 O ATOM 147 CB PRO A 572 20.252 0.192 -3.349 1.00 0.00 C ATOM 148 CG PRO A 572 19.036 -0.359 -2.703 1.00 0.00 C ATOM 149 CD PRO A 572 19.501 -0.942 -1.405 1.00 0.00 C ATOM 0 HA PRO A 572 22.168 0.686 -2.373 1.00 0.00 H new ATOM 0 HB2 PRO A 572 20.003 0.985 -4.053 1.00 0.00 H new ATOM 0 HB3 PRO A 572 20.787 -0.575 -3.909 1.00 0.00 H new ATOM 0 HG2 PRO A 572 18.292 0.420 -2.539 1.00 0.00 H new ATOM 0 HG3 PRO A 572 18.569 -1.119 -3.330 1.00 0.00 H new ATOM 0 HD2 PRO A 572 18.733 -0.871 -0.634 1.00 0.00 H new ATOM 0 HD3 PRO A 572 19.755 -1.997 -1.506 1.00 0.00 H new ATOM 157 N LYS A 573 20.890 3.003 -2.922 1.00 0.00 N ATOM 158 CA LYS A 573 20.626 4.392 -2.758 1.00 0.00 C ATOM 159 C LYS A 573 19.167 4.631 -3.003 1.00 0.00 C ATOM 160 O LYS A 573 18.723 4.749 -4.140 1.00 0.00 O ATOM 161 CB LYS A 573 21.494 5.233 -3.692 1.00 0.00 C ATOM 162 CG LYS A 573 22.984 4.983 -3.523 1.00 0.00 C ATOM 163 CD LYS A 573 23.471 5.351 -2.127 1.00 0.00 C ATOM 164 CE LYS A 573 24.937 4.992 -1.944 1.00 0.00 C ATOM 165 NZ LYS A 573 25.807 5.663 -2.935 1.00 0.00 N ATOM 0 H LYS A 573 21.164 2.725 -3.864 1.00 0.00 H new ATOM 0 HA LYS A 573 20.877 4.695 -1.742 1.00 0.00 H new ATOM 0 HB2 LYS A 573 21.213 5.023 -4.724 1.00 0.00 H new ATOM 0 HB3 LYS A 573 21.288 6.289 -3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 573 23.199 3.932 -3.716 1.00 0.00 H new ATOM 0 HG3 LYS A 573 23.535 5.563 -4.263 1.00 0.00 H new ATOM 0 HD2 LYS A 573 23.332 6.419 -1.960 1.00 0.00 H new ATOM 0 HD3 LYS A 573 22.871 4.831 -1.381 1.00 0.00 H new ATOM 0 HE2 LYS A 573 25.254 5.269 -0.939 1.00 0.00 H new ATOM 0 HE3 LYS A 573 25.058 3.912 -2.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 573 26.804 5.526 -2.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 573 25.639 5.255 -3.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 573 25.590 6.680 -2.955 1.00 0.00 H new ATOM 179 N ILE A 574 18.411 4.590 -1.939 1.00 0.00 N ATOM 180 CA ILE A 574 16.989 4.836 -1.997 1.00 0.00 C ATOM 181 C ILE A 574 16.734 6.321 -2.095 1.00 0.00 C ATOM 182 O ILE A 574 17.665 7.118 -2.260 1.00 0.00 O ATOM 183 CB ILE A 574 16.262 4.306 -0.738 1.00 0.00 C ATOM 184 CG1 ILE A 574 16.888 4.913 0.534 1.00 0.00 C ATOM 185 CG2 ILE A 574 16.303 2.779 -0.699 1.00 0.00 C ATOM 186 CD1 ILE A 574 16.127 4.626 1.801 1.00 0.00 C ATOM 0 H ILE A 574 18.762 4.385 -1.003 1.00 0.00 H new ATOM 0 HA ILE A 574 16.605 4.313 -2.873 1.00 0.00 H new ATOM 0 HB ILE A 574 15.216 4.611 -0.781 1.00 0.00 H new ATOM 0 HG12 ILE A 574 17.904 4.533 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 574 16.964 5.993 0.407 1.00 0.00 H new ATOM 0 HG21 ILE A 574 15.787 2.424 0.193 1.00 0.00 H new ATOM 0 HG22 ILE A 574 15.812 2.379 -1.586 1.00 0.00 H new ATOM 0 HG23 ILE A 574 17.340 2.443 -0.676 1.00 0.00 H new ATOM 0 HD11 ILE A 574 16.637 5.090 2.645 1.00 0.00 H new ATOM 0 HD12 ILE A 574 15.118 5.031 1.719 1.00 0.00 H new ATOM 0 HD13 ILE A 574 16.073 3.549 1.957 1.00 0.00 H new ATOM 193 N ASP A 575 15.503 6.700 -1.972 1.00 0.00 N ATOM 194 CA ASP A 575 15.172 8.093 -1.985 1.00 0.00 C ATOM 195 C ASP A 575 15.515 8.670 -0.634 1.00 0.00 C ATOM 196 O ASP A 575 15.444 7.974 0.387 1.00 0.00 O ATOM 197 CB ASP A 575 13.692 8.321 -2.248 1.00 0.00 C ATOM 198 CG ASP A 575 13.391 9.769 -2.567 1.00 0.00 C ATOM 199 OD1 ASP A 575 13.141 10.553 -1.642 1.00 0.00 O ATOM 200 OD2 ASP A 575 13.440 10.156 -3.759 1.00 0.00 O ATOM 0 H ASP A 575 14.710 6.068 -1.861 1.00 0.00 H new ATOM 0 HA ASP A 575 15.735 8.574 -2.785 1.00 0.00 H new ATOM 0 HB2 ASP A 575 13.370 7.692 -3.078 1.00 0.00 H new ATOM 0 HB3 ASP A 575 13.117 8.015 -1.374 1.00 0.00 H new ATOM 205 N VAL A 576 15.908 9.898 -0.628 1.00 0.00 N ATOM 206 CA VAL A 576 16.212 10.636 0.587 1.00 0.00 C ATOM 207 C VAL A 576 14.997 10.655 1.544 1.00 0.00 C ATOM 208 O VAL A 576 15.141 10.621 2.758 1.00 0.00 O ATOM 209 CB VAL A 576 16.659 12.084 0.236 1.00 0.00 C ATOM 210 CG1 VAL A 576 15.595 12.788 -0.596 1.00 0.00 C ATOM 211 CG2 VAL A 576 16.996 12.892 1.484 1.00 0.00 C ATOM 0 H VAL A 576 16.035 10.445 -1.480 1.00 0.00 H new ATOM 0 HA VAL A 576 17.031 10.132 1.100 1.00 0.00 H new ATOM 0 HB VAL A 576 17.570 12.011 -0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 576 15.927 13.799 -0.831 1.00 0.00 H new ATOM 0 HG12 VAL A 576 15.432 12.235 -1.521 1.00 0.00 H new ATOM 0 HG13 VAL A 576 14.663 12.834 -0.032 1.00 0.00 H new ATOM 0 HG21 VAL A 576 17.303 13.897 1.195 1.00 0.00 H new ATOM 0 HG22 VAL A 576 16.118 12.952 2.127 1.00 0.00 H new ATOM 0 HG23 VAL A 576 17.808 12.405 2.024 1.00 0.00 H new ATOM 215 N HIS A 577 13.813 10.649 0.982 1.00 0.00 N ATOM 216 CA HIS A 577 12.610 10.690 1.757 1.00 0.00 C ATOM 217 C HIS A 577 12.024 9.308 1.924 1.00 0.00 C ATOM 218 O HIS A 577 10.894 9.181 2.343 1.00 0.00 O ATOM 219 CB HIS A 577 11.573 11.633 1.120 1.00 0.00 C ATOM 220 CG HIS A 577 11.944 13.090 1.186 1.00 0.00 C ATOM 221 ND1 HIS A 577 12.155 13.867 0.074 1.00 0.00 N ATOM 222 CD2 HIS A 577 12.101 13.918 2.249 1.00 0.00 C ATOM 223 CE1 HIS A 577 12.423 15.100 0.442 1.00 0.00 C ATOM 224 NE2 HIS A 577 12.396 15.158 1.754 1.00 0.00 N ATOM 0 H HIS A 577 13.663 10.615 -0.026 1.00 0.00 H new ATOM 0 HA HIS A 577 12.868 11.077 2.743 1.00 0.00 H new ATOM 0 HB2 HIS A 577 11.435 11.351 0.076 1.00 0.00 H new ATOM 0 HB3 HIS A 577 10.614 11.491 1.618 1.00 0.00 H new ATOM 0 HD2 HIS A 577 12.010 13.648 3.291 1.00 0.00 H new ATOM 0 HE1 HIS A 577 12.630 15.926 -0.222 1.00 0.00 H new ATOM 0 HE2 HIS A 577 12.567 15.993 2.313 1.00 0.00 H new ATOM 233 N LEU A 578 12.796 8.288 1.630 1.00 0.00 N ATOM 234 CA LEU A 578 12.326 6.924 1.738 1.00 0.00 C ATOM 235 C LEU A 578 12.924 6.301 2.978 1.00 0.00 C ATOM 236 O LEU A 578 14.021 6.685 3.400 1.00 0.00 O ATOM 237 CB LEU A 578 12.790 6.114 0.559 1.00 0.00 C ATOM 238 CG LEU A 578 11.950 4.891 0.252 1.00 0.00 C ATOM 239 CD1 LEU A 578 10.746 5.238 -0.579 1.00 0.00 C ATOM 240 CD2 LEU A 578 12.758 3.871 -0.408 1.00 0.00 C ATOM 0 H LEU A 578 13.761 8.377 1.311 1.00 0.00 H new ATOM 0 HA LEU A 578 11.237 6.933 1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 578 12.804 6.757 -0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 578 13.817 5.795 0.738 1.00 0.00 H new ATOM 0 HG LEU A 578 11.587 4.491 1.199 1.00 0.00 H new ATOM 0 HD11 LEU A 578 10.169 4.335 -0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 578 10.125 5.954 -0.039 1.00 0.00 H new ATOM 0 HD13 LEU A 578 11.070 5.677 -1.523 1.00 0.00 H new ATOM 0 HD21 LEU A 578 12.140 2.999 -0.622 1.00 0.00 H new ATOM 0 HD22 LEU A 578 13.157 4.270 -1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 578 13.582 3.581 0.244 1.00 0.00 H new ATOM 252 N VAL A 579 12.225 5.370 3.573 1.00 0.00 N ATOM 253 CA VAL A 579 12.709 4.656 4.737 1.00 0.00 C ATOM 254 C VAL A 579 12.334 3.186 4.596 1.00 0.00 C ATOM 255 O VAL A 579 11.169 2.849 4.405 1.00 0.00 O ATOM 256 CB VAL A 579 12.091 5.164 6.076 1.00 0.00 C ATOM 257 CG1 VAL A 579 12.799 4.559 7.285 1.00 0.00 C ATOM 258 CG2 VAL A 579 12.032 6.678 6.166 1.00 0.00 C ATOM 0 H VAL A 579 11.297 5.080 3.265 1.00 0.00 H new ATOM 0 HA VAL A 579 13.786 4.817 4.778 1.00 0.00 H new ATOM 0 HB VAL A 579 11.058 4.818 6.085 1.00 0.00 H new ATOM 0 HG11 VAL A 579 12.342 4.935 8.200 1.00 0.00 H new ATOM 0 HG12 VAL A 579 12.708 3.473 7.254 1.00 0.00 H new ATOM 0 HG13 VAL A 579 13.853 4.836 7.265 1.00 0.00 H new ATOM 0 HG21 VAL A 579 11.592 6.969 7.120 1.00 0.00 H new ATOM 0 HG22 VAL A 579 13.040 7.086 6.091 1.00 0.00 H new ATOM 0 HG23 VAL A 579 11.421 7.067 5.351 1.00 0.00 H new ATOM 262 N PRO A 580 13.312 2.315 4.632 1.00 0.00 N ATOM 263 CA PRO A 580 13.089 0.884 4.629 1.00 0.00 C ATOM 264 C PRO A 580 12.677 0.367 6.023 1.00 0.00 C ATOM 265 O PRO A 580 13.137 0.881 7.047 1.00 0.00 O ATOM 266 CB PRO A 580 14.446 0.317 4.226 1.00 0.00 C ATOM 267 CG PRO A 580 15.441 1.354 4.630 1.00 0.00 C ATOM 268 CD PRO A 580 14.719 2.672 4.657 1.00 0.00 C ATOM 0 HA PRO A 580 12.279 0.591 3.961 1.00 0.00 H new ATOM 0 HB2 PRO A 580 14.641 -0.631 4.727 1.00 0.00 H new ATOM 0 HB3 PRO A 580 14.490 0.126 3.154 1.00 0.00 H new ATOM 0 HG2 PRO A 580 15.861 1.124 5.609 1.00 0.00 H new ATOM 0 HG3 PRO A 580 16.273 1.385 3.926 1.00 0.00 H new ATOM 0 HD2 PRO A 580 14.968 3.243 5.552 1.00 0.00 H new ATOM 0 HD3 PRO A 580 14.987 3.289 3.800 1.00 0.00 H new ATOM 276 N ASP A 581 11.803 -0.626 6.027 1.00 0.00 N ATOM 277 CA ASP A 581 11.271 -1.303 7.225 1.00 0.00 C ATOM 278 C ASP A 581 12.387 -1.768 8.131 1.00 0.00 C ATOM 279 O ASP A 581 12.403 -1.453 9.324 1.00 0.00 O ATOM 280 CB ASP A 581 10.408 -2.509 6.801 1.00 0.00 C ATOM 281 CG ASP A 581 9.907 -3.354 7.961 1.00 0.00 C ATOM 282 OD1 ASP A 581 10.655 -4.207 8.450 1.00 0.00 O ATOM 283 OD2 ASP A 581 8.737 -3.216 8.373 1.00 0.00 O ATOM 0 H ASP A 581 11.420 -1.008 5.162 1.00 0.00 H new ATOM 0 HA ASP A 581 10.660 -0.589 7.777 1.00 0.00 H new ATOM 0 HB2 ASP A 581 9.551 -2.147 6.233 1.00 0.00 H new ATOM 0 HB3 ASP A 581 10.991 -3.141 6.131 1.00 0.00 H new ATOM 288 N ARG A 582 13.317 -2.524 7.575 1.00 0.00 N ATOM 289 CA ARG A 582 14.461 -2.967 8.334 1.00 0.00 C ATOM 290 C ARG A 582 15.387 -1.805 8.622 1.00 0.00 C ATOM 291 O ARG A 582 15.625 -1.458 9.771 1.00 0.00 O ATOM 292 CB ARG A 582 15.225 -4.038 7.564 1.00 0.00 C ATOM 293 CG ARG A 582 14.850 -5.470 7.873 1.00 0.00 C ATOM 294 CD ARG A 582 13.422 -5.808 7.602 1.00 0.00 C ATOM 295 NE ARG A 582 13.148 -7.191 8.004 1.00 0.00 N ATOM 296 CZ ARG A 582 12.057 -7.598 8.673 1.00 0.00 C ATOM 297 NH1 ARG A 582 11.043 -6.771 8.871 1.00 0.00 N ATOM 298 NH2 ARG A 582 11.985 -8.837 9.139 1.00 0.00 N ATOM 0 H ARG A 582 13.299 -2.840 6.605 1.00 0.00 H new ATOM 0 HA ARG A 582 14.103 -3.384 9.275 1.00 0.00 H new ATOM 0 HB2 ARG A 582 15.077 -3.866 6.498 1.00 0.00 H new ATOM 0 HB3 ARG A 582 16.289 -3.911 7.763 1.00 0.00 H new ATOM 0 HG2 ARG A 582 15.485 -6.133 7.286 1.00 0.00 H new ATOM 0 HG3 ARG A 582 15.065 -5.670 8.923 1.00 0.00 H new ATOM 0 HD2 ARG A 582 12.769 -5.126 8.147 1.00 0.00 H new ATOM 0 HD3 ARG A 582 13.204 -5.679 6.542 1.00 0.00 H new ATOM 0 HE ARG A 582 13.839 -7.899 7.756 1.00 0.00 H new ATOM 0 HH11 ARG A 582 11.086 -5.816 8.514 1.00 0.00 H new ATOM 0 HH12 ARG A 582 10.218 -7.088 9.380 1.00 0.00 H new ATOM 0 HH21 ARG A 582 12.759 -9.484 8.990 1.00 0.00 H new ATOM 0 HH22 ARG A 582 11.155 -9.143 9.647 1.00 0.00 H new ATOM 312 N LYS A 583 15.860 -1.206 7.548 1.00 0.00 N ATOM 313 CA LYS A 583 16.846 -0.151 7.565 1.00 0.00 C ATOM 314 C LYS A 583 18.117 -0.668 8.210 1.00 0.00 C ATOM 315 O LYS A 583 18.528 -0.255 9.307 1.00 0.00 O ATOM 316 CB LYS A 583 16.365 1.164 8.197 1.00 0.00 C ATOM 317 CG LYS A 583 17.243 2.322 7.822 1.00 0.00 C ATOM 318 CD LYS A 583 16.828 3.589 8.502 1.00 0.00 C ATOM 319 CE LYS A 583 17.531 4.767 7.878 1.00 0.00 C ATOM 320 NZ LYS A 583 19.017 4.653 7.900 1.00 0.00 N ATOM 0 H LYS A 583 15.555 -1.452 6.606 1.00 0.00 H new ATOM 0 HA LYS A 583 17.044 0.120 6.528 1.00 0.00 H new ATOM 0 HB2 LYS A 583 15.342 1.366 7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 583 16.346 1.059 9.282 1.00 0.00 H new ATOM 0 HG2 LYS A 583 18.276 2.092 8.084 1.00 0.00 H new ATOM 0 HG3 LYS A 583 17.212 2.464 6.742 1.00 0.00 H new ATOM 0 HD2 LYS A 583 15.748 3.716 8.423 1.00 0.00 H new ATOM 0 HD3 LYS A 583 17.065 3.535 9.564 1.00 0.00 H new ATOM 0 HE2 LYS A 583 17.198 4.873 6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 583 17.236 5.676 8.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 19.439 5.560 7.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 19.332 4.412 8.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 19.318 3.908 7.240 1.00 0.00 H new ATOM 334 N LYS A 584 18.660 -1.643 7.569 1.00 0.00 N ATOM 335 CA LYS A 584 19.881 -2.250 7.977 1.00 0.00 C ATOM 336 C LYS A 584 20.848 -2.026 6.846 1.00 0.00 C ATOM 337 O LYS A 584 20.414 -1.740 5.729 1.00 0.00 O ATOM 338 CB LYS A 584 19.694 -3.762 8.267 1.00 0.00 C ATOM 339 CG LYS A 584 19.244 -4.572 7.065 1.00 0.00 C ATOM 340 CD LYS A 584 19.246 -6.070 7.324 1.00 0.00 C ATOM 341 CE LYS A 584 18.030 -6.509 8.081 1.00 0.00 C ATOM 342 NZ LYS A 584 18.114 -7.917 8.516 1.00 0.00 N ATOM 0 H LYS A 584 18.258 -2.052 6.725 1.00 0.00 H new ATOM 0 HA LYS A 584 20.248 -1.814 8.906 1.00 0.00 H new ATOM 0 HB2 LYS A 584 20.636 -4.170 8.635 1.00 0.00 H new ATOM 0 HB3 LYS A 584 18.962 -3.880 9.066 1.00 0.00 H new ATOM 0 HG2 LYS A 584 18.240 -4.260 6.779 1.00 0.00 H new ATOM 0 HG3 LYS A 584 19.898 -4.354 6.221 1.00 0.00 H new ATOM 0 HD2 LYS A 584 19.294 -6.602 6.374 1.00 0.00 H new ATOM 0 HD3 LYS A 584 20.140 -6.340 7.886 1.00 0.00 H new ATOM 0 HE2 LYS A 584 17.899 -5.869 8.954 1.00 0.00 H new ATOM 0 HE3 LYS A 584 17.148 -6.378 7.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 584 17.328 -8.456 8.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 584 19.018 -8.324 8.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 584 18.055 -7.964 9.553 1.00 0.00 H new ATOM 356 N ASP A 585 22.110 -2.125 7.097 1.00 0.00 N ATOM 357 CA ASP A 585 23.078 -1.857 6.055 1.00 0.00 C ATOM 358 C ASP A 585 23.192 -2.958 5.041 1.00 0.00 C ATOM 359 O ASP A 585 23.191 -2.693 3.837 1.00 0.00 O ATOM 360 CB ASP A 585 24.432 -1.448 6.598 1.00 0.00 C ATOM 361 CG ASP A 585 24.438 -0.016 7.039 1.00 0.00 C ATOM 362 OD1 ASP A 585 24.457 0.873 6.158 1.00 0.00 O ATOM 363 OD2 ASP A 585 24.406 0.253 8.263 1.00 0.00 O ATOM 0 H ASP A 585 22.505 -2.386 8.000 1.00 0.00 H new ATOM 0 HA ASP A 585 22.679 -0.995 5.520 1.00 0.00 H new ATOM 0 HB2 ASP A 585 24.697 -2.090 7.438 1.00 0.00 H new ATOM 0 HB3 ASP A 585 25.192 -1.597 5.831 1.00 0.00 H new ATOM 368 N GLN A 586 23.257 -4.179 5.495 1.00 0.00 N ATOM 369 CA GLN A 586 23.365 -5.308 4.602 1.00 0.00 C ATOM 370 C GLN A 586 22.174 -6.213 4.751 1.00 0.00 C ATOM 371 O GLN A 586 21.857 -6.646 5.844 1.00 0.00 O ATOM 372 CB GLN A 586 24.655 -6.115 4.803 1.00 0.00 C ATOM 373 CG GLN A 586 25.936 -5.428 4.365 1.00 0.00 C ATOM 374 CD GLN A 586 26.742 -4.822 5.490 1.00 0.00 C ATOM 375 OE1 GLN A 586 27.963 -4.746 5.404 1.00 0.00 O ATOM 376 NE2 GLN A 586 26.105 -4.423 6.548 1.00 0.00 N ATOM 0 H GLN A 586 23.237 -4.423 6.485 1.00 0.00 H new ATOM 0 HA GLN A 586 23.397 -4.897 3.593 1.00 0.00 H new ATOM 0 HB2 GLN A 586 24.743 -6.368 5.860 1.00 0.00 H new ATOM 0 HB3 GLN A 586 24.563 -7.054 4.257 1.00 0.00 H new ATOM 0 HG2 GLN A 586 26.559 -6.151 3.838 1.00 0.00 H new ATOM 0 HG3 GLN A 586 25.686 -4.643 3.651 1.00 0.00 H new ATOM 0 HE21 GLN A 586 25.089 -4.499 6.590 1.00 0.00 H new ATOM 0 HE22 GLN A 586 26.621 -4.033 7.337 1.00 0.00 H new ATOM 385 N TYR A 587 21.536 -6.505 3.652 1.00 0.00 N ATOM 386 CA TYR A 587 20.368 -7.344 3.643 1.00 0.00 C ATOM 387 C TYR A 587 20.743 -8.723 3.211 1.00 0.00 C ATOM 388 O TYR A 587 21.500 -8.896 2.249 1.00 0.00 O ATOM 389 CB TYR A 587 19.253 -6.772 2.749 1.00 0.00 C ATOM 390 CG TYR A 587 18.688 -5.478 3.275 1.00 0.00 C ATOM 391 CD1 TYR A 587 19.321 -4.284 3.024 1.00 0.00 C ATOM 392 CD2 TYR A 587 17.546 -5.458 4.067 1.00 0.00 C ATOM 393 CE1 TYR A 587 18.833 -3.103 3.532 1.00 0.00 C ATOM 394 CE2 TYR A 587 17.059 -4.289 4.584 1.00 0.00 C ATOM 395 CZ TYR A 587 17.699 -3.111 4.315 1.00 0.00 C ATOM 396 OH TYR A 587 17.216 -1.932 4.843 1.00 0.00 O ATOM 0 H TYR A 587 21.813 -6.166 2.731 1.00 0.00 H new ATOM 0 HA TYR A 587 19.970 -7.381 4.657 1.00 0.00 H new ATOM 0 HB2 TYR A 587 19.646 -6.610 1.745 1.00 0.00 H new ATOM 0 HB3 TYR A 587 18.451 -7.505 2.663 1.00 0.00 H new ATOM 0 HD1 TYR A 587 20.215 -4.273 2.419 1.00 0.00 H new ATOM 0 HD2 TYR A 587 17.033 -6.384 4.279 1.00 0.00 H new ATOM 0 HE1 TYR A 587 19.337 -2.172 3.318 1.00 0.00 H new ATOM 0 HE2 TYR A 587 16.173 -4.296 5.202 1.00 0.00 H new ATOM 0 HH TYR A 587 16.581 -1.528 4.215 1.00 0.00 H new ATOM 406 N LYS A 588 20.277 -9.681 3.951 1.00 0.00 N ATOM 407 CA LYS A 588 20.512 -11.068 3.667 1.00 0.00 C ATOM 408 C LYS A 588 19.575 -11.493 2.543 1.00 0.00 C ATOM 409 O LYS A 588 18.472 -10.938 2.420 1.00 0.00 O ATOM 410 CB LYS A 588 20.228 -11.877 4.929 1.00 0.00 C ATOM 411 CG LYS A 588 20.688 -13.303 4.889 1.00 0.00 C ATOM 412 CD LYS A 588 20.372 -14.017 6.183 1.00 0.00 C ATOM 413 CE LYS A 588 20.882 -15.446 6.168 1.00 0.00 C ATOM 414 NZ LYS A 588 20.318 -16.228 5.043 1.00 0.00 N ATOM 0 H LYS A 588 19.712 -9.521 4.785 1.00 0.00 H new ATOM 0 HA LYS A 588 21.544 -11.236 3.360 1.00 0.00 H new ATOM 0 HB2 LYS A 588 20.705 -11.381 5.774 1.00 0.00 H new ATOM 0 HB3 LYS A 588 19.154 -11.863 5.116 1.00 0.00 H new ATOM 0 HG2 LYS A 588 20.207 -13.820 4.059 1.00 0.00 H new ATOM 0 HG3 LYS A 588 21.762 -13.336 4.705 1.00 0.00 H new ATOM 0 HD2 LYS A 588 20.822 -13.478 7.017 1.00 0.00 H new ATOM 0 HD3 LYS A 588 19.294 -14.016 6.347 1.00 0.00 H new ATOM 0 HE2 LYS A 588 21.970 -15.441 6.096 1.00 0.00 H new ATOM 0 HE3 LYS A 588 20.627 -15.931 7.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 20.511 -17.239 5.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 19.290 -16.075 4.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 20.756 -15.919 4.152 1.00 0.00 H new ATOM 428 N VAL A 589 20.005 -12.441 1.723 1.00 0.00 N ATOM 429 CA VAL A 589 19.187 -12.924 0.611 1.00 0.00 C ATOM 430 C VAL A 589 17.858 -13.477 1.139 1.00 0.00 C ATOM 431 O VAL A 589 17.836 -14.420 1.936 1.00 0.00 O ATOM 432 CB VAL A 589 19.922 -14.012 -0.230 1.00 0.00 C ATOM 433 CG1 VAL A 589 19.058 -14.479 -1.397 1.00 0.00 C ATOM 434 CG2 VAL A 589 21.253 -13.486 -0.747 1.00 0.00 C ATOM 0 H VAL A 589 20.916 -12.894 1.804 1.00 0.00 H new ATOM 0 HA VAL A 589 18.996 -12.076 -0.047 1.00 0.00 H new ATOM 0 HB VAL A 589 20.111 -14.864 0.423 1.00 0.00 H new ATOM 0 HG11 VAL A 589 19.595 -15.238 -1.967 1.00 0.00 H new ATOM 0 HG12 VAL A 589 18.129 -14.902 -1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 589 18.832 -13.632 -2.044 1.00 0.00 H new ATOM 0 HG21 VAL A 589 21.749 -14.262 -1.331 1.00 0.00 H new ATOM 0 HG22 VAL A 589 21.080 -12.613 -1.376 1.00 0.00 H new ATOM 0 HG23 VAL A 589 21.886 -13.206 0.095 1.00 0.00 H new ATOM 438 N GLY A 590 16.775 -12.879 0.710 1.00 0.00 N ATOM 439 CA GLY A 590 15.460 -13.263 1.160 1.00 0.00 C ATOM 440 C GLY A 590 14.860 -12.262 2.127 1.00 0.00 C ATOM 441 O GLY A 590 13.745 -12.453 2.613 1.00 0.00 O ATOM 0 H GLY A 590 16.780 -12.111 0.038 1.00 0.00 H new ATOM 0 HA2 GLY A 590 14.802 -13.369 0.298 1.00 0.00 H new ATOM 0 HA3 GLY A 590 15.515 -14.239 1.641 1.00 0.00 H new ATOM 445 N GLU A 591 15.603 -11.222 2.452 1.00 0.00 N ATOM 446 CA GLU A 591 15.051 -10.137 3.250 1.00 0.00 C ATOM 447 C GLU A 591 14.114 -9.327 2.419 1.00 0.00 C ATOM 448 O GLU A 591 14.418 -9.004 1.267 1.00 0.00 O ATOM 449 CB GLU A 591 16.136 -9.226 3.829 1.00 0.00 C ATOM 450 CG GLU A 591 16.749 -9.723 5.115 1.00 0.00 C ATOM 451 CD GLU A 591 15.748 -9.732 6.251 1.00 0.00 C ATOM 452 OE1 GLU A 591 15.586 -8.696 6.929 1.00 0.00 O ATOM 453 OE2 GLU A 591 15.113 -10.784 6.496 1.00 0.00 O ATOM 0 H GLU A 591 16.579 -11.102 2.181 1.00 0.00 H new ATOM 0 HA GLU A 591 14.521 -10.590 4.088 1.00 0.00 H new ATOM 0 HB2 GLU A 591 16.926 -9.106 3.087 1.00 0.00 H new ATOM 0 HB3 GLU A 591 15.709 -8.238 4.003 1.00 0.00 H new ATOM 0 HG2 GLU A 591 17.138 -10.730 4.966 1.00 0.00 H new ATOM 0 HG3 GLU A 591 17.595 -9.090 5.382 1.00 0.00 H new ATOM 460 N VAL A 592 12.978 -9.024 2.961 1.00 0.00 N ATOM 461 CA VAL A 592 12.054 -8.197 2.269 1.00 0.00 C ATOM 462 C VAL A 592 12.163 -6.813 2.837 1.00 0.00 C ATOM 463 O VAL A 592 11.880 -6.569 4.023 1.00 0.00 O ATOM 464 CB VAL A 592 10.596 -8.692 2.360 1.00 0.00 C ATOM 465 CG1 VAL A 592 9.699 -7.909 1.417 1.00 0.00 C ATOM 466 CG2 VAL A 592 10.510 -10.187 2.106 1.00 0.00 C ATOM 0 H VAL A 592 12.672 -9.339 3.881 1.00 0.00 H new ATOM 0 HA VAL A 592 12.308 -8.219 1.209 1.00 0.00 H new ATOM 0 HB VAL A 592 10.239 -8.515 3.375 1.00 0.00 H new ATOM 0 HG11 VAL A 592 8.676 -8.276 1.499 1.00 0.00 H new ATOM 0 HG12 VAL A 592 9.727 -6.852 1.682 1.00 0.00 H new ATOM 0 HG13 VAL A 592 10.049 -8.036 0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 592 9.471 -10.509 2.176 1.00 0.00 H new ATOM 0 HG22 VAL A 592 10.892 -10.409 1.110 1.00 0.00 H new ATOM 0 HG23 VAL A 592 11.105 -10.717 2.849 1.00 0.00 H new ATOM 470 N LEU A 593 12.596 -5.932 2.024 1.00 0.00 N ATOM 471 CA LEU A 593 12.778 -4.589 2.396 1.00 0.00 C ATOM 472 C LEU A 593 11.513 -3.882 2.074 1.00 0.00 C ATOM 473 O LEU A 593 11.269 -3.515 0.917 1.00 0.00 O ATOM 474 CB LEU A 593 13.932 -3.894 1.635 1.00 0.00 C ATOM 475 CG LEU A 593 15.354 -4.401 1.767 1.00 0.00 C ATOM 476 CD1 LEU A 593 15.510 -5.819 1.265 1.00 0.00 C ATOM 477 CD2 LEU A 593 16.281 -3.458 1.021 1.00 0.00 C ATOM 0 H LEU A 593 12.840 -6.131 1.054 1.00 0.00 H new ATOM 0 HA LEU A 593 13.034 -4.556 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 593 13.679 -3.918 0.575 1.00 0.00 H new ATOM 0 HB3 LEU A 593 13.934 -2.847 1.939 1.00 0.00 H new ATOM 0 HG LEU A 593 15.615 -4.422 2.825 1.00 0.00 H new ATOM 0 HD11 LEU A 593 16.547 -6.134 1.382 1.00 0.00 H new ATOM 0 HD12 LEU A 593 14.862 -6.482 1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 593 15.233 -5.865 0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 593 17.308 -3.812 1.109 1.00 0.00 H new ATOM 0 HD22 LEU A 593 15.997 -3.425 -0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 593 16.204 -2.458 1.449 1.00 0.00 H new ATOM 489 N LYS A 594 10.651 -3.811 3.031 1.00 0.00 N ATOM 490 CA LYS A 594 9.479 -3.037 2.857 1.00 0.00 C ATOM 491 C LYS A 594 9.903 -1.605 2.951 1.00 0.00 C ATOM 492 O LYS A 594 10.752 -1.279 3.750 1.00 0.00 O ATOM 493 CB LYS A 594 8.406 -3.349 3.909 1.00 0.00 C ATOM 494 CG LYS A 594 7.924 -4.789 3.927 1.00 0.00 C ATOM 495 CD LYS A 594 6.696 -4.925 4.815 1.00 0.00 C ATOM 496 CE LYS A 594 6.202 -6.359 4.902 1.00 0.00 C ATOM 497 NZ LYS A 594 7.120 -7.231 5.647 1.00 0.00 N ATOM 0 H LYS A 594 10.738 -4.277 3.934 1.00 0.00 H new ATOM 0 HA LYS A 594 9.023 -3.266 1.894 1.00 0.00 H new ATOM 0 HB2 LYS A 594 8.802 -3.102 4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 594 7.550 -2.697 3.737 1.00 0.00 H new ATOM 0 HG2 LYS A 594 7.686 -5.112 2.914 1.00 0.00 H new ATOM 0 HG3 LYS A 594 8.718 -5.441 4.291 1.00 0.00 H new ATOM 0 HD2 LYS A 594 6.932 -4.563 5.816 1.00 0.00 H new ATOM 0 HD3 LYS A 594 5.898 -4.291 4.427 1.00 0.00 H new ATOM 0 HE2 LYS A 594 5.224 -6.373 5.382 1.00 0.00 H new ATOM 0 HE3 LYS A 594 6.068 -6.755 3.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 594 6.696 -8.175 5.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 594 8.020 -7.309 5.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 594 7.295 -6.827 6.589 1.00 0.00 H new ATOM 511 N PHE A 595 9.423 -0.793 2.106 1.00 0.00 N ATOM 512 CA PHE A 595 9.758 0.584 2.176 1.00 0.00 C ATOM 513 C PHE A 595 8.553 1.377 2.547 1.00 0.00 C ATOM 514 O PHE A 595 7.418 0.892 2.483 1.00 0.00 O ATOM 515 CB PHE A 595 10.292 1.106 0.856 1.00 0.00 C ATOM 516 CG PHE A 595 11.510 0.430 0.368 1.00 0.00 C ATOM 517 CD1 PHE A 595 12.701 0.537 1.054 1.00 0.00 C ATOM 518 CD2 PHE A 595 11.468 -0.303 -0.784 1.00 0.00 C ATOM 519 CE1 PHE A 595 13.833 -0.086 0.590 1.00 0.00 C ATOM 520 CE2 PHE A 595 12.582 -0.922 -1.254 1.00 0.00 C ATOM 521 CZ PHE A 595 13.775 -0.818 -0.568 1.00 0.00 C ATOM 0 H PHE A 595 8.791 -1.048 1.347 1.00 0.00 H new ATOM 0 HA PHE A 595 10.538 0.690 2.930 1.00 0.00 H new ATOM 0 HB2 PHE A 595 9.512 1.008 0.101 1.00 0.00 H new ATOM 0 HB3 PHE A 595 10.502 2.170 0.961 1.00 0.00 H new ATOM 0 HD1 PHE A 595 12.744 1.116 1.965 1.00 0.00 H new ATOM 0 HD2 PHE A 595 10.539 -0.391 -1.327 1.00 0.00 H new ATOM 0 HE1 PHE A 595 14.763 -0.000 1.133 1.00 0.00 H new ATOM 0 HE2 PHE A 595 12.534 -1.497 -2.167 1.00 0.00 H new ATOM 0 HZ PHE A 595 14.660 -1.311 -0.942 1.00 0.00 H new ATOM 531 N SER A 596 8.795 2.557 2.952 1.00 0.00 N ATOM 532 CA SER A 596 7.830 3.518 3.228 1.00 0.00 C ATOM 533 C SER A 596 8.559 4.810 2.980 1.00 0.00 C ATOM 534 O SER A 596 9.761 4.785 2.728 1.00 0.00 O ATOM 535 CB SER A 596 7.394 3.423 4.698 1.00 0.00 C ATOM 536 OG SER A 596 7.039 2.083 5.058 1.00 0.00 O ATOM 0 H SER A 596 9.745 2.894 3.108 1.00 0.00 H new ATOM 0 HA SER A 596 6.926 3.411 2.629 1.00 0.00 H new ATOM 0 HB2 SER A 596 8.203 3.771 5.341 1.00 0.00 H new ATOM 0 HB3 SER A 596 6.544 4.084 4.869 1.00 0.00 H new ATOM 0 HG SER A 596 6.768 2.058 6.000 1.00 0.00 H new ATOM 542 N CYS A 597 7.899 5.868 3.002 1.00 0.00 N ATOM 543 CA CYS A 597 8.548 7.136 2.882 1.00 0.00 C ATOM 544 C CYS A 597 8.496 7.834 4.217 1.00 0.00 C ATOM 545 O CYS A 597 7.943 7.289 5.185 1.00 0.00 O ATOM 546 CB CYS A 597 7.892 7.995 1.796 1.00 0.00 C ATOM 547 SG CYS A 597 8.208 7.428 0.095 1.00 0.00 S ATOM 0 H CYS A 597 6.885 5.913 3.103 1.00 0.00 H new ATOM 0 HA CYS A 597 9.586 6.981 2.587 1.00 0.00 H new ATOM 0 HB2 CYS A 597 6.815 8.014 1.966 1.00 0.00 H new ATOM 0 HB3 CYS A 597 8.248 9.020 1.896 1.00 0.00 H new ATOM 552 N LYS A 598 9.084 9.007 4.276 1.00 0.00 N ATOM 553 CA LYS A 598 9.080 9.857 5.441 1.00 0.00 C ATOM 554 C LYS A 598 7.666 10.134 5.939 1.00 0.00 C ATOM 555 O LYS A 598 6.700 9.939 5.195 1.00 0.00 O ATOM 556 CB LYS A 598 9.797 11.163 5.125 1.00 0.00 C ATOM 557 CG LYS A 598 11.283 11.016 5.026 1.00 0.00 C ATOM 558 CD LYS A 598 11.898 10.503 6.318 1.00 0.00 C ATOM 559 CE LYS A 598 13.392 10.262 6.162 1.00 0.00 C ATOM 560 NZ LYS A 598 14.024 9.832 7.428 1.00 0.00 N ATOM 0 H LYS A 598 9.594 9.407 3.488 1.00 0.00 H new ATOM 0 HA LYS A 598 9.607 9.335 6.240 1.00 0.00 H new ATOM 0 HB2 LYS A 598 9.415 11.560 4.185 1.00 0.00 H new ATOM 0 HB3 LYS A 598 9.562 11.894 5.899 1.00 0.00 H new ATOM 0 HG2 LYS A 598 11.525 10.331 4.214 1.00 0.00 H new ATOM 0 HG3 LYS A 598 11.725 11.979 4.773 1.00 0.00 H new ATOM 0 HD2 LYS A 598 11.725 11.224 7.117 1.00 0.00 H new ATOM 0 HD3 LYS A 598 11.407 9.576 6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 598 13.558 9.502 5.399 1.00 0.00 H new ATOM 0 HE3 LYS A 598 13.871 11.176 5.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 598 15.041 9.680 7.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 598 13.890 10.568 8.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 598 13.586 8.946 7.751 1.00 0.00 H new ATOM 574 N PRO A 599 7.537 10.603 7.194 1.00 0.00 N ATOM 575 CA PRO A 599 6.247 10.851 7.853 1.00 0.00 C ATOM 576 C PRO A 599 5.214 11.573 6.973 1.00 0.00 C ATOM 577 O PRO A 599 4.052 11.158 6.911 1.00 0.00 O ATOM 578 CB PRO A 599 6.625 11.715 9.049 1.00 0.00 C ATOM 579 CG PRO A 599 8.014 11.301 9.387 1.00 0.00 C ATOM 580 CD PRO A 599 8.667 10.936 8.088 1.00 0.00 C ATOM 0 HA PRO A 599 5.756 9.912 8.108 1.00 0.00 H new ATOM 0 HB2 PRO A 599 6.576 12.776 8.803 1.00 0.00 H new ATOM 0 HB3 PRO A 599 5.947 11.551 9.887 1.00 0.00 H new ATOM 0 HG2 PRO A 599 8.553 12.110 9.880 1.00 0.00 H new ATOM 0 HG3 PRO A 599 8.012 10.454 10.074 1.00 0.00 H new ATOM 0 HD2 PRO A 599 9.257 11.763 7.693 1.00 0.00 H new ATOM 0 HD3 PRO A 599 9.344 10.090 8.207 1.00 0.00 H new ATOM 588 N GLY A 600 5.639 12.604 6.281 1.00 0.00 N ATOM 589 CA GLY A 600 4.733 13.370 5.460 1.00 0.00 C ATOM 590 C GLY A 600 4.816 13.003 3.995 1.00 0.00 C ATOM 591 O GLY A 600 4.384 13.763 3.133 1.00 0.00 O ATOM 0 H GLY A 600 6.605 12.931 6.270 1.00 0.00 H new ATOM 0 HA2 GLY A 600 3.713 13.215 5.811 1.00 0.00 H new ATOM 0 HA3 GLY A 600 4.953 14.431 5.577 1.00 0.00 H new ATOM 595 N PHE A 601 5.367 11.857 3.699 1.00 0.00 N ATOM 596 CA PHE A 601 5.482 11.417 2.341 1.00 0.00 C ATOM 597 C PHE A 601 4.770 10.126 2.099 1.00 0.00 C ATOM 598 O PHE A 601 4.663 9.269 2.979 1.00 0.00 O ATOM 599 CB PHE A 601 6.934 11.297 1.902 1.00 0.00 C ATOM 600 CG PHE A 601 7.549 12.580 1.498 1.00 0.00 C ATOM 601 CD1 PHE A 601 8.111 13.430 2.424 1.00 0.00 C ATOM 602 CD2 PHE A 601 7.562 12.933 0.171 1.00 0.00 C ATOM 603 CE1 PHE A 601 8.678 14.620 2.029 1.00 0.00 C ATOM 604 CE2 PHE A 601 8.124 14.115 -0.242 1.00 0.00 C ATOM 605 CZ PHE A 601 8.687 14.967 0.688 1.00 0.00 C ATOM 0 H PHE A 601 5.745 11.208 4.389 1.00 0.00 H new ATOM 0 HA PHE A 601 5.001 12.187 1.738 1.00 0.00 H new ATOM 0 HB2 PHE A 601 7.515 10.869 2.718 1.00 0.00 H new ATOM 0 HB3 PHE A 601 6.994 10.599 1.067 1.00 0.00 H new ATOM 0 HD1 PHE A 601 8.107 13.160 3.470 1.00 0.00 H new ATOM 0 HD2 PHE A 601 7.123 12.270 -0.559 1.00 0.00 H new ATOM 0 HE1 PHE A 601 9.115 15.282 2.762 1.00 0.00 H new ATOM 0 HE2 PHE A 601 8.126 14.378 -1.290 1.00 0.00 H new ATOM 0 HZ PHE A 601 9.132 15.899 0.371 1.00 0.00 H new ATOM 615 N THR A 602 4.280 10.010 0.924 1.00 0.00 N ATOM 616 CA THR A 602 3.653 8.843 0.445 1.00 0.00 C ATOM 617 C THR A 602 4.622 8.065 -0.432 1.00 0.00 C ATOM 618 O THR A 602 5.288 8.645 -1.290 1.00 0.00 O ATOM 619 CB THR A 602 2.422 9.224 -0.391 1.00 0.00 C ATOM 620 OG1 THR A 602 1.375 9.782 0.437 1.00 0.00 O ATOM 621 CG2 THR A 602 1.914 8.047 -1.214 1.00 0.00 C ATOM 0 H THR A 602 4.307 10.764 0.238 1.00 0.00 H new ATOM 0 HA THR A 602 3.348 8.230 1.293 1.00 0.00 H new ATOM 0 HB THR A 602 2.734 9.997 -1.093 1.00 0.00 H new ATOM 0 HG1 THR A 602 0.955 10.534 -0.030 1.00 0.00 H new ATOM 0 HG21 THR A 602 1.043 8.356 -1.792 1.00 0.00 H new ATOM 0 HG22 THR A 602 2.699 7.712 -1.892 1.00 0.00 H new ATOM 0 HG23 THR A 602 1.637 7.230 -0.548 1.00 0.00 H new ATOM 629 N ILE A 603 4.702 6.783 -0.210 1.00 0.00 N ATOM 630 CA ILE A 603 5.509 5.931 -1.029 1.00 0.00 C ATOM 631 C ILE A 603 4.686 5.437 -2.226 1.00 0.00 C ATOM 632 O ILE A 603 3.551 4.980 -2.067 1.00 0.00 O ATOM 633 CB ILE A 603 6.083 4.735 -0.219 1.00 0.00 C ATOM 634 CG1 ILE A 603 6.904 3.829 -1.136 1.00 0.00 C ATOM 635 CG2 ILE A 603 4.982 3.959 0.512 1.00 0.00 C ATOM 636 CD1 ILE A 603 7.521 2.660 -0.439 1.00 0.00 C ATOM 0 H ILE A 603 4.210 6.302 0.543 1.00 0.00 H new ATOM 0 HA ILE A 603 6.359 6.508 -1.393 1.00 0.00 H new ATOM 0 HB ILE A 603 6.743 5.130 0.553 1.00 0.00 H new ATOM 0 HG12 ILE A 603 6.263 3.464 -1.938 1.00 0.00 H new ATOM 0 HG13 ILE A 603 7.693 4.419 -1.602 1.00 0.00 H new ATOM 0 HG21 ILE A 603 5.426 3.132 1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 603 4.467 4.624 1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 603 4.269 3.568 -0.214 1.00 0.00 H new ATOM 0 HD11 ILE A 603 8.087 2.066 -1.157 1.00 0.00 H new ATOM 0 HD12 ILE A 603 8.190 3.015 0.345 1.00 0.00 H new ATOM 0 HD13 ILE A 603 6.737 2.045 0.003 1.00 0.00 H new ATOM 643 N VAL A 604 5.223 5.581 -3.401 1.00 0.00 N ATOM 644 CA VAL A 604 4.560 5.138 -4.610 1.00 0.00 C ATOM 645 C VAL A 604 5.450 4.141 -5.328 1.00 0.00 C ATOM 646 O VAL A 604 6.617 4.441 -5.624 1.00 0.00 O ATOM 647 CB VAL A 604 4.211 6.333 -5.549 1.00 0.00 C ATOM 648 CG1 VAL A 604 3.529 5.855 -6.828 1.00 0.00 C ATOM 649 CG2 VAL A 604 3.319 7.328 -4.827 1.00 0.00 C ATOM 0 H VAL A 604 6.135 6.009 -3.558 1.00 0.00 H new ATOM 0 HA VAL A 604 3.619 4.662 -4.334 1.00 0.00 H new ATOM 0 HB VAL A 604 5.145 6.822 -5.825 1.00 0.00 H new ATOM 0 HG11 VAL A 604 3.299 6.713 -7.460 1.00 0.00 H new ATOM 0 HG12 VAL A 604 4.194 5.177 -7.363 1.00 0.00 H new ATOM 0 HG13 VAL A 604 2.606 5.333 -6.575 1.00 0.00 H new ATOM 0 HG21 VAL A 604 3.084 8.157 -5.495 1.00 0.00 H new ATOM 0 HG22 VAL A 604 2.396 6.835 -4.522 1.00 0.00 H new ATOM 0 HG23 VAL A 604 3.836 7.708 -3.946 1.00 0.00 H new ATOM 653 N GLY A 605 4.919 2.960 -5.570 1.00 0.00 N ATOM 654 CA GLY A 605 5.668 1.916 -6.226 1.00 0.00 C ATOM 655 C GLY A 605 5.710 0.661 -5.377 1.00 0.00 C ATOM 656 O GLY A 605 4.776 0.415 -4.606 1.00 0.00 O ATOM 0 H GLY A 605 3.965 2.701 -5.319 1.00 0.00 H new ATOM 0 HA2 GLY A 605 5.215 1.691 -7.192 1.00 0.00 H new ATOM 0 HA3 GLY A 605 6.683 2.261 -6.422 1.00 0.00 H new ATOM 660 N PRO A 606 6.770 -0.154 -5.483 1.00 0.00 N ATOM 661 CA PRO A 606 6.907 -1.364 -4.683 1.00 0.00 C ATOM 662 C PRO A 606 7.241 -1.031 -3.230 1.00 0.00 C ATOM 663 O PRO A 606 8.287 -0.459 -2.929 1.00 0.00 O ATOM 664 CB PRO A 606 8.061 -2.116 -5.349 1.00 0.00 C ATOM 665 CG PRO A 606 8.863 -1.066 -6.026 1.00 0.00 C ATOM 666 CD PRO A 606 7.910 0.035 -6.397 1.00 0.00 C ATOM 0 HA PRO A 606 5.987 -1.947 -4.648 1.00 0.00 H new ATOM 0 HB2 PRO A 606 8.657 -2.655 -4.613 1.00 0.00 H new ATOM 0 HB3 PRO A 606 7.692 -2.853 -6.063 1.00 0.00 H new ATOM 0 HG2 PRO A 606 9.647 -0.693 -5.367 1.00 0.00 H new ATOM 0 HG3 PRO A 606 9.355 -1.466 -6.912 1.00 0.00 H new ATOM 0 HD2 PRO A 606 8.366 1.017 -6.268 1.00 0.00 H new ATOM 0 HD3 PRO A 606 7.602 -0.039 -7.440 1.00 0.00 H new ATOM 674 N ASN A 607 6.345 -1.365 -2.333 1.00 0.00 N ATOM 675 CA ASN A 607 6.547 -1.061 -0.929 1.00 0.00 C ATOM 676 C ASN A 607 7.217 -2.236 -0.237 1.00 0.00 C ATOM 677 O ASN A 607 7.334 -2.252 0.968 1.00 0.00 O ATOM 678 CB ASN A 607 5.225 -0.713 -0.183 1.00 0.00 C ATOM 679 CG ASN A 607 4.312 0.304 -0.886 1.00 0.00 C ATOM 680 OD1 ASN A 607 3.092 0.282 -0.702 1.00 0.00 O ATOM 681 ND2 ASN A 607 4.866 1.176 -1.689 1.00 0.00 N ATOM 0 H ASN A 607 5.471 -1.846 -2.545 1.00 0.00 H new ATOM 0 HA ASN A 607 7.184 -0.177 -0.890 1.00 0.00 H new ATOM 0 HB2 ASN A 607 4.662 -1.634 -0.030 1.00 0.00 H new ATOM 0 HB3 ASN A 607 5.477 -0.326 0.804 1.00 0.00 H new ATOM 0 HD21 ASN A 607 4.287 1.858 -2.179 1.00 0.00 H new ATOM 0 HD22 ASN A 607 5.877 1.174 -1.825 1.00 0.00 H new ATOM 688 N SER A 608 7.634 -3.221 -1.005 1.00 0.00 N ATOM 689 CA SER A 608 8.342 -4.369 -0.488 1.00 0.00 C ATOM 690 C SER A 608 9.176 -5.008 -1.592 1.00 0.00 C ATOM 691 O SER A 608 8.634 -5.487 -2.578 1.00 0.00 O ATOM 692 CB SER A 608 7.335 -5.378 0.095 1.00 0.00 C ATOM 693 OG SER A 608 6.344 -5.760 -0.872 1.00 0.00 O ATOM 0 H SER A 608 7.489 -3.246 -2.014 1.00 0.00 H new ATOM 0 HA SER A 608 9.017 -4.053 0.308 1.00 0.00 H new ATOM 0 HB2 SER A 608 7.867 -6.265 0.440 1.00 0.00 H new ATOM 0 HB3 SER A 608 6.845 -4.941 0.965 1.00 0.00 H new ATOM 0 HG SER A 608 6.733 -5.723 -1.771 1.00 0.00 H new ATOM 699 N VAL A 609 10.475 -4.958 -1.467 1.00 0.00 N ATOM 700 CA VAL A 609 11.343 -5.603 -2.439 1.00 0.00 C ATOM 701 C VAL A 609 12.142 -6.670 -1.717 1.00 0.00 C ATOM 702 O VAL A 609 12.341 -6.574 -0.522 1.00 0.00 O ATOM 703 CB VAL A 609 12.309 -4.599 -3.156 1.00 0.00 C ATOM 704 CG1 VAL A 609 11.543 -3.436 -3.771 1.00 0.00 C ATOM 705 CG2 VAL A 609 13.421 -4.100 -2.239 1.00 0.00 C ATOM 0 H VAL A 609 10.962 -4.482 -0.708 1.00 0.00 H new ATOM 0 HA VAL A 609 10.720 -6.036 -3.222 1.00 0.00 H new ATOM 0 HB VAL A 609 12.790 -5.153 -3.962 1.00 0.00 H new ATOM 0 HG11 VAL A 609 12.242 -2.758 -4.260 1.00 0.00 H new ATOM 0 HG12 VAL A 609 10.832 -3.816 -4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 609 11.005 -2.900 -2.989 1.00 0.00 H new ATOM 0 HG21 VAL A 609 14.061 -3.408 -2.786 1.00 0.00 H new ATOM 0 HG22 VAL A 609 12.984 -3.589 -1.381 1.00 0.00 H new ATOM 0 HG23 VAL A 609 14.015 -4.946 -1.893 1.00 0.00 H new ATOM 709 N GLN A 610 12.543 -7.704 -2.392 1.00 0.00 N ATOM 710 CA GLN A 610 13.337 -8.727 -1.740 1.00 0.00 C ATOM 711 C GLN A 610 14.777 -8.566 -2.084 1.00 0.00 C ATOM 712 O GLN A 610 15.135 -7.988 -3.120 1.00 0.00 O ATOM 713 CB GLN A 610 12.944 -10.182 -2.092 1.00 0.00 C ATOM 714 CG GLN A 610 11.856 -10.884 -1.273 1.00 0.00 C ATOM 715 CD GLN A 610 10.410 -10.431 -1.475 1.00 0.00 C ATOM 716 OE1 GLN A 610 9.505 -11.262 -1.414 1.00 0.00 O ATOM 717 NE2 GLN A 610 10.160 -9.170 -1.579 1.00 0.00 N ATOM 0 H GLN A 610 12.343 -7.870 -3.378 1.00 0.00 H new ATOM 0 HA GLN A 610 13.144 -8.579 -0.678 1.00 0.00 H new ATOM 0 HB2 GLN A 610 12.627 -10.192 -3.135 1.00 0.00 H new ATOM 0 HB3 GLN A 610 13.846 -10.790 -2.027 1.00 0.00 H new ATOM 0 HG2 GLN A 610 11.907 -11.950 -1.492 1.00 0.00 H new ATOM 0 HG3 GLN A 610 12.101 -10.764 -0.218 1.00 0.00 H new ATOM 0 HE21 GLN A 610 10.928 -8.500 -1.628 1.00 0.00 H new ATOM 0 HE22 GLN A 610 9.195 -8.843 -1.612 1.00 0.00 H new ATOM 726 N CYS A 611 15.586 -9.037 -1.218 1.00 0.00 N ATOM 727 CA CYS A 611 16.973 -9.163 -1.493 1.00 0.00 C ATOM 728 C CYS A 611 17.169 -10.465 -2.200 1.00 0.00 C ATOM 729 O CYS A 611 16.917 -11.523 -1.634 1.00 0.00 O ATOM 730 CB CYS A 611 17.816 -9.134 -0.226 1.00 0.00 C ATOM 731 SG CYS A 611 19.534 -9.701 -0.485 1.00 0.00 S ATOM 0 H CYS A 611 15.309 -9.351 -0.288 1.00 0.00 H new ATOM 0 HA CYS A 611 17.296 -8.320 -2.104 1.00 0.00 H new ATOM 0 HB2 CYS A 611 17.832 -8.118 0.168 1.00 0.00 H new ATOM 0 HB3 CYS A 611 17.344 -9.761 0.530 1.00 0.00 H new ATOM 736 N TYR A 612 17.538 -10.397 -3.426 1.00 0.00 N ATOM 737 CA TYR A 612 17.771 -11.566 -4.191 1.00 0.00 C ATOM 738 C TYR A 612 19.246 -11.762 -4.329 1.00 0.00 C ATOM 739 O TYR A 612 20.022 -10.861 -4.037 1.00 0.00 O ATOM 740 CB TYR A 612 17.132 -11.430 -5.558 1.00 0.00 C ATOM 741 CG TYR A 612 15.627 -11.340 -5.523 1.00 0.00 C ATOM 742 CD1 TYR A 612 14.854 -12.444 -5.194 1.00 0.00 C ATOM 743 CD2 TYR A 612 14.978 -10.157 -5.821 1.00 0.00 C ATOM 744 CE1 TYR A 612 13.479 -12.367 -5.165 1.00 0.00 C ATOM 745 CE2 TYR A 612 13.606 -10.074 -5.793 1.00 0.00 C ATOM 746 CZ TYR A 612 12.861 -11.177 -5.465 1.00 0.00 C ATOM 747 OH TYR A 612 11.481 -11.089 -5.440 1.00 0.00 O ATOM 0 H TYR A 612 17.688 -9.523 -3.931 1.00 0.00 H new ATOM 0 HA TYR A 612 17.330 -12.428 -3.691 1.00 0.00 H new ATOM 0 HB2 TYR A 612 17.528 -10.540 -6.046 1.00 0.00 H new ATOM 0 HB3 TYR A 612 17.421 -12.285 -6.170 1.00 0.00 H new ATOM 0 HD1 TYR A 612 15.338 -13.380 -4.957 1.00 0.00 H new ATOM 0 HD2 TYR A 612 15.558 -9.284 -6.080 1.00 0.00 H new ATOM 0 HE1 TYR A 612 12.891 -13.236 -4.908 1.00 0.00 H new ATOM 0 HE2 TYR A 612 13.116 -9.141 -6.029 1.00 0.00 H new ATOM 0 HH TYR A 612 11.207 -10.178 -5.676 1.00 0.00 H new ATOM 757 N HIS A 613 19.642 -12.901 -4.837 1.00 0.00 N ATOM 758 CA HIS A 613 21.062 -13.205 -5.007 1.00 0.00 C ATOM 759 C HIS A 613 21.676 -12.510 -6.229 1.00 0.00 C ATOM 760 O HIS A 613 22.766 -12.864 -6.684 1.00 0.00 O ATOM 761 CB HIS A 613 21.360 -14.728 -4.976 1.00 0.00 C ATOM 762 CG HIS A 613 20.590 -15.582 -5.949 1.00 0.00 C ATOM 763 ND1 HIS A 613 19.982 -16.755 -5.579 1.00 0.00 N ATOM 764 CD2 HIS A 613 20.371 -15.460 -7.278 1.00 0.00 C ATOM 765 CE1 HIS A 613 19.427 -17.309 -6.627 1.00 0.00 C ATOM 766 NE2 HIS A 613 19.646 -16.552 -7.664 1.00 0.00 N ATOM 0 H HIS A 613 19.010 -13.641 -5.144 1.00 0.00 H new ATOM 0 HA HIS A 613 21.562 -12.782 -4.136 1.00 0.00 H new ATOM 0 HB2 HIS A 613 22.424 -14.872 -5.163 1.00 0.00 H new ATOM 0 HB3 HIS A 613 21.162 -15.094 -3.969 1.00 0.00 H new ATOM 0 HD2 HIS A 613 20.705 -14.653 -7.913 1.00 0.00 H new ATOM 0 HE1 HIS A 613 18.879 -18.239 -6.631 1.00 0.00 H new ATOM 0 HE2 HIS A 613 19.327 -16.744 -8.614 1.00 0.00 H new ATOM 775 N PHE A 614 20.968 -11.538 -6.760 1.00 0.00 N ATOM 776 CA PHE A 614 21.505 -10.690 -7.786 1.00 0.00 C ATOM 777 C PHE A 614 21.360 -9.233 -7.351 1.00 0.00 C ATOM 778 O PHE A 614 21.781 -8.320 -8.053 1.00 0.00 O ATOM 779 CB PHE A 614 20.857 -10.937 -9.166 1.00 0.00 C ATOM 780 CG PHE A 614 19.476 -10.391 -9.333 1.00 0.00 C ATOM 781 CD1 PHE A 614 18.392 -11.038 -8.805 1.00 0.00 C ATOM 782 CD2 PHE A 614 19.276 -9.222 -10.041 1.00 0.00 C ATOM 783 CE1 PHE A 614 17.126 -10.538 -8.974 1.00 0.00 C ATOM 784 CE2 PHE A 614 18.019 -8.711 -10.211 1.00 0.00 C ATOM 785 CZ PHE A 614 16.936 -9.370 -9.678 1.00 0.00 C ATOM 0 H PHE A 614 20.009 -11.319 -6.490 1.00 0.00 H new ATOM 0 HA PHE A 614 22.560 -10.931 -7.912 1.00 0.00 H new ATOM 0 HB2 PHE A 614 21.497 -10.500 -9.932 1.00 0.00 H new ATOM 0 HB3 PHE A 614 20.829 -12.011 -9.348 1.00 0.00 H new ATOM 0 HD1 PHE A 614 18.535 -11.953 -8.249 1.00 0.00 H new ATOM 0 HD2 PHE A 614 20.123 -8.705 -10.466 1.00 0.00 H new ATOM 0 HE1 PHE A 614 16.279 -11.060 -8.555 1.00 0.00 H new ATOM 0 HE2 PHE A 614 17.877 -7.793 -10.762 1.00 0.00 H new ATOM 0 HZ PHE A 614 15.940 -8.973 -9.811 1.00 0.00 H new ATOM 795 N GLY A 615 20.773 -9.027 -6.175 1.00 0.00 N ATOM 796 CA GLY A 615 20.597 -7.696 -5.663 1.00 0.00 C ATOM 797 C GLY A 615 19.195 -7.439 -5.161 1.00 0.00 C ATOM 798 O GLY A 615 18.354 -8.346 -5.142 1.00 0.00 O ATOM 0 H GLY A 615 20.417 -9.768 -5.571 1.00 0.00 H new ATOM 0 HA2 GLY A 615 21.305 -7.528 -4.851 1.00 0.00 H new ATOM 0 HA3 GLY A 615 20.834 -6.976 -6.447 1.00 0.00 H new ATOM 802 N LEU A 616 18.938 -6.204 -4.764 1.00 0.00 N ATOM 803 CA LEU A 616 17.628 -5.800 -4.262 1.00 0.00 C ATOM 804 C LEU A 616 16.719 -5.593 -5.453 1.00 0.00 C ATOM 805 O LEU A 616 17.059 -4.810 -6.353 1.00 0.00 O ATOM 806 CB LEU A 616 17.688 -4.465 -3.424 1.00 0.00 C ATOM 807 CG LEU A 616 18.529 -4.450 -2.134 1.00 0.00 C ATOM 808 CD1 LEU A 616 18.125 -5.571 -1.216 1.00 0.00 C ATOM 809 CD2 LEU A 616 20.010 -4.485 -2.442 1.00 0.00 C ATOM 0 H LEU A 616 19.627 -5.452 -4.779 1.00 0.00 H new ATOM 0 HA LEU A 616 17.258 -6.581 -3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 616 18.067 -3.679 -4.077 1.00 0.00 H new ATOM 0 HB3 LEU A 616 16.666 -4.193 -3.158 1.00 0.00 H new ATOM 0 HG LEU A 616 18.331 -3.512 -1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 616 18.734 -5.539 -0.312 1.00 0.00 H new ATOM 0 HD12 LEU A 616 17.074 -5.462 -0.950 1.00 0.00 H new ATOM 0 HD13 LEU A 616 18.275 -6.526 -1.720 1.00 0.00 H new ATOM 0 HD21 LEU A 616 20.576 -4.473 -1.510 1.00 0.00 H new ATOM 0 HD22 LEU A 616 20.245 -5.393 -2.998 1.00 0.00 H new ATOM 0 HD23 LEU A 616 20.278 -3.614 -3.040 1.00 0.00 H new ATOM 821 N SER A 617 15.601 -6.272 -5.497 1.00 0.00 N ATOM 822 CA SER A 617 14.716 -6.132 -6.624 1.00 0.00 C ATOM 823 C SER A 617 13.259 -6.372 -6.172 1.00 0.00 C ATOM 824 O SER A 617 13.025 -7.084 -5.180 1.00 0.00 O ATOM 825 CB SER A 617 15.142 -7.106 -7.739 1.00 0.00 C ATOM 826 OG SER A 617 14.613 -6.730 -9.001 1.00 0.00 O ATOM 0 H SER A 617 15.285 -6.920 -4.775 1.00 0.00 H new ATOM 0 HA SER A 617 14.776 -5.121 -7.026 1.00 0.00 H new ATOM 0 HB2 SER A 617 16.230 -7.138 -7.797 1.00 0.00 H new ATOM 0 HB3 SER A 617 14.806 -8.112 -7.490 1.00 0.00 H new ATOM 0 HG SER A 617 15.138 -7.150 -9.714 1.00 0.00 H new ATOM 832 N PRO A 618 12.252 -5.759 -6.853 1.00 0.00 N ATOM 833 CA PRO A 618 12.467 -4.867 -8.016 1.00 0.00 C ATOM 834 C PRO A 618 13.115 -3.529 -7.626 1.00 0.00 C ATOM 835 O PRO A 618 13.475 -3.314 -6.454 1.00 0.00 O ATOM 836 CB PRO A 618 11.049 -4.643 -8.552 1.00 0.00 C ATOM 837 CG PRO A 618 10.172 -4.824 -7.367 1.00 0.00 C ATOM 838 CD PRO A 618 10.820 -5.897 -6.536 1.00 0.00 C ATOM 0 HA PRO A 618 13.151 -5.304 -8.743 1.00 0.00 H new ATOM 0 HB2 PRO A 618 10.939 -3.646 -8.979 1.00 0.00 H new ATOM 0 HB3 PRO A 618 10.805 -5.356 -9.339 1.00 0.00 H new ATOM 0 HG2 PRO A 618 10.080 -3.895 -6.804 1.00 0.00 H new ATOM 0 HG3 PRO A 618 9.166 -5.116 -7.667 1.00 0.00 H new ATOM 0 HD2 PRO A 618 10.628 -5.752 -5.473 1.00 0.00 H new ATOM 0 HD3 PRO A 618 10.445 -6.887 -6.795 1.00 0.00 H new ATOM 846 N ASP A 619 13.310 -2.656 -8.598 1.00 0.00 N ATOM 847 CA ASP A 619 13.883 -1.345 -8.307 1.00 0.00 C ATOM 848 C ASP A 619 12.978 -0.545 -7.395 1.00 0.00 C ATOM 849 O ASP A 619 11.762 -0.768 -7.338 1.00 0.00 O ATOM 850 CB ASP A 619 14.289 -0.535 -9.545 1.00 0.00 C ATOM 851 CG ASP A 619 13.134 -0.036 -10.377 1.00 0.00 C ATOM 852 OD1 ASP A 619 12.533 -0.844 -11.131 1.00 0.00 O ATOM 853 OD2 ASP A 619 12.822 1.166 -10.324 1.00 0.00 O ATOM 0 H ASP A 619 13.087 -2.821 -9.579 1.00 0.00 H new ATOM 0 HA ASP A 619 14.819 -1.550 -7.787 1.00 0.00 H new ATOM 0 HB2 ASP A 619 14.884 0.320 -9.224 1.00 0.00 H new ATOM 0 HB3 ASP A 619 14.931 -1.153 -10.173 1.00 0.00 H new ATOM 858 N LEU A 620 13.582 0.383 -6.730 1.00 0.00 N ATOM 859 CA LEU A 620 13.009 1.120 -5.622 1.00 0.00 C ATOM 860 C LEU A 620 11.838 2.038 -6.015 1.00 0.00 C ATOM 861 O LEU A 620 11.734 2.500 -7.156 1.00 0.00 O ATOM 862 CB LEU A 620 14.128 1.927 -4.976 1.00 0.00 C ATOM 863 CG LEU A 620 15.400 1.135 -4.695 1.00 0.00 C ATOM 864 CD1 LEU A 620 16.523 2.042 -4.263 1.00 0.00 C ATOM 865 CD2 LEU A 620 15.156 0.049 -3.668 1.00 0.00 C ATOM 0 H LEU A 620 14.536 0.672 -6.945 1.00 0.00 H new ATOM 0 HA LEU A 620 12.578 0.400 -4.927 1.00 0.00 H new ATOM 0 HB2 LEU A 620 14.374 2.767 -5.626 1.00 0.00 H new ATOM 0 HB3 LEU A 620 13.762 2.346 -4.039 1.00 0.00 H new ATOM 0 HG LEU A 620 15.698 0.653 -5.626 1.00 0.00 H new ATOM 0 HD11 LEU A 620 17.416 1.448 -4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 620 16.731 2.765 -5.052 1.00 0.00 H new ATOM 0 HD13 LEU A 620 16.235 2.570 -3.354 1.00 0.00 H new ATOM 0 HD21 LEU A 620 16.082 -0.498 -3.490 1.00 0.00 H new ATOM 0 HD22 LEU A 620 14.815 0.500 -2.736 1.00 0.00 H new ATOM 0 HD23 LEU A 620 14.395 -0.638 -4.038 1.00 0.00 H new ATOM 877 N PRO A 621 10.939 2.279 -5.060 1.00 0.00 N ATOM 878 CA PRO A 621 9.787 3.180 -5.221 1.00 0.00 C ATOM 879 C PRO A 621 10.186 4.653 -5.019 1.00 0.00 C ATOM 880 O PRO A 621 11.350 4.957 -4.725 1.00 0.00 O ATOM 881 CB PRO A 621 8.881 2.743 -4.079 1.00 0.00 C ATOM 882 CG PRO A 621 9.830 2.328 -3.016 1.00 0.00 C ATOM 883 CD PRO A 621 10.962 1.666 -3.723 1.00 0.00 C ATOM 0 HA PRO A 621 9.340 3.123 -6.213 1.00 0.00 H new ATOM 0 HB2 PRO A 621 8.237 3.556 -3.745 1.00 0.00 H new ATOM 0 HB3 PRO A 621 8.229 1.922 -4.377 1.00 0.00 H new ATOM 0 HG2 PRO A 621 10.176 3.188 -2.442 1.00 0.00 H new ATOM 0 HG3 PRO A 621 9.355 1.645 -2.312 1.00 0.00 H new ATOM 0 HD2 PRO A 621 11.911 1.844 -3.216 1.00 0.00 H new ATOM 0 HD3 PRO A 621 10.826 0.586 -3.775 1.00 0.00 H new ATOM 891 N ILE A 622 9.229 5.551 -5.146 1.00 0.00 N ATOM 892 CA ILE A 622 9.489 6.973 -4.970 1.00 0.00 C ATOM 893 C ILE A 622 8.616 7.544 -3.858 1.00 0.00 C ATOM 894 O ILE A 622 7.719 6.857 -3.343 1.00 0.00 O ATOM 895 CB ILE A 622 9.216 7.792 -6.254 1.00 0.00 C ATOM 896 CG1 ILE A 622 7.747 7.645 -6.670 1.00 0.00 C ATOM 897 CG2 ILE A 622 10.157 7.371 -7.377 1.00 0.00 C ATOM 898 CD1 ILE A 622 7.313 8.619 -7.736 1.00 0.00 C ATOM 0 H ILE A 622 8.260 5.324 -5.371 1.00 0.00 H new ATOM 0 HA ILE A 622 10.546 7.056 -4.718 1.00 0.00 H new ATOM 0 HB ILE A 622 9.408 8.845 -6.046 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.582 6.630 -7.030 1.00 0.00 H new ATOM 0 HG13 ILE A 622 7.116 7.778 -5.791 1.00 0.00 H new ATOM 0 HG21 ILE A 622 9.946 7.961 -8.269 1.00 0.00 H new ATOM 0 HG22 ILE A 622 11.189 7.537 -7.068 1.00 0.00 H new ATOM 0 HG23 ILE A 622 10.010 6.314 -7.598 1.00 0.00 H new ATOM 0 HD11 ILE A 622 6.263 8.452 -7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 622 7.444 9.638 -7.373 1.00 0.00 H new ATOM 0 HD13 ILE A 622 7.917 8.472 -8.631 1.00 0.00 H new ATOM 905 N CYS A 623 8.848 8.796 -3.535 1.00 0.00 N ATOM 906 CA CYS A 623 8.122 9.491 -2.508 1.00 0.00 C ATOM 907 C CYS A 623 7.402 10.703 -3.064 1.00 0.00 C ATOM 908 O CYS A 623 7.986 11.533 -3.760 1.00 0.00 O ATOM 909 CB CYS A 623 9.073 9.916 -1.411 1.00 0.00 C ATOM 910 SG CYS A 623 9.810 8.527 -0.506 1.00 0.00 S ATOM 0 H CYS A 623 9.561 9.366 -3.990 1.00 0.00 H new ATOM 0 HA CYS A 623 7.372 8.812 -2.102 1.00 0.00 H new ATOM 0 HB2 CYS A 623 9.870 10.518 -1.847 1.00 0.00 H new ATOM 0 HB3 CYS A 623 8.539 10.555 -0.707 1.00 0.00 H new ATOM 915 N LYS A 624 6.140 10.785 -2.769 1.00 0.00 N ATOM 916 CA LYS A 624 5.295 11.898 -3.143 1.00 0.00 C ATOM 917 C LYS A 624 4.672 12.457 -1.907 1.00 0.00 C ATOM 918 O LYS A 624 4.171 11.714 -1.096 1.00 0.00 O ATOM 919 CB LYS A 624 4.179 11.442 -4.071 1.00 0.00 C ATOM 920 CG LYS A 624 4.590 11.167 -5.504 1.00 0.00 C ATOM 921 CD LYS A 624 3.452 10.505 -6.268 1.00 0.00 C ATOM 922 CE LYS A 624 2.148 11.303 -6.214 1.00 0.00 C ATOM 923 NZ LYS A 624 2.192 12.561 -6.988 1.00 0.00 N ATOM 0 H LYS A 624 5.647 10.061 -2.246 1.00 0.00 H new ATOM 0 HA LYS A 624 5.903 12.644 -3.655 1.00 0.00 H new ATOM 0 HB2 LYS A 624 3.736 10.536 -3.659 1.00 0.00 H new ATOM 0 HB3 LYS A 624 3.400 12.204 -4.075 1.00 0.00 H new ATOM 0 HG2 LYS A 624 4.870 12.100 -5.993 1.00 0.00 H new ATOM 0 HG3 LYS A 624 5.469 10.523 -5.519 1.00 0.00 H new ATOM 0 HD2 LYS A 624 3.748 10.375 -7.309 1.00 0.00 H new ATOM 0 HD3 LYS A 624 3.279 9.509 -5.859 1.00 0.00 H new ATOM 0 HE2 LYS A 624 1.336 10.682 -6.592 1.00 0.00 H new ATOM 0 HE3 LYS A 624 1.916 11.534 -5.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 624 1.841 13.343 -6.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 624 3.172 12.757 -7.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 624 1.594 12.469 -7.834 1.00 0.00 H new ATOM 937 N GLU A 625 4.709 13.733 -1.742 1.00 0.00 N ATOM 938 CA GLU A 625 4.074 14.341 -0.603 1.00 0.00 C ATOM 939 C GLU A 625 2.632 14.569 -0.970 1.00 0.00 C ATOM 940 O GLU A 625 1.705 14.276 -0.201 1.00 0.00 O ATOM 941 CB GLU A 625 4.793 15.648 -0.250 1.00 0.00 C ATOM 942 CG GLU A 625 4.328 16.327 1.032 1.00 0.00 C ATOM 943 CD GLU A 625 3.084 17.189 0.885 1.00 0.00 C ATOM 944 OE1 GLU A 625 3.199 18.321 0.386 1.00 0.00 O ATOM 945 OE2 GLU A 625 1.988 16.768 1.291 1.00 0.00 O ATOM 0 H GLU A 625 5.170 14.385 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 625 4.126 13.704 0.280 1.00 0.00 H new ATOM 0 HB2 GLU A 625 5.860 15.444 -0.166 1.00 0.00 H new ATOM 0 HB3 GLU A 625 4.666 16.347 -1.077 1.00 0.00 H new ATOM 0 HG2 GLU A 625 4.135 15.560 1.782 1.00 0.00 H new ATOM 0 HG3 GLU A 625 5.139 16.948 1.412 1.00 0.00 H new ATOM 952 N GLN A 626 2.456 15.002 -2.185 1.00 0.00 N ATOM 953 CA GLN A 626 1.171 15.319 -2.705 1.00 0.00 C ATOM 954 C GLN A 626 0.613 14.173 -3.495 1.00 0.00 C ATOM 955 O GLN A 626 1.161 13.767 -4.521 1.00 0.00 O ATOM 956 CB GLN A 626 1.200 16.600 -3.524 1.00 0.00 C ATOM 957 CG GLN A 626 1.631 17.795 -2.708 1.00 0.00 C ATOM 958 CD GLN A 626 1.375 19.099 -3.398 1.00 0.00 C ATOM 959 OE1 GLN A 626 2.227 19.629 -4.110 1.00 0.00 O ATOM 960 NE2 GLN A 626 0.191 19.614 -3.210 1.00 0.00 N ATOM 0 H GLN A 626 3.218 15.145 -2.848 1.00 0.00 H new ATOM 0 HA GLN A 626 0.506 15.494 -1.860 1.00 0.00 H new ATOM 0 HB2 GLN A 626 1.880 16.474 -4.366 1.00 0.00 H new ATOM 0 HB3 GLN A 626 0.209 16.785 -3.939 1.00 0.00 H new ATOM 0 HG2 GLN A 626 1.104 17.786 -1.754 1.00 0.00 H new ATOM 0 HG3 GLN A 626 2.695 17.711 -2.485 1.00 0.00 H new ATOM 0 HE21 GLN A 626 -0.483 19.138 -2.610 1.00 0.00 H new ATOM 0 HE22 GLN A 626 -0.061 20.493 -3.663 1.00 0.00 H new ATOM 969 N VAL A 627 -0.443 13.639 -2.980 1.00 0.00 N ATOM 970 CA VAL A 627 -1.162 12.525 -3.564 1.00 0.00 C ATOM 971 C VAL A 627 -2.594 12.918 -3.777 1.00 0.00 C ATOM 972 O VAL A 627 -2.959 14.067 -3.528 1.00 0.00 O ATOM 973 CB VAL A 627 -1.107 11.288 -2.639 1.00 0.00 C ATOM 974 CG1 VAL A 627 0.268 10.709 -2.658 1.00 0.00 C ATOM 975 CG2 VAL A 627 -1.491 11.665 -1.213 1.00 0.00 C ATOM 0 H VAL A 627 -0.856 13.969 -2.108 1.00 0.00 H new ATOM 0 HA VAL A 627 -0.694 12.270 -4.515 1.00 0.00 H new ATOM 0 HB VAL A 627 -1.819 10.547 -3.003 1.00 0.00 H new ATOM 0 HG11 VAL A 627 0.305 9.837 -2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 627 0.524 10.412 -3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 627 0.982 11.455 -2.308 1.00 0.00 H new ATOM 0 HG21 VAL A 627 -1.446 10.780 -0.578 1.00 0.00 H new ATOM 0 HG22 VAL A 627 -0.798 12.418 -0.836 1.00 0.00 H new ATOM 0 HG23 VAL A 627 -2.504 12.067 -1.203 1.00 0.00 H new ATOM 979 N GLN A 628 -3.406 11.998 -4.211 1.00 0.00 N ATOM 980 CA GLN A 628 -4.787 12.290 -4.423 1.00 0.00 C ATOM 981 C GLN A 628 -5.594 11.802 -3.250 1.00 0.00 C ATOM 982 O GLN A 628 -5.105 11.009 -2.425 1.00 0.00 O ATOM 983 CB GLN A 628 -5.301 11.663 -5.710 1.00 0.00 C ATOM 984 CG GLN A 628 -4.574 12.124 -6.953 1.00 0.00 C ATOM 985 CD GLN A 628 -5.250 11.645 -8.205 1.00 0.00 C ATOM 986 OE1 GLN A 628 -4.962 10.561 -8.718 1.00 0.00 O ATOM 987 NE2 GLN A 628 -6.165 12.434 -8.705 1.00 0.00 N ATOM 0 H GLN A 628 -3.132 11.039 -4.424 1.00 0.00 H new ATOM 0 HA GLN A 628 -4.894 13.371 -4.517 1.00 0.00 H new ATOM 0 HB2 GLN A 628 -5.216 10.579 -5.633 1.00 0.00 H new ATOM 0 HB3 GLN A 628 -6.361 11.893 -5.816 1.00 0.00 H new ATOM 0 HG2 GLN A 628 -4.523 13.213 -6.961 1.00 0.00 H new ATOM 0 HG3 GLN A 628 -3.548 11.757 -6.931 1.00 0.00 H new ATOM 0 HE21 GLN A 628 -6.375 13.323 -8.251 1.00 0.00 H new ATOM 0 HE22 GLN A 628 -6.669 12.160 -9.549 1.00 0.00 H new ATOM 996 N SER A 629 -6.807 12.257 -3.162 1.00 0.00 N ATOM 997 CA SER A 629 -7.662 11.863 -2.093 1.00 0.00 C ATOM 998 C SER A 629 -8.626 10.784 -2.561 1.00 0.00 C ATOM 999 O SER A 629 -9.348 10.187 -1.758 1.00 0.00 O ATOM 1000 CB SER A 629 -8.388 13.059 -1.534 1.00 0.00 C ATOM 1001 OG SER A 629 -7.466 14.086 -1.181 1.00 0.00 O ATOM 0 H SER A 629 -7.226 12.907 -3.826 1.00 0.00 H new ATOM 0 HA SER A 629 -7.059 11.441 -1.289 1.00 0.00 H new ATOM 0 HB2 SER A 629 -9.097 13.437 -2.270 1.00 0.00 H new ATOM 0 HB3 SER A 629 -8.965 12.764 -0.658 1.00 0.00 H new ATOM 0 HG SER A 629 -7.955 14.855 -0.821 1.00 0.00 H new ATOM 1007 N CYS A 630 -8.670 10.597 -3.878 1.00 0.00 N ATOM 1008 CA CYS A 630 -9.356 9.475 -4.534 1.00 0.00 C ATOM 1009 C CYS A 630 -10.878 9.590 -4.505 1.00 0.00 C ATOM 1010 O CYS A 630 -11.579 8.744 -5.075 1.00 0.00 O ATOM 1011 CB CYS A 630 -8.892 8.162 -3.905 1.00 0.00 C ATOM 1012 SG CYS A 630 -7.076 8.064 -3.743 1.00 0.00 S ATOM 0 H CYS A 630 -8.221 11.233 -4.538 1.00 0.00 H new ATOM 0 HA CYS A 630 -9.083 9.500 -5.589 1.00 0.00 H new ATOM 0 HB2 CYS A 630 -9.347 8.054 -2.920 1.00 0.00 H new ATOM 0 HB3 CYS A 630 -9.244 7.328 -4.512 1.00 0.00 H new ATOM 1017 N GLY A 631 -11.372 10.658 -3.898 1.00 0.00 N ATOM 1018 CA GLY A 631 -12.789 10.847 -3.748 1.00 0.00 C ATOM 1019 C GLY A 631 -13.401 9.765 -2.889 1.00 0.00 C ATOM 1020 O GLY A 631 -12.781 9.335 -1.906 1.00 0.00 O ATOM 0 H GLY A 631 -10.801 11.405 -3.503 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -12.982 11.822 -3.301 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -13.264 10.847 -4.729 1.00 0.00 H new ATOM 1024 N PRO A 632 -14.624 9.344 -3.193 1.00 0.00 N ATOM 1025 CA PRO A 632 -15.257 8.223 -2.518 1.00 0.00 C ATOM 1026 C PRO A 632 -14.740 6.880 -3.077 1.00 0.00 C ATOM 1027 O PRO A 632 -14.223 6.819 -4.203 1.00 0.00 O ATOM 1028 CB PRO A 632 -16.740 8.415 -2.848 1.00 0.00 C ATOM 1029 CG PRO A 632 -16.747 9.094 -4.168 1.00 0.00 C ATOM 1030 CD PRO A 632 -15.512 9.954 -4.205 1.00 0.00 C ATOM 0 HA PRO A 632 -15.054 8.196 -1.448 1.00 0.00 H new ATOM 0 HB2 PRO A 632 -17.263 7.460 -2.891 1.00 0.00 H new ATOM 0 HB3 PRO A 632 -17.240 9.018 -2.090 1.00 0.00 H new ATOM 0 HG2 PRO A 632 -16.739 8.367 -4.980 1.00 0.00 H new ATOM 0 HG3 PRO A 632 -17.646 9.698 -4.290 1.00 0.00 H new ATOM 0 HD2 PRO A 632 -15.053 9.951 -5.193 1.00 0.00 H new ATOM 0 HD3 PRO A 632 -15.740 10.992 -3.963 1.00 0.00 H new ATOM 1038 N PRO A 633 -14.843 5.805 -2.297 1.00 0.00 N ATOM 1039 CA PRO A 633 -14.401 4.473 -2.717 1.00 0.00 C ATOM 1040 C PRO A 633 -15.367 3.824 -3.718 1.00 0.00 C ATOM 1041 O PRO A 633 -16.510 4.276 -3.877 1.00 0.00 O ATOM 1042 CB PRO A 633 -14.403 3.692 -1.405 1.00 0.00 C ATOM 1043 CG PRO A 633 -15.442 4.351 -0.582 1.00 0.00 C ATOM 1044 CD PRO A 633 -15.388 5.797 -0.936 1.00 0.00 C ATOM 0 HA PRO A 633 -13.438 4.499 -3.227 1.00 0.00 H new ATOM 0 HB2 PRO A 633 -14.636 2.640 -1.570 1.00 0.00 H new ATOM 0 HB3 PRO A 633 -13.428 3.731 -0.919 1.00 0.00 H new ATOM 0 HG2 PRO A 633 -16.428 3.935 -0.790 1.00 0.00 H new ATOM 0 HG3 PRO A 633 -15.251 4.202 0.481 1.00 0.00 H new ATOM 0 HD2 PRO A 633 -16.376 6.255 -0.898 1.00 0.00 H new ATOM 0 HD3 PRO A 633 -14.752 6.354 -0.247 1.00 0.00 H new ATOM 1052 N PRO A 634 -14.912 2.775 -4.419 1.00 0.00 N ATOM 1053 CA PRO A 634 -15.748 2.034 -5.354 1.00 0.00 C ATOM 1054 C PRO A 634 -16.835 1.220 -4.631 1.00 0.00 C ATOM 1055 O PRO A 634 -16.850 1.133 -3.387 1.00 0.00 O ATOM 1056 CB PRO A 634 -14.758 1.095 -6.062 1.00 0.00 C ATOM 1057 CG PRO A 634 -13.611 0.960 -5.135 1.00 0.00 C ATOM 1058 CD PRO A 634 -13.533 2.243 -4.366 1.00 0.00 C ATOM 0 HA PRO A 634 -16.283 2.695 -6.036 1.00 0.00 H new ATOM 0 HB2 PRO A 634 -15.214 0.126 -6.267 1.00 0.00 H new ATOM 0 HB3 PRO A 634 -14.442 1.508 -7.020 1.00 0.00 H new ATOM 0 HG2 PRO A 634 -13.752 0.113 -4.463 1.00 0.00 H new ATOM 0 HG3 PRO A 634 -12.687 0.780 -5.685 1.00 0.00 H new ATOM 0 HD2 PRO A 634 -13.209 2.074 -3.339 1.00 0.00 H new ATOM 0 HD3 PRO A 634 -12.820 2.935 -4.815 1.00 0.00 H new ATOM 1066 N GLU A 635 -17.724 0.635 -5.399 1.00 0.00 N ATOM 1067 CA GLU A 635 -18.808 -0.162 -4.863 1.00 0.00 C ATOM 1068 C GLU A 635 -18.319 -1.585 -4.655 1.00 0.00 C ATOM 1069 O GLU A 635 -17.312 -1.986 -5.245 1.00 0.00 O ATOM 1070 CB GLU A 635 -19.981 -0.178 -5.856 1.00 0.00 C ATOM 1071 CG GLU A 635 -19.681 -0.925 -7.156 1.00 0.00 C ATOM 1072 CD GLU A 635 -20.830 -0.922 -8.119 1.00 0.00 C ATOM 1073 OE1 GLU A 635 -21.808 -1.657 -7.898 1.00 0.00 O ATOM 1074 OE2 GLU A 635 -20.775 -0.201 -9.127 1.00 0.00 O ATOM 0 H GLU A 635 -17.718 0.697 -6.417 1.00 0.00 H new ATOM 0 HA GLU A 635 -19.139 0.265 -3.916 1.00 0.00 H new ATOM 0 HB2 GLU A 635 -20.845 -0.637 -5.376 1.00 0.00 H new ATOM 0 HB3 GLU A 635 -20.257 0.849 -6.094 1.00 0.00 H new ATOM 0 HG2 GLU A 635 -18.813 -0.472 -7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 635 -19.415 -1.956 -6.922 1.00 0.00 H new ATOM 1081 N LEU A 636 -19.009 -2.349 -3.847 1.00 0.00 N ATOM 1082 CA LEU A 636 -18.664 -3.729 -3.689 1.00 0.00 C ATOM 1083 C LEU A 636 -19.602 -4.560 -4.551 1.00 0.00 C ATOM 1084 O LEU A 636 -20.770 -4.215 -4.704 1.00 0.00 O ATOM 1085 CB LEU A 636 -18.766 -4.139 -2.237 1.00 0.00 C ATOM 1086 CG LEU A 636 -18.198 -5.502 -1.893 1.00 0.00 C ATOM 1087 CD1 LEU A 636 -16.808 -5.659 -2.481 1.00 0.00 C ATOM 1088 CD2 LEU A 636 -18.097 -5.601 -0.419 1.00 0.00 C ATOM 0 H LEU A 636 -19.807 -2.037 -3.294 1.00 0.00 H new ATOM 0 HA LEU A 636 -17.633 -3.892 -4.004 1.00 0.00 H new ATOM 0 HB2 LEU A 636 -18.255 -3.390 -1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 636 -19.817 -4.121 -1.947 1.00 0.00 H new ATOM 0 HG LEU A 636 -18.847 -6.278 -2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 636 -16.414 -6.643 -2.225 1.00 0.00 H new ATOM 0 HD12 LEU A 636 -16.858 -5.559 -3.565 1.00 0.00 H new ATOM 0 HD13 LEU A 636 -16.152 -4.889 -2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 636 -17.690 -6.575 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 636 -17.440 -4.816 -0.046 1.00 0.00 H new ATOM 0 HD23 LEU A 636 -19.087 -5.485 0.022 1.00 0.00 H new ATOM 1100 N LEU A 637 -19.102 -5.644 -5.107 1.00 0.00 N ATOM 1101 CA LEU A 637 -19.875 -6.465 -6.025 1.00 0.00 C ATOM 1102 C LEU A 637 -21.089 -7.165 -5.374 1.00 0.00 C ATOM 1103 O LEU A 637 -22.151 -7.252 -5.968 1.00 0.00 O ATOM 1104 CB LEU A 637 -18.943 -7.418 -6.813 1.00 0.00 C ATOM 1105 CG LEU A 637 -17.797 -8.102 -6.028 1.00 0.00 C ATOM 1106 CD1 LEU A 637 -18.284 -9.172 -5.083 1.00 0.00 C ATOM 1107 CD2 LEU A 637 -16.762 -8.663 -6.971 1.00 0.00 C ATOM 0 H LEU A 637 -18.154 -5.982 -4.939 1.00 0.00 H new ATOM 0 HA LEU A 637 -20.338 -5.794 -6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 637 -19.559 -8.199 -7.259 1.00 0.00 H new ATOM 0 HB3 LEU A 637 -18.500 -6.854 -7.633 1.00 0.00 H new ATOM 0 HG LEU A 637 -17.340 -7.326 -5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 637 -17.433 -9.613 -4.563 1.00 0.00 H new ATOM 0 HD12 LEU A 637 -18.966 -8.732 -4.355 1.00 0.00 H new ATOM 0 HD13 LEU A 637 -18.805 -9.946 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 637 -15.967 -9.139 -6.397 1.00 0.00 H new ATOM 0 HD22 LEU A 637 -17.228 -9.400 -7.626 1.00 0.00 H new ATOM 0 HD23 LEU A 637 -16.343 -7.857 -7.573 1.00 0.00 H new ATOM 1119 N ASN A 638 -20.929 -7.614 -4.146 1.00 0.00 N ATOM 1120 CA ASN A 638 -22.012 -8.282 -3.412 1.00 0.00 C ATOM 1121 C ASN A 638 -22.026 -7.806 -1.987 1.00 0.00 C ATOM 1122 O ASN A 638 -22.345 -8.548 -1.045 1.00 0.00 O ATOM 1123 CB ASN A 638 -21.924 -9.822 -3.483 1.00 0.00 C ATOM 1124 CG ASN A 638 -22.388 -10.394 -4.826 1.00 0.00 C ATOM 1125 OD1 ASN A 638 -23.578 -10.620 -5.029 1.00 0.00 O ATOM 1126 ND2 ASN A 638 -21.476 -10.674 -5.722 1.00 0.00 N ATOM 0 H ASN A 638 -20.057 -7.533 -3.623 1.00 0.00 H new ATOM 0 HA ASN A 638 -22.951 -8.012 -3.894 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -20.894 -10.129 -3.302 1.00 0.00 H new ATOM 0 HB3 ASN A 638 -22.530 -10.251 -2.685 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -21.747 -11.090 -6.613 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -20.494 -10.477 -5.529 1.00 0.00 H new ATOM 1133 N GLY A 639 -21.678 -6.561 -1.842 1.00 0.00 N ATOM 1134 CA GLY A 639 -21.684 -5.909 -0.588 1.00 0.00 C ATOM 1135 C GLY A 639 -21.765 -4.430 -0.788 1.00 0.00 C ATOM 1136 O GLY A 639 -22.281 -3.974 -1.810 1.00 0.00 O ATOM 0 H GLY A 639 -21.378 -5.968 -2.615 1.00 0.00 H new ATOM 0 HA2 GLY A 639 -22.531 -6.252 0.007 1.00 0.00 H new ATOM 0 HA3 GLY A 639 -20.781 -6.161 -0.032 1.00 0.00 H new ATOM 1140 N ASN A 640 -21.217 -3.690 0.127 1.00 0.00 N ATOM 1141 CA ASN A 640 -21.218 -2.244 0.051 1.00 0.00 C ATOM 1142 C ASN A 640 -20.134 -1.757 0.957 1.00 0.00 C ATOM 1143 O ASN A 640 -19.434 -2.558 1.581 1.00 0.00 O ATOM 1144 CB ASN A 640 -22.521 -1.708 0.605 1.00 0.00 C ATOM 1145 CG ASN A 640 -22.875 -0.253 0.254 1.00 0.00 C ATOM 1146 OD1 ASN A 640 -23.534 0.437 1.033 1.00 0.00 O ATOM 1147 ND2 ASN A 640 -22.444 0.218 -0.878 1.00 0.00 N ATOM 0 H ASN A 640 -20.752 -4.064 0.954 1.00 0.00 H new ATOM 0 HA ASN A 640 -21.082 -1.923 -0.982 1.00 0.00 H new ATOM 0 HB2 ASN A 640 -23.329 -2.349 0.253 1.00 0.00 H new ATOM 0 HB3 ASN A 640 -22.492 -1.799 1.691 1.00 0.00 H new ATOM 0 HD21 ASN A 640 -22.649 1.182 -1.141 1.00 0.00 H new ATOM 0 HD22 ASN A 640 -21.900 -0.376 -1.504 1.00 0.00 H new ATOM 1154 N VAL A 641 -20.018 -0.476 1.061 1.00 0.00 N ATOM 1155 CA VAL A 641 -19.113 0.130 1.963 1.00 0.00 C ATOM 1156 C VAL A 641 -19.890 0.359 3.259 1.00 0.00 C ATOM 1157 O VAL A 641 -21.000 0.888 3.222 1.00 0.00 O ATOM 1158 CB VAL A 641 -18.620 1.485 1.415 1.00 0.00 C ATOM 1159 CG1 VAL A 641 -17.487 2.039 2.245 1.00 0.00 C ATOM 1160 CG2 VAL A 641 -18.239 1.383 -0.047 1.00 0.00 C ATOM 0 H VAL A 641 -20.562 0.187 0.509 1.00 0.00 H new ATOM 0 HA VAL A 641 -18.239 -0.503 2.116 1.00 0.00 H new ATOM 0 HB VAL A 641 -19.449 2.188 1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 641 -17.165 2.994 1.830 1.00 0.00 H new ATOM 0 HG12 VAL A 641 -17.825 2.185 3.271 1.00 0.00 H new ATOM 0 HG13 VAL A 641 -16.652 1.339 2.234 1.00 0.00 H new ATOM 0 HG21 VAL A 641 -17.896 2.355 -0.402 1.00 0.00 H new ATOM 0 HG22 VAL A 641 -17.440 0.651 -0.165 1.00 0.00 H new ATOM 0 HG23 VAL A 641 -19.106 1.070 -0.628 1.00 0.00 H new ATOM 1164 N LYS A 642 -19.353 -0.057 4.379 1.00 0.00 N ATOM 1165 CA LYS A 642 -20.072 0.102 5.648 1.00 0.00 C ATOM 1166 C LYS A 642 -19.746 1.411 6.308 1.00 0.00 C ATOM 1167 O LYS A 642 -20.434 1.843 7.230 1.00 0.00 O ATOM 1168 CB LYS A 642 -19.791 -1.048 6.616 1.00 0.00 C ATOM 1169 CG LYS A 642 -18.322 -1.327 6.858 1.00 0.00 C ATOM 1170 CD LYS A 642 -18.137 -2.365 7.951 1.00 0.00 C ATOM 1171 CE LYS A 642 -18.451 -1.797 9.332 1.00 0.00 C ATOM 1172 NZ LYS A 642 -17.372 -0.934 9.830 1.00 0.00 N ATOM 0 H LYS A 642 -18.438 -0.502 4.453 1.00 0.00 H new ATOM 0 HA LYS A 642 -21.133 0.089 5.401 1.00 0.00 H new ATOM 0 HB2 LYS A 642 -20.267 -0.825 7.571 1.00 0.00 H new ATOM 0 HB3 LYS A 642 -20.260 -1.953 6.230 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -17.858 -1.678 5.936 1.00 0.00 H new ATOM 0 HG3 LYS A 642 -17.814 -0.404 7.139 1.00 0.00 H new ATOM 0 HD2 LYS A 642 -18.784 -3.220 7.754 1.00 0.00 H new ATOM 0 HD3 LYS A 642 -17.111 -2.732 7.934 1.00 0.00 H new ATOM 0 HE2 LYS A 642 -19.379 -1.228 9.287 1.00 0.00 H new ATOM 0 HE3 LYS A 642 -18.613 -2.616 10.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 -17.625 -0.569 10.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 -16.491 -1.483 9.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 -17.234 -0.138 9.175 1.00 0.00 H new ATOM 1186 N GLU A 643 -18.707 2.025 5.845 1.00 0.00 N ATOM 1187 CA GLU A 643 -18.246 3.247 6.416 1.00 0.00 C ATOM 1188 C GLU A 643 -18.904 4.443 5.742 1.00 0.00 C ATOM 1189 O GLU A 643 -19.541 4.300 4.681 1.00 0.00 O ATOM 1190 CB GLU A 643 -16.744 3.329 6.273 1.00 0.00 C ATOM 1191 CG GLU A 643 -16.028 2.217 6.980 1.00 0.00 C ATOM 1192 CD GLU A 643 -16.323 2.195 8.447 1.00 0.00 C ATOM 1193 OE1 GLU A 643 -15.631 2.888 9.214 1.00 0.00 O ATOM 1194 OE2 GLU A 643 -17.234 1.467 8.864 1.00 0.00 O ATOM 0 H GLU A 643 -18.152 1.692 5.057 1.00 0.00 H new ATOM 0 HA GLU A 643 -18.514 3.267 7.472 1.00 0.00 H new ATOM 0 HB2 GLU A 643 -16.483 3.307 5.215 1.00 0.00 H new ATOM 0 HB3 GLU A 643 -16.398 4.285 6.667 1.00 0.00 H new ATOM 0 HG2 GLU A 643 -16.317 1.263 6.539 1.00 0.00 H new ATOM 0 HG3 GLU A 643 -14.954 2.325 6.829 1.00 0.00 H new ATOM 1201 N LYS A 644 -18.733 5.608 6.329 1.00 0.00 N ATOM 1202 CA LYS A 644 -19.275 6.824 5.789 1.00 0.00 C ATOM 1203 C LYS A 644 -18.417 7.286 4.644 1.00 0.00 C ATOM 1204 O LYS A 644 -17.274 7.699 4.840 1.00 0.00 O ATOM 1205 CB LYS A 644 -19.358 7.918 6.866 1.00 0.00 C ATOM 1206 CG LYS A 644 -19.746 9.302 6.349 1.00 0.00 C ATOM 1207 CD LYS A 644 -21.109 9.304 5.674 1.00 0.00 C ATOM 1208 CE LYS A 644 -21.496 10.696 5.192 1.00 0.00 C ATOM 1209 NZ LYS A 644 -20.505 11.277 4.253 1.00 0.00 N ATOM 0 H LYS A 644 -18.212 5.733 7.197 1.00 0.00 H new ATOM 0 HA LYS A 644 -20.286 6.629 5.433 1.00 0.00 H new ATOM 0 HB2 LYS A 644 -20.083 7.611 7.620 1.00 0.00 H new ATOM 0 HB3 LYS A 644 -18.392 7.990 7.365 1.00 0.00 H new ATOM 0 HG2 LYS A 644 -19.753 10.009 7.179 1.00 0.00 H new ATOM 0 HG3 LYS A 644 -18.992 9.648 5.642 1.00 0.00 H new ATOM 0 HD2 LYS A 644 -21.098 8.616 4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 644 -21.862 8.938 6.372 1.00 0.00 H new ATOM 0 HE2 LYS A 644 -22.469 10.648 4.702 1.00 0.00 H new ATOM 0 HE3 LYS A 644 -21.604 11.356 6.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 -20.947 12.050 3.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 -19.694 11.647 4.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 -20.178 10.541 3.594 1.00 0.00 H new ATOM 1223 N THR A 645 -18.964 7.207 3.465 1.00 0.00 N ATOM 1224 CA THR A 645 -18.282 7.606 2.291 1.00 0.00 C ATOM 1225 C THR A 645 -18.146 9.118 2.242 1.00 0.00 C ATOM 1226 O THR A 645 -19.136 9.853 2.094 1.00 0.00 O ATOM 1227 CB THR A 645 -18.989 7.062 1.029 1.00 0.00 C ATOM 1228 OG1 THR A 645 -20.407 7.312 1.111 1.00 0.00 O ATOM 1229 CG2 THR A 645 -18.751 5.567 0.878 1.00 0.00 C ATOM 0 H THR A 645 -19.908 6.858 3.301 1.00 0.00 H new ATOM 0 HA THR A 645 -17.279 7.179 2.314 1.00 0.00 H new ATOM 0 HB THR A 645 -18.575 7.575 0.161 1.00 0.00 H new ATOM 0 HG1 THR A 645 -20.560 8.222 1.442 1.00 0.00 H new ATOM 0 HG21 THR A 645 -19.258 5.206 -0.017 1.00 0.00 H new ATOM 0 HG22 THR A 645 -17.681 5.376 0.791 1.00 0.00 H new ATOM 0 HG23 THR A 645 -19.143 5.046 1.752 1.00 0.00 H new ATOM 1237 N LYS A 646 -16.956 9.572 2.479 1.00 0.00 N ATOM 1238 CA LYS A 646 -16.633 10.961 2.384 1.00 0.00 C ATOM 1239 C LYS A 646 -16.228 11.284 0.960 1.00 0.00 C ATOM 1240 O LYS A 646 -15.762 10.408 0.232 1.00 0.00 O ATOM 1241 CB LYS A 646 -15.564 11.366 3.438 1.00 0.00 C ATOM 1242 CG LYS A 646 -14.368 10.447 3.554 1.00 0.00 C ATOM 1243 CD LYS A 646 -13.493 10.822 4.744 1.00 0.00 C ATOM 1244 CE LYS A 646 -12.346 9.841 4.912 1.00 0.00 C ATOM 1245 NZ LYS A 646 -11.484 10.150 6.079 1.00 0.00 N ATOM 0 H LYS A 646 -16.170 8.980 2.748 1.00 0.00 H new ATOM 0 HA LYS A 646 -17.512 11.562 2.620 1.00 0.00 H new ATOM 0 HB2 LYS A 646 -15.206 12.367 3.198 1.00 0.00 H new ATOM 0 HB3 LYS A 646 -16.048 11.426 4.413 1.00 0.00 H new ATOM 0 HG2 LYS A 646 -14.708 9.417 3.660 1.00 0.00 H new ATOM 0 HG3 LYS A 646 -13.779 10.496 2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 646 -13.097 11.828 4.605 1.00 0.00 H new ATOM 0 HD3 LYS A 646 -14.096 10.839 5.652 1.00 0.00 H new ATOM 0 HE2 LYS A 646 -12.750 8.834 5.022 1.00 0.00 H new ATOM 0 HE3 LYS A 646 -11.738 9.844 4.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 -10.750 9.419 6.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 -11.033 11.077 5.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 -12.063 10.171 6.943 1.00 0.00 H new ATOM 1259 N GLU A 647 -16.422 12.525 0.568 1.00 0.00 N ATOM 1260 CA GLU A 647 -16.164 12.994 -0.814 1.00 0.00 C ATOM 1261 C GLU A 647 -14.675 12.988 -1.140 1.00 0.00 C ATOM 1262 O GLU A 647 -14.264 13.149 -2.300 1.00 0.00 O ATOM 1263 CB GLU A 647 -16.652 14.436 -0.953 1.00 0.00 C ATOM 1264 CG GLU A 647 -15.918 15.382 -0.004 1.00 0.00 C ATOM 1265 CD GLU A 647 -16.206 16.822 -0.233 1.00 0.00 C ATOM 1266 OE1 GLU A 647 -15.667 17.389 -1.191 1.00 0.00 O ATOM 1267 OE2 GLU A 647 -16.936 17.428 0.568 1.00 0.00 O ATOM 0 H GLU A 647 -16.765 13.257 1.190 1.00 0.00 H new ATOM 0 HA GLU A 647 -16.687 12.320 -1.493 1.00 0.00 H new ATOM 0 HB2 GLU A 647 -16.509 14.770 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 647 -17.722 14.478 -0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 647 -16.185 15.129 1.022 1.00 0.00 H new ATOM 0 HG3 GLU A 647 -14.845 15.218 -0.104 1.00 0.00 H new ATOM 1274 N GLU A 648 -13.896 12.834 -0.126 1.00 0.00 N ATOM 1275 CA GLU A 648 -12.499 12.974 -0.198 1.00 0.00 C ATOM 1276 C GLU A 648 -11.895 12.083 0.858 1.00 0.00 C ATOM 1277 O GLU A 648 -11.978 12.382 2.047 1.00 0.00 O ATOM 1278 CB GLU A 648 -12.215 14.449 0.063 1.00 0.00 C ATOM 1279 CG GLU A 648 -10.789 14.889 0.064 1.00 0.00 C ATOM 1280 CD GLU A 648 -10.710 16.375 0.232 1.00 0.00 C ATOM 1281 OE1 GLU A 648 -10.674 16.862 1.382 1.00 0.00 O ATOM 1282 OE2 GLU A 648 -10.742 17.088 -0.776 1.00 0.00 O ATOM 0 H GLU A 648 -14.236 12.599 0.807 1.00 0.00 H new ATOM 0 HA GLU A 648 -12.075 12.685 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 648 -12.746 15.032 -0.690 1.00 0.00 H new ATOM 0 HB3 GLU A 648 -12.647 14.708 1.029 1.00 0.00 H new ATOM 0 HG2 GLU A 648 -10.248 14.395 0.871 1.00 0.00 H new ATOM 0 HG3 GLU A 648 -10.309 14.594 -0.869 1.00 0.00 H new ATOM 1289 N TYR A 649 -11.387 10.957 0.444 1.00 0.00 N ATOM 1290 CA TYR A 649 -10.814 10.018 1.370 1.00 0.00 C ATOM 1291 C TYR A 649 -9.390 10.341 1.751 1.00 0.00 C ATOM 1292 O TYR A 649 -9.126 10.757 2.878 1.00 0.00 O ATOM 1293 CB TYR A 649 -10.980 8.582 0.890 1.00 0.00 C ATOM 1294 CG TYR A 649 -12.171 7.928 1.516 1.00 0.00 C ATOM 1295 CD1 TYR A 649 -13.458 8.155 1.071 1.00 0.00 C ATOM 1296 CD2 TYR A 649 -11.992 7.110 2.592 1.00 0.00 C ATOM 1297 CE1 TYR A 649 -14.533 7.562 1.705 1.00 0.00 C ATOM 1298 CE2 TYR A 649 -13.032 6.516 3.229 1.00 0.00 C ATOM 1299 CZ TYR A 649 -14.311 6.740 2.786 1.00 0.00 C ATOM 1300 OH TYR A 649 -15.365 6.142 3.412 1.00 0.00 O ATOM 0 H TYR A 649 -11.357 10.665 -0.533 1.00 0.00 H new ATOM 0 HA TYR A 649 -11.384 10.117 2.294 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -11.085 8.570 -0.195 1.00 0.00 H new ATOM 0 HB3 TYR A 649 -10.083 8.011 1.129 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -13.626 8.800 0.222 1.00 0.00 H new ATOM 0 HD2 TYR A 649 -10.989 6.929 2.949 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -15.539 7.742 1.355 1.00 0.00 H new ATOM 0 HE2 TYR A 649 -12.855 5.872 4.078 1.00 0.00 H new ATOM 0 HH TYR A 649 -15.870 6.814 3.916 1.00 0.00 H new ATOM 1310 N GLY A 650 -8.498 10.168 0.838 1.00 0.00 N ATOM 1311 CA GLY A 650 -7.122 10.431 1.097 1.00 0.00 C ATOM 1312 C GLY A 650 -6.300 9.201 0.888 1.00 0.00 C ATOM 1313 O GLY A 650 -6.836 8.087 0.784 1.00 0.00 O ATOM 0 H GLY A 650 -8.699 9.841 -0.107 1.00 0.00 H new ATOM 0 HA2 GLY A 650 -6.769 11.226 0.440 1.00 0.00 H new ATOM 0 HA3 GLY A 650 -7.001 10.786 2.121 1.00 0.00 H new ATOM 1317 N HIS A 651 -5.019 9.375 0.810 1.00 0.00 N ATOM 1318 CA HIS A 651 -4.133 8.268 0.636 1.00 0.00 C ATOM 1319 C HIS A 651 -4.008 7.471 1.942 1.00 0.00 C ATOM 1320 O HIS A 651 -4.020 8.049 3.034 1.00 0.00 O ATOM 1321 CB HIS A 651 -2.765 8.745 0.138 1.00 0.00 C ATOM 1322 CG HIS A 651 -1.778 7.648 -0.021 1.00 0.00 C ATOM 1323 ND1 HIS A 651 -1.830 6.741 -1.042 1.00 0.00 N ATOM 1324 CD2 HIS A 651 -0.760 7.275 0.752 1.00 0.00 C ATOM 1325 CE1 HIS A 651 -0.876 5.852 -0.881 1.00 0.00 C ATOM 1326 NE2 HIS A 651 -0.216 6.154 0.195 1.00 0.00 N ATOM 0 H HIS A 651 -4.559 10.284 0.865 1.00 0.00 H new ATOM 0 HA HIS A 651 -4.548 7.604 -0.122 1.00 0.00 H new ATOM 0 HB2 HIS A 651 -2.892 9.251 -0.819 1.00 0.00 H new ATOM 0 HB3 HIS A 651 -2.369 9.481 0.838 1.00 0.00 H new ATOM 0 HD2 HIS A 651 -0.426 7.768 1.653 1.00 0.00 H new ATOM 0 HE1 HIS A 651 -0.675 5.014 -1.532 1.00 0.00 H new ATOM 0 HE2 HIS A 651 0.581 5.637 0.565 1.00 0.00 H new ATOM 1335 N SER A 652 -3.930 6.144 1.804 1.00 0.00 N ATOM 1336 CA SER A 652 -3.775 5.200 2.925 1.00 0.00 C ATOM 1337 C SER A 652 -5.045 5.084 3.768 1.00 0.00 C ATOM 1338 O SER A 652 -5.078 4.386 4.792 1.00 0.00 O ATOM 1339 CB SER A 652 -2.545 5.520 3.784 1.00 0.00 C ATOM 1340 OG SER A 652 -1.375 5.470 2.982 1.00 0.00 O ATOM 0 H SER A 652 -3.973 5.683 0.895 1.00 0.00 H new ATOM 0 HA SER A 652 -3.605 4.219 2.480 1.00 0.00 H new ATOM 0 HB2 SER A 652 -2.649 6.509 4.231 1.00 0.00 H new ATOM 0 HB3 SER A 652 -2.466 4.806 4.604 1.00 0.00 H new ATOM 0 HG SER A 652 -0.591 5.677 3.533 1.00 0.00 H new ATOM 1346 N GLU A 653 -6.091 5.737 3.313 1.00 0.00 N ATOM 1347 CA GLU A 653 -7.359 5.682 3.950 1.00 0.00 C ATOM 1348 C GLU A 653 -8.054 4.439 3.443 1.00 0.00 C ATOM 1349 O GLU A 653 -8.277 4.300 2.237 1.00 0.00 O ATOM 1350 CB GLU A 653 -8.154 6.935 3.614 1.00 0.00 C ATOM 1351 CG GLU A 653 -9.361 7.138 4.489 1.00 0.00 C ATOM 1352 CD GLU A 653 -9.017 7.426 5.916 1.00 0.00 C ATOM 1353 OE1 GLU A 653 -8.549 6.512 6.625 1.00 0.00 O ATOM 1354 OE2 GLU A 653 -9.268 8.561 6.371 1.00 0.00 O ATOM 0 H GLU A 653 -6.070 6.324 2.479 1.00 0.00 H new ATOM 0 HA GLU A 653 -7.263 5.639 5.035 1.00 0.00 H new ATOM 0 HB2 GLU A 653 -7.501 7.803 3.703 1.00 0.00 H new ATOM 0 HB3 GLU A 653 -8.475 6.883 2.574 1.00 0.00 H new ATOM 0 HG2 GLU A 653 -9.954 7.962 4.092 1.00 0.00 H new ATOM 0 HG3 GLU A 653 -9.986 6.246 4.446 1.00 0.00 H new ATOM 1361 N VAL A 654 -8.295 3.508 4.334 1.00 0.00 N ATOM 1362 CA VAL A 654 -8.911 2.257 3.971 1.00 0.00 C ATOM 1363 C VAL A 654 -10.394 2.392 4.092 1.00 0.00 C ATOM 1364 O VAL A 654 -10.900 3.227 4.871 1.00 0.00 O ATOM 1365 CB VAL A 654 -8.421 1.096 4.862 1.00 0.00 C ATOM 1366 CG1 VAL A 654 -9.096 0.959 6.200 1.00 0.00 C ATOM 1367 CG2 VAL A 654 -8.308 -0.164 4.138 1.00 0.00 C ATOM 0 H VAL A 654 -8.071 3.596 5.325 1.00 0.00 H new ATOM 0 HA VAL A 654 -8.631 2.024 2.944 1.00 0.00 H new ATOM 0 HB VAL A 654 -7.409 1.395 5.134 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -8.671 0.111 6.737 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -8.943 1.869 6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -10.164 0.797 6.054 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -7.959 -0.943 4.816 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -9.283 -0.442 3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -7.597 -0.051 3.319 1.00 0.00 H new ATOM 1371 N VAL A 655 -11.085 1.626 3.327 1.00 0.00 N ATOM 1372 CA VAL A 655 -12.496 1.617 3.364 1.00 0.00 C ATOM 1373 C VAL A 655 -13.013 0.239 3.701 1.00 0.00 C ATOM 1374 O VAL A 655 -12.806 -0.710 2.961 1.00 0.00 O ATOM 1375 CB VAL A 655 -13.129 2.163 2.052 1.00 0.00 C ATOM 1376 CG1 VAL A 655 -12.802 3.601 1.877 1.00 0.00 C ATOM 1377 CG2 VAL A 655 -12.647 1.410 0.833 1.00 0.00 C ATOM 0 H VAL A 655 -10.678 0.981 2.650 1.00 0.00 H new ATOM 0 HA VAL A 655 -12.803 2.299 4.157 1.00 0.00 H new ATOM 0 HB VAL A 655 -14.207 2.027 2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 655 -13.253 3.967 0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 655 -13.193 4.168 2.722 1.00 0.00 H new ATOM 0 HG13 VAL A 655 -11.720 3.725 1.826 1.00 0.00 H new ATOM 0 HG21 VAL A 655 -13.115 1.825 -0.060 1.00 0.00 H new ATOM 0 HG22 VAL A 655 -11.564 1.504 0.752 1.00 0.00 H new ATOM 0 HG23 VAL A 655 -12.914 0.357 0.926 1.00 0.00 H new ATOM 1381 N GLU A 656 -13.592 0.130 4.861 1.00 0.00 N ATOM 1382 CA GLU A 656 -14.225 -1.095 5.277 1.00 0.00 C ATOM 1383 C GLU A 656 -15.485 -1.358 4.471 1.00 0.00 C ATOM 1384 O GLU A 656 -16.435 -0.548 4.455 1.00 0.00 O ATOM 1385 CB GLU A 656 -14.596 -1.068 6.753 1.00 0.00 C ATOM 1386 CG GLU A 656 -13.491 -1.443 7.700 1.00 0.00 C ATOM 1387 CD GLU A 656 -13.870 -1.216 9.141 1.00 0.00 C ATOM 1388 OE1 GLU A 656 -14.883 -1.769 9.603 1.00 0.00 O ATOM 1389 OE2 GLU A 656 -13.140 -0.485 9.858 1.00 0.00 O ATOM 0 H GLU A 656 -13.641 0.884 5.547 1.00 0.00 H new ATOM 0 HA GLU A 656 -13.500 -1.890 5.105 1.00 0.00 H new ATOM 0 HB2 GLU A 656 -14.944 -0.066 7.005 1.00 0.00 H new ATOM 0 HB3 GLU A 656 -15.434 -1.746 6.912 1.00 0.00 H new ATOM 0 HG2 GLU A 656 -13.232 -2.492 7.556 1.00 0.00 H new ATOM 0 HG3 GLU A 656 -12.601 -0.860 7.465 1.00 0.00 H new ATOM 1396 N TYR A 657 -15.482 -2.441 3.805 1.00 0.00 N ATOM 1397 CA TYR A 657 -16.622 -2.916 3.101 1.00 0.00 C ATOM 1398 C TYR A 657 -17.318 -3.973 3.927 1.00 0.00 C ATOM 1399 O TYR A 657 -16.828 -4.367 4.987 1.00 0.00 O ATOM 1400 CB TYR A 657 -16.220 -3.542 1.782 1.00 0.00 C ATOM 1401 CG TYR A 657 -15.771 -2.593 0.715 1.00 0.00 C ATOM 1402 CD1 TYR A 657 -16.689 -2.046 -0.152 1.00 0.00 C ATOM 1403 CD2 TYR A 657 -14.440 -2.260 0.554 1.00 0.00 C ATOM 1404 CE1 TYR A 657 -16.306 -1.190 -1.143 1.00 0.00 C ATOM 1405 CE2 TYR A 657 -14.046 -1.403 -0.445 1.00 0.00 C ATOM 1406 CZ TYR A 657 -14.985 -0.869 -1.287 1.00 0.00 C ATOM 1407 OH TYR A 657 -14.604 -0.029 -2.285 1.00 0.00 O ATOM 0 H TYR A 657 -14.666 -3.048 3.726 1.00 0.00 H new ATOM 0 HA TYR A 657 -17.282 -2.069 2.915 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -15.415 -4.253 1.970 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -17.067 -4.113 1.400 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -17.733 -2.299 -0.046 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -13.701 -2.678 1.221 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -17.043 -0.768 -1.810 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -13.003 -1.152 -0.566 1.00 0.00 H new ATOM 0 HH TYR A 657 -15.399 0.335 -2.728 1.00 0.00 H new ATOM 1417 N TYR A 658 -18.449 -4.405 3.463 1.00 0.00 N ATOM 1418 CA TYR A 658 -19.157 -5.496 4.059 1.00 0.00 C ATOM 1419 C TYR A 658 -19.932 -6.160 2.960 1.00 0.00 C ATOM 1420 O TYR A 658 -20.419 -5.477 2.062 1.00 0.00 O ATOM 1421 CB TYR A 658 -20.126 -5.024 5.181 1.00 0.00 C ATOM 1422 CG TYR A 658 -21.404 -4.335 4.704 1.00 0.00 C ATOM 1423 CD1 TYR A 658 -21.411 -3.011 4.317 1.00 0.00 C ATOM 1424 CD2 TYR A 658 -22.606 -5.036 4.642 1.00 0.00 C ATOM 1425 CE1 TYR A 658 -22.559 -2.399 3.891 1.00 0.00 C ATOM 1426 CE2 TYR A 658 -23.767 -4.429 4.211 1.00 0.00 C ATOM 1427 CZ TYR A 658 -23.737 -3.107 3.837 1.00 0.00 C ATOM 1428 OH TYR A 658 -24.897 -2.486 3.396 1.00 0.00 O ATOM 0 H TYR A 658 -18.913 -4.004 2.648 1.00 0.00 H new ATOM 0 HA TYR A 658 -18.450 -6.180 4.529 1.00 0.00 H new ATOM 0 HB2 TYR A 658 -20.404 -5.889 5.783 1.00 0.00 H new ATOM 0 HB3 TYR A 658 -19.588 -4.339 5.836 1.00 0.00 H new ATOM 0 HD1 TYR A 658 -20.492 -2.445 4.351 1.00 0.00 H new ATOM 0 HD2 TYR A 658 -22.629 -6.075 4.937 1.00 0.00 H new ATOM 0 HE1 TYR A 658 -22.540 -1.360 3.597 1.00 0.00 H new ATOM 0 HE2 TYR A 658 -24.691 -4.987 4.168 1.00 0.00 H new ATOM 0 HH TYR A 658 -25.639 -3.126 3.418 1.00 0.00 H new ATOM 1438 N CYS A 659 -19.981 -7.437 2.967 1.00 0.00 N ATOM 1439 CA CYS A 659 -20.824 -8.148 2.046 1.00 0.00 C ATOM 1440 C CYS A 659 -22.021 -8.675 2.739 1.00 0.00 C ATOM 1441 O CYS A 659 -22.052 -8.768 3.981 1.00 0.00 O ATOM 1442 CB CYS A 659 -20.090 -9.248 1.301 1.00 0.00 C ATOM 1443 SG CYS A 659 -19.041 -8.627 -0.034 1.00 0.00 S ATOM 0 H CYS A 659 -19.447 -8.030 3.602 1.00 0.00 H new ATOM 0 HA CYS A 659 -21.144 -7.431 1.290 1.00 0.00 H new ATOM 0 HB2 CYS A 659 -19.476 -9.808 2.006 1.00 0.00 H new ATOM 0 HB3 CYS A 659 -20.818 -9.946 0.888 1.00 0.00 H new ATOM 1448 N ASN A 660 -23.003 -8.992 1.946 1.00 0.00 N ATOM 1449 CA ASN A 660 -24.283 -9.483 2.400 1.00 0.00 C ATOM 1450 C ASN A 660 -24.131 -10.741 3.250 1.00 0.00 C ATOM 1451 O ASN A 660 -23.190 -11.538 3.052 1.00 0.00 O ATOM 1452 CB ASN A 660 -25.175 -9.734 1.188 1.00 0.00 C ATOM 1453 CG ASN A 660 -25.403 -8.460 0.385 1.00 0.00 C ATOM 1454 OD1 ASN A 660 -25.521 -7.376 0.937 1.00 0.00 O ATOM 1455 ND2 ASN A 660 -25.382 -8.567 -0.899 1.00 0.00 N ATOM 0 H ASN A 660 -22.938 -8.915 0.931 1.00 0.00 H new ATOM 0 HA ASN A 660 -24.748 -8.732 3.039 1.00 0.00 H new ATOM 0 HB2 ASN A 660 -24.718 -10.490 0.550 1.00 0.00 H new ATOM 0 HB3 ASN A 660 -26.134 -10.133 1.518 1.00 0.00 H new ATOM 0 HD21 ASN A 660 -25.465 -7.734 -1.482 1.00 0.00 H new ATOM 0 HD22 ASN A 660 -25.282 -9.485 -1.333 1.00 0.00 H new ATOM 1462 N PRO A 661 -25.081 -10.963 4.174 1.00 0.00 N ATOM 1463 CA PRO A 661 -25.063 -12.083 5.160 1.00 0.00 C ATOM 1464 C PRO A 661 -25.318 -13.462 4.528 1.00 0.00 C ATOM 1465 O PRO A 661 -25.891 -14.348 5.143 1.00 0.00 O ATOM 1466 CB PRO A 661 -26.222 -11.716 6.089 1.00 0.00 C ATOM 1467 CG PRO A 661 -27.149 -10.936 5.238 1.00 0.00 C ATOM 1468 CD PRO A 661 -26.282 -10.121 4.347 1.00 0.00 C ATOM 0 HA PRO A 661 -24.091 -12.181 5.643 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -26.706 -12.606 6.490 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -25.877 -11.130 6.941 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -27.798 -11.594 4.659 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -27.797 -10.301 5.843 1.00 0.00 H new ATOM 0 HD2 PRO A 661 -26.768 -9.914 3.394 1.00 0.00 H new ATOM 0 HD3 PRO A 661 -26.037 -9.158 4.796 1.00 0.00 H new ATOM 1476 N ARG A 662 -24.858 -13.627 3.325 1.00 0.00 N ATOM 1477 CA ARG A 662 -25.021 -14.846 2.553 1.00 0.00 C ATOM 1478 C ARG A 662 -23.705 -15.178 1.868 1.00 0.00 C ATOM 1479 O ARG A 662 -23.590 -16.159 1.141 1.00 0.00 O ATOM 1480 CB ARG A 662 -26.077 -14.593 1.484 1.00 0.00 C ATOM 1481 CG ARG A 662 -27.455 -14.277 2.029 1.00 0.00 C ATOM 1482 CD ARG A 662 -28.156 -13.264 1.157 1.00 0.00 C ATOM 1483 NE ARG A 662 -28.150 -13.620 -0.266 1.00 0.00 N ATOM 1484 CZ ARG A 662 -28.175 -12.727 -1.264 1.00 0.00 C ATOM 1485 NH1 ARG A 662 -28.345 -11.426 -0.994 1.00 0.00 N ATOM 1486 NH2 ARG A 662 -28.049 -13.134 -2.525 1.00 0.00 N ATOM 0 H ARG A 662 -24.341 -12.901 2.828 1.00 0.00 H new ATOM 0 HA ARG A 662 -25.319 -15.669 3.202 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -25.749 -13.765 0.855 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -26.146 -15.472 0.843 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -28.048 -15.190 2.083 1.00 0.00 H new ATOM 0 HG3 ARG A 662 -27.370 -13.892 3.045 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -29.187 -13.157 1.493 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -27.677 -12.293 1.283 1.00 0.00 H new ATOM 0 HE ARG A 662 -28.125 -14.610 -0.511 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -28.455 -11.116 -0.029 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -28.364 -10.746 -1.754 1.00 0.00 H new ATOM 0 HH21 ARG A 662 -27.933 -14.126 -2.732 1.00 0.00 H new ATOM 0 HH22 ARG A 662 -28.068 -12.454 -3.285 1.00 0.00 H new ATOM 1500 N PHE A 663 -22.711 -14.351 2.104 1.00 0.00 N ATOM 1501 CA PHE A 663 -21.458 -14.474 1.418 1.00 0.00 C ATOM 1502 C PHE A 663 -20.313 -14.530 2.399 1.00 0.00 C ATOM 1503 O PHE A 663 -20.448 -14.116 3.557 1.00 0.00 O ATOM 1504 CB PHE A 663 -21.224 -13.282 0.457 1.00 0.00 C ATOM 1505 CG PHE A 663 -22.257 -13.095 -0.631 1.00 0.00 C ATOM 1506 CD1 PHE A 663 -23.498 -12.528 -0.360 1.00 0.00 C ATOM 1507 CD2 PHE A 663 -21.977 -13.470 -1.923 1.00 0.00 C ATOM 1508 CE1 PHE A 663 -24.427 -12.355 -1.362 1.00 0.00 C ATOM 1509 CE2 PHE A 663 -22.898 -13.301 -2.927 1.00 0.00 C ATOM 1510 CZ PHE A 663 -24.129 -12.744 -2.648 1.00 0.00 C ATOM 0 H PHE A 663 -22.754 -13.582 2.773 1.00 0.00 H new ATOM 0 HA PHE A 663 -21.499 -15.399 0.843 1.00 0.00 H new ATOM 0 HB2 PHE A 663 -21.179 -12.368 1.049 1.00 0.00 H new ATOM 0 HB3 PHE A 663 -20.248 -13.406 -0.013 1.00 0.00 H new ATOM 0 HD1 PHE A 663 -23.736 -12.220 0.647 1.00 0.00 H new ATOM 0 HD2 PHE A 663 -21.016 -13.905 -2.153 1.00 0.00 H new ATOM 0 HE1 PHE A 663 -25.388 -11.915 -1.139 1.00 0.00 H new ATOM 0 HE2 PHE A 663 -22.659 -13.604 -3.936 1.00 0.00 H new ATOM 0 HZ PHE A 663 -24.856 -12.614 -3.436 1.00 0.00 H new ATOM 1520 N LEU A 664 -19.220 -15.053 1.931 1.00 0.00 N ATOM 1521 CA LEU A 664 -17.976 -15.099 2.634 1.00 0.00 C ATOM 1522 C LEU A 664 -17.070 -14.107 1.963 1.00 0.00 C ATOM 1523 O LEU A 664 -17.054 -14.022 0.719 1.00 0.00 O ATOM 1524 CB LEU A 664 -17.363 -16.491 2.536 1.00 0.00 C ATOM 1525 CG LEU A 664 -18.232 -17.615 3.060 1.00 0.00 C ATOM 1526 CD1 LEU A 664 -17.567 -18.960 2.844 1.00 0.00 C ATOM 1527 CD2 LEU A 664 -18.560 -17.409 4.531 1.00 0.00 C ATOM 0 H LEU A 664 -19.170 -15.479 1.005 1.00 0.00 H new ATOM 0 HA LEU A 664 -18.118 -14.867 3.689 1.00 0.00 H new ATOM 0 HB2 LEU A 664 -17.125 -16.693 1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 664 -16.421 -16.495 3.084 1.00 0.00 H new ATOM 0 HG LEU A 664 -19.166 -17.604 2.499 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -18.211 -19.750 3.229 1.00 0.00 H new ATOM 0 HD12 LEU A 664 -17.399 -19.116 1.778 1.00 0.00 H new ATOM 0 HD13 LEU A 664 -16.612 -18.982 3.369 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -19.185 -18.230 4.883 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -17.637 -17.382 5.109 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -19.094 -16.467 4.656 1.00 0.00 H new ATOM 1539 N MET A 665 -16.368 -13.349 2.730 1.00 0.00 N ATOM 1540 CA MET A 665 -15.517 -12.334 2.182 1.00 0.00 C ATOM 1541 C MET A 665 -14.106 -12.887 2.055 1.00 0.00 C ATOM 1542 O MET A 665 -13.452 -13.191 3.065 1.00 0.00 O ATOM 1543 CB MET A 665 -15.577 -11.102 3.081 1.00 0.00 C ATOM 1544 CG MET A 665 -15.421 -9.799 2.345 1.00 0.00 C ATOM 1545 SD MET A 665 -15.959 -8.386 3.315 1.00 0.00 S ATOM 1546 CE MET A 665 -16.170 -7.190 2.003 1.00 0.00 C ATOM 0 H MET A 665 -16.362 -13.408 3.748 1.00 0.00 H new ATOM 0 HA MET A 665 -15.848 -12.037 1.187 1.00 0.00 H new ATOM 0 HB2 MET A 665 -16.530 -11.097 3.610 1.00 0.00 H new ATOM 0 HB3 MET A 665 -14.794 -11.177 3.836 1.00 0.00 H new ATOM 0 HG2 MET A 665 -14.375 -9.667 2.067 1.00 0.00 H new ATOM 0 HG3 MET A 665 -15.995 -9.839 1.419 1.00 0.00 H new ATOM 0 HE1 MET A 665 -15.416 -6.409 2.098 1.00 0.00 H new ATOM 0 HE2 MET A 665 -16.060 -7.685 1.038 1.00 0.00 H new ATOM 0 HE3 MET A 665 -17.163 -6.746 2.072 1.00 0.00 H new ATOM 1556 N LYS A 666 -13.649 -13.032 0.826 1.00 0.00 N ATOM 1557 CA LYS A 666 -12.368 -13.662 0.547 1.00 0.00 C ATOM 1558 C LYS A 666 -11.183 -12.744 0.797 1.00 0.00 C ATOM 1559 O LYS A 666 -10.349 -13.030 1.660 1.00 0.00 O ATOM 1560 CB LYS A 666 -12.341 -14.237 -0.880 1.00 0.00 C ATOM 1561 CG LYS A 666 -10.977 -14.757 -1.328 1.00 0.00 C ATOM 1562 CD LYS A 666 -11.070 -15.535 -2.628 1.00 0.00 C ATOM 1563 CE LYS A 666 -11.807 -16.840 -2.409 1.00 0.00 C ATOM 1564 NZ LYS A 666 -11.905 -17.649 -3.628 1.00 0.00 N ATOM 0 H LYS A 666 -14.151 -12.719 -0.005 1.00 0.00 H new ATOM 0 HA LYS A 666 -12.265 -14.484 1.255 1.00 0.00 H new ATOM 0 HB2 LYS A 666 -13.064 -15.050 -0.944 1.00 0.00 H new ATOM 0 HB3 LYS A 666 -12.667 -13.464 -1.576 1.00 0.00 H new ATOM 0 HG2 LYS A 666 -10.292 -13.919 -1.454 1.00 0.00 H new ATOM 0 HG3 LYS A 666 -10.558 -15.396 -0.551 1.00 0.00 H new ATOM 0 HD2 LYS A 666 -11.587 -14.939 -3.380 1.00 0.00 H new ATOM 0 HD3 LYS A 666 -10.070 -15.735 -3.012 1.00 0.00 H new ATOM 0 HE2 LYS A 666 -11.296 -17.415 -1.637 1.00 0.00 H new ATOM 0 HE3 LYS A 666 -12.810 -16.628 -2.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 -12.418 -18.529 -3.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 -12.416 -17.115 -4.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 -10.950 -17.878 -3.971 1.00 0.00 H new ATOM 1578 N GLY A 667 -11.103 -11.665 0.062 1.00 0.00 N ATOM 1579 CA GLY A 667 -9.982 -10.769 0.192 1.00 0.00 C ATOM 1580 C GLY A 667 -10.154 -9.772 1.314 1.00 0.00 C ATOM 1581 O GLY A 667 -11.098 -9.891 2.118 1.00 0.00 O ATOM 0 H GLY A 667 -11.798 -11.386 -0.631 1.00 0.00 H new ATOM 0 HA2 GLY A 667 -9.077 -11.351 0.365 1.00 0.00 H new ATOM 0 HA3 GLY A 667 -9.842 -10.232 -0.746 1.00 0.00 H new ATOM 1585 N PRO A 668 -9.268 -8.776 1.396 1.00 0.00 N ATOM 1586 CA PRO A 668 -9.309 -7.758 2.443 1.00 0.00 C ATOM 1587 C PRO A 668 -10.590 -6.936 2.374 1.00 0.00 C ATOM 1588 O PRO A 668 -10.889 -6.336 1.353 1.00 0.00 O ATOM 1589 CB PRO A 668 -8.093 -6.864 2.139 1.00 0.00 C ATOM 1590 CG PRO A 668 -7.760 -7.128 0.712 1.00 0.00 C ATOM 1591 CD PRO A 668 -8.151 -8.550 0.452 1.00 0.00 C ATOM 0 HA PRO A 668 -9.285 -8.198 3.440 1.00 0.00 H new ATOM 0 HB2 PRO A 668 -8.328 -5.812 2.300 1.00 0.00 H new ATOM 0 HB3 PRO A 668 -7.253 -7.107 2.790 1.00 0.00 H new ATOM 0 HG2 PRO A 668 -8.300 -6.448 0.053 1.00 0.00 H new ATOM 0 HG3 PRO A 668 -6.697 -6.975 0.525 1.00 0.00 H new ATOM 0 HD2 PRO A 668 -8.462 -8.699 -0.582 1.00 0.00 H new ATOM 0 HD3 PRO A 668 -7.323 -9.235 0.637 1.00 0.00 H new ATOM 1599 N ASN A 669 -11.336 -6.904 3.476 1.00 0.00 N ATOM 1600 CA ASN A 669 -12.604 -6.159 3.563 1.00 0.00 C ATOM 1601 C ASN A 669 -12.388 -4.682 3.412 1.00 0.00 C ATOM 1602 O ASN A 669 -13.314 -3.943 3.161 1.00 0.00 O ATOM 1603 CB ASN A 669 -13.334 -6.394 4.897 1.00 0.00 C ATOM 1604 CG ASN A 669 -12.470 -6.138 6.139 1.00 0.00 C ATOM 1605 OD1 ASN A 669 -11.259 -6.399 6.157 1.00 0.00 O ATOM 1606 ND2 ASN A 669 -13.060 -5.602 7.157 1.00 0.00 N ATOM 0 H ASN A 669 -11.085 -7.391 4.336 1.00 0.00 H new ATOM 0 HA ASN A 669 -13.217 -6.536 2.745 1.00 0.00 H new ATOM 0 HB2 ASN A 669 -14.210 -5.747 4.938 1.00 0.00 H new ATOM 0 HB3 ASN A 669 -13.695 -7.422 4.925 1.00 0.00 H new ATOM 0 HD21 ASN A 669 -12.527 -5.385 7.999 1.00 0.00 H new ATOM 0 HD22 ASN A 669 -14.058 -5.396 7.118 1.00 0.00 H new ATOM 1613 N LYS A 670 -11.185 -4.259 3.593 1.00 0.00 N ATOM 1614 CA LYS A 670 -10.869 -2.891 3.484 1.00 0.00 C ATOM 1615 C LYS A 670 -9.794 -2.753 2.419 1.00 0.00 C ATOM 1616 O LYS A 670 -9.014 -3.684 2.213 1.00 0.00 O ATOM 1617 CB LYS A 670 -10.347 -2.353 4.819 1.00 0.00 C ATOM 1618 CG LYS A 670 -10.990 -2.898 6.061 1.00 0.00 C ATOM 1619 CD LYS A 670 -9.960 -3.430 7.038 1.00 0.00 C ATOM 1620 CE LYS A 670 -9.003 -2.347 7.484 1.00 0.00 C ATOM 1621 NZ LYS A 670 -7.973 -2.878 8.408 1.00 0.00 N ATOM 0 H LYS A 670 -10.394 -4.861 3.822 1.00 0.00 H new ATOM 0 HA LYS A 670 -11.758 -2.320 3.216 1.00 0.00 H new ATOM 0 HB2 LYS A 670 -9.277 -2.555 4.873 1.00 0.00 H new ATOM 0 HB3 LYS A 670 -10.468 -1.270 4.820 1.00 0.00 H new ATOM 0 HG2 LYS A 670 -11.576 -2.115 6.541 1.00 0.00 H new ATOM 0 HG3 LYS A 670 -11.683 -3.695 5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 670 -10.466 -3.850 7.908 1.00 0.00 H new ATOM 0 HD3 LYS A 670 -9.401 -4.241 6.572 1.00 0.00 H new ATOM 0 HE2 LYS A 670 -8.519 -1.907 6.612 1.00 0.00 H new ATOM 0 HE3 LYS A 670 -9.559 -1.549 7.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 -7.334 -2.109 8.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 -8.435 -3.276 9.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 -7.427 -3.622 7.929 1.00 0.00 H new ATOM 1635 N ILE A 671 -9.726 -1.604 1.780 1.00 0.00 N ATOM 1636 CA ILE A 671 -8.752 -1.321 0.742 1.00 0.00 C ATOM 1637 C ILE A 671 -8.367 0.124 0.915 1.00 0.00 C ATOM 1638 O ILE A 671 -9.209 0.936 1.311 1.00 0.00 O ATOM 1639 CB ILE A 671 -9.302 -1.502 -0.711 1.00 0.00 C ATOM 1640 CG1 ILE A 671 -10.423 -0.502 -0.994 1.00 0.00 C ATOM 1641 CG2 ILE A 671 -9.786 -2.915 -0.930 1.00 0.00 C ATOM 1642 CD1 ILE A 671 -10.890 -0.472 -2.409 1.00 0.00 C ATOM 0 H ILE A 671 -10.357 -0.825 1.970 1.00 0.00 H new ATOM 0 HA ILE A 671 -7.924 -2.022 0.849 1.00 0.00 H new ATOM 0 HB ILE A 671 -8.486 -1.309 -1.407 1.00 0.00 H new ATOM 0 HG12 ILE A 671 -11.271 -0.737 -0.351 1.00 0.00 H new ATOM 0 HG13 ILE A 671 -10.080 0.495 -0.718 1.00 0.00 H new ATOM 0 HG21 ILE A 671 -10.164 -3.017 -1.947 1.00 0.00 H new ATOM 0 HG22 ILE A 671 -8.960 -3.610 -0.779 1.00 0.00 H new ATOM 0 HG23 ILE A 671 -10.584 -3.140 -0.222 1.00 0.00 H new ATOM 0 HD11 ILE A 671 -11.685 0.266 -2.514 1.00 0.00 H new ATOM 0 HD12 ILE A 671 -10.058 -0.205 -3.061 1.00 0.00 H new ATOM 0 HD13 ILE A 671 -11.268 -1.455 -2.688 1.00 0.00 H new ATOM 1649 N GLN A 672 -7.146 0.443 0.711 1.00 0.00 N ATOM 1650 CA GLN A 672 -6.702 1.796 0.873 1.00 0.00 C ATOM 1651 C GLN A 672 -6.325 2.350 -0.479 1.00 0.00 C ATOM 1652 O GLN A 672 -5.898 1.605 -1.362 1.00 0.00 O ATOM 1653 CB GLN A 672 -5.522 1.902 1.872 1.00 0.00 C ATOM 1654 CG GLN A 672 -4.214 1.279 1.405 1.00 0.00 C ATOM 1655 CD GLN A 672 -4.270 -0.232 1.232 1.00 0.00 C ATOM 1656 OE1 GLN A 672 -4.602 -0.724 0.171 1.00 0.00 O ATOM 1657 NE2 GLN A 672 -3.930 -0.961 2.235 1.00 0.00 N ATOM 0 H GLN A 672 -6.419 -0.214 0.428 1.00 0.00 H new ATOM 0 HA GLN A 672 -7.515 2.386 1.296 1.00 0.00 H new ATOM 0 HB2 GLN A 672 -5.346 2.955 2.090 1.00 0.00 H new ATOM 0 HB3 GLN A 672 -5.817 1.428 2.808 1.00 0.00 H new ATOM 0 HG2 GLN A 672 -3.927 1.732 0.456 1.00 0.00 H new ATOM 0 HG3 GLN A 672 -3.431 1.523 2.124 1.00 0.00 H new ATOM 0 HE21 GLN A 672 -3.656 -0.523 3.114 1.00 0.00 H new ATOM 0 HE22 GLN A 672 -3.935 -1.978 2.151 1.00 0.00 H new ATOM 1666 N CYS A 673 -6.510 3.616 -0.671 1.00 0.00 N ATOM 1667 CA CYS A 673 -6.169 4.196 -1.939 1.00 0.00 C ATOM 1668 C CYS A 673 -4.684 4.506 -1.997 1.00 0.00 C ATOM 1669 O CYS A 673 -4.125 5.139 -1.072 1.00 0.00 O ATOM 1670 CB CYS A 673 -6.988 5.443 -2.233 1.00 0.00 C ATOM 1671 SG CYS A 673 -6.683 6.087 -3.899 1.00 0.00 S ATOM 0 H CYS A 673 -6.889 4.264 0.019 1.00 0.00 H new ATOM 0 HA CYS A 673 -6.408 3.463 -2.709 1.00 0.00 H new ATOM 0 HB2 CYS A 673 -8.048 5.214 -2.123 1.00 0.00 H new ATOM 0 HB3 CYS A 673 -6.750 6.213 -1.499 1.00 0.00 H new ATOM 1676 N VAL A 674 -4.040 4.052 -3.052 1.00 0.00 N ATOM 1677 CA VAL A 674 -2.624 4.265 -3.265 1.00 0.00 C ATOM 1678 C VAL A 674 -2.393 5.231 -4.429 1.00 0.00 C ATOM 1679 O VAL A 674 -2.909 5.023 -5.521 1.00 0.00 O ATOM 1680 CB VAL A 674 -1.842 2.937 -3.459 1.00 0.00 C ATOM 1681 CG1 VAL A 674 -1.931 2.099 -2.207 1.00 0.00 C ATOM 1682 CG2 VAL A 674 -2.348 2.145 -4.645 1.00 0.00 C ATOM 0 H VAL A 674 -4.491 3.518 -3.795 1.00 0.00 H new ATOM 0 HA VAL A 674 -2.226 4.720 -2.358 1.00 0.00 H new ATOM 0 HB VAL A 674 -0.802 3.196 -3.657 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -1.380 1.170 -2.351 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -1.502 2.649 -1.370 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.976 1.872 -1.994 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -1.771 1.225 -4.741 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.400 1.900 -4.497 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -2.238 2.739 -5.553 1.00 0.00 H new ATOM 1686 N ASP A 675 -1.616 6.303 -4.162 1.00 0.00 N ATOM 1687 CA ASP A 675 -1.388 7.442 -5.105 1.00 0.00 C ATOM 1688 C ASP A 675 -2.694 8.166 -5.474 1.00 0.00 C ATOM 1689 O ASP A 675 -2.899 9.322 -5.091 1.00 0.00 O ATOM 1690 CB ASP A 675 -0.585 7.023 -6.351 1.00 0.00 C ATOM 1691 CG ASP A 675 -0.479 8.109 -7.404 1.00 0.00 C ATOM 1692 OD1 ASP A 675 0.293 9.062 -7.228 1.00 0.00 O ATOM 1693 OD2 ASP A 675 -1.167 8.029 -8.429 1.00 0.00 O ATOM 0 H ASP A 675 -1.119 6.412 -3.278 1.00 0.00 H new ATOM 0 HA ASP A 675 -0.772 8.164 -4.568 1.00 0.00 H new ATOM 0 HB2 ASP A 675 0.418 6.729 -6.043 1.00 0.00 H new ATOM 0 HB3 ASP A 675 -1.053 6.144 -6.795 1.00 0.00 H new ATOM 1698 N GLY A 676 -3.545 7.481 -6.180 1.00 0.00 N ATOM 1699 CA GLY A 676 -4.844 7.969 -6.546 1.00 0.00 C ATOM 1700 C GLY A 676 -5.690 6.843 -7.114 1.00 0.00 C ATOM 1701 O GLY A 676 -6.659 7.086 -7.836 1.00 0.00 O ATOM 0 H GLY A 676 -3.350 6.542 -6.527 1.00 0.00 H new ATOM 0 HA2 GLY A 676 -5.337 8.399 -5.674 1.00 0.00 H new ATOM 0 HA3 GLY A 676 -4.746 8.766 -7.283 1.00 0.00 H new ATOM 1705 N GLU A 677 -5.326 5.610 -6.783 1.00 0.00 N ATOM 1706 CA GLU A 677 -6.012 4.427 -7.259 1.00 0.00 C ATOM 1707 C GLU A 677 -6.253 3.522 -6.075 1.00 0.00 C ATOM 1708 O GLU A 677 -5.385 3.372 -5.233 1.00 0.00 O ATOM 1709 CB GLU A 677 -5.146 3.676 -8.264 1.00 0.00 C ATOM 1710 CG GLU A 677 -4.779 4.457 -9.501 1.00 0.00 C ATOM 1711 CD GLU A 677 -3.785 3.719 -10.352 1.00 0.00 C ATOM 1712 OE1 GLU A 677 -2.572 3.789 -10.055 1.00 0.00 O ATOM 1713 OE2 GLU A 677 -4.182 3.067 -11.343 1.00 0.00 O ATOM 0 H GLU A 677 -4.537 5.407 -6.169 1.00 0.00 H new ATOM 0 HA GLU A 677 -6.946 4.718 -7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 677 -4.229 3.361 -7.766 1.00 0.00 H new ATOM 0 HB3 GLU A 677 -5.671 2.770 -8.567 1.00 0.00 H new ATOM 0 HG2 GLU A 677 -5.678 4.658 -10.084 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -4.364 5.422 -9.212 1.00 0.00 H new ATOM 1720 N TRP A 678 -7.395 2.944 -5.990 1.00 0.00 N ATOM 1721 CA TRP A 678 -7.695 2.058 -4.892 1.00 0.00 C ATOM 1722 C TRP A 678 -7.120 0.682 -5.163 1.00 0.00 C ATOM 1723 O TRP A 678 -6.963 0.285 -6.321 1.00 0.00 O ATOM 1724 CB TRP A 678 -9.181 1.950 -4.710 1.00 0.00 C ATOM 1725 CG TRP A 678 -9.855 3.202 -4.225 1.00 0.00 C ATOM 1726 CD1 TRP A 678 -10.436 4.184 -4.979 1.00 0.00 C ATOM 1727 CD2 TRP A 678 -10.018 3.588 -2.867 1.00 0.00 C ATOM 1728 NE1 TRP A 678 -10.953 5.165 -4.157 1.00 0.00 N ATOM 1729 CE2 TRP A 678 -10.702 4.820 -2.853 1.00 0.00 C ATOM 1730 CE3 TRP A 678 -9.644 3.008 -1.660 1.00 0.00 C ATOM 1731 CZ2 TRP A 678 -11.020 5.477 -1.670 1.00 0.00 C ATOM 1732 CZ3 TRP A 678 -9.954 3.648 -0.489 1.00 0.00 C ATOM 1733 CH2 TRP A 678 -10.636 4.876 -0.494 1.00 0.00 C ATOM 0 H TRP A 678 -8.151 3.060 -6.665 1.00 0.00 H new ATOM 0 HA TRP A 678 -7.248 2.463 -3.984 1.00 0.00 H new ATOM 0 HB2 TRP A 678 -9.628 1.660 -5.661 1.00 0.00 H new ATOM 0 HB3 TRP A 678 -9.388 1.147 -4.003 1.00 0.00 H new ATOM 0 HD1 TRP A 678 -10.483 4.191 -6.058 1.00 0.00 H new ATOM 0 HE1 TRP A 678 -11.440 6.006 -4.467 1.00 0.00 H new ATOM 0 HE3 TRP A 678 -9.116 2.066 -1.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 -11.547 6.420 -1.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 -9.670 3.202 0.452 1.00 0.00 H new ATOM 0 HH2 TRP A 678 -10.864 5.358 0.445 1.00 0.00 H new ATOM 1744 N THR A 679 -6.806 -0.036 -4.119 1.00 0.00 N ATOM 1745 CA THR A 679 -6.256 -1.357 -4.238 1.00 0.00 C ATOM 1746 C THR A 679 -7.329 -2.404 -4.574 1.00 0.00 C ATOM 1747 O THR A 679 -8.504 -2.054 -4.795 1.00 0.00 O ATOM 1748 CB THR A 679 -5.476 -1.699 -2.972 1.00 0.00 C ATOM 1749 OG1 THR A 679 -6.228 -1.282 -1.829 1.00 0.00 O ATOM 1750 CG2 THR A 679 -4.139 -0.987 -2.994 1.00 0.00 C ATOM 0 H THR A 679 -6.926 0.282 -3.157 1.00 0.00 H new ATOM 0 HA THR A 679 -5.564 -1.374 -5.080 1.00 0.00 H new ATOM 0 HB THR A 679 -5.307 -2.775 -2.923 1.00 0.00 H new ATOM 0 HG1 THR A 679 -5.699 -1.429 -1.018 1.00 0.00 H new ATOM 0 HG21 THR A 679 -3.582 -1.231 -2.090 1.00 0.00 H new ATOM 0 HG22 THR A 679 -3.571 -1.307 -3.868 1.00 0.00 H new ATOM 0 HG23 THR A 679 -4.301 0.090 -3.041 1.00 0.00 H new ATOM 1758 N THR A 680 -6.935 -3.662 -4.642 1.00 0.00 N ATOM 1759 CA THR A 680 -7.816 -4.724 -5.075 1.00 0.00 C ATOM 1760 C THR A 680 -8.907 -5.006 -4.041 1.00 0.00 C ATOM 1761 O THR A 680 -8.615 -5.213 -2.864 1.00 0.00 O ATOM 1762 CB THR A 680 -6.998 -5.991 -5.367 1.00 0.00 C ATOM 1763 OG1 THR A 680 -5.882 -5.635 -6.225 1.00 0.00 O ATOM 1764 CG2 THR A 680 -7.845 -7.033 -6.078 1.00 0.00 C ATOM 0 H THR A 680 -5.995 -3.974 -4.398 1.00 0.00 H new ATOM 0 HA THR A 680 -8.315 -4.404 -5.990 1.00 0.00 H new ATOM 0 HB THR A 680 -6.649 -6.409 -4.423 1.00 0.00 H new ATOM 0 HG1 THR A 680 -5.350 -6.435 -6.418 1.00 0.00 H new ATOM 0 HG21 THR A 680 -7.242 -7.920 -6.273 1.00 0.00 H new ATOM 0 HG22 THR A 680 -8.694 -7.302 -5.450 1.00 0.00 H new ATOM 0 HG23 THR A 680 -8.207 -6.625 -7.022 1.00 0.00 H new ATOM 1772 N LEU A 681 -10.149 -4.992 -4.508 1.00 0.00 N ATOM 1773 CA LEU A 681 -11.313 -5.209 -3.669 1.00 0.00 C ATOM 1774 C LEU A 681 -11.365 -6.580 -3.029 1.00 0.00 C ATOM 1775 O LEU A 681 -10.798 -7.542 -3.544 1.00 0.00 O ATOM 1776 CB LEU A 681 -12.617 -4.939 -4.417 1.00 0.00 C ATOM 1777 CG LEU A 681 -13.238 -3.585 -4.141 1.00 0.00 C ATOM 1778 CD1 LEU A 681 -12.357 -2.468 -4.608 1.00 0.00 C ATOM 1779 CD2 LEU A 681 -14.610 -3.498 -4.724 1.00 0.00 C ATOM 0 H LEU A 681 -10.375 -4.828 -5.489 1.00 0.00 H new ATOM 0 HA LEU A 681 -11.205 -4.484 -2.862 1.00 0.00 H new ATOM 0 HB2 LEU A 681 -12.430 -5.026 -5.487 1.00 0.00 H new ATOM 0 HB3 LEU A 681 -13.337 -5.714 -4.155 1.00 0.00 H new ATOM 0 HG LEU A 681 -13.335 -3.476 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 681 -12.836 -1.513 -4.393 1.00 0.00 H new ATOM 0 HD12 LEU A 681 -11.399 -2.519 -4.090 1.00 0.00 H new ATOM 0 HD13 LEU A 681 -12.193 -2.558 -5.682 1.00 0.00 H new ATOM 0 HD21 LEU A 681 -15.034 -2.516 -4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 681 -14.557 -3.645 -5.803 1.00 0.00 H new ATOM 0 HD23 LEU A 681 -15.242 -4.269 -4.283 1.00 0.00 H new ATOM 1791 N PRO A 682 -12.080 -6.670 -1.885 1.00 0.00 N ATOM 1792 CA PRO A 682 -12.249 -7.910 -1.126 1.00 0.00 C ATOM 1793 C PRO A 682 -12.767 -9.085 -1.968 1.00 0.00 C ATOM 1794 O PRO A 682 -12.133 -10.136 -2.023 1.00 0.00 O ATOM 1795 CB PRO A 682 -13.292 -7.549 -0.052 1.00 0.00 C ATOM 1796 CG PRO A 682 -13.798 -6.183 -0.394 1.00 0.00 C ATOM 1797 CD PRO A 682 -12.744 -5.528 -1.214 1.00 0.00 C ATOM 0 HA PRO A 682 -11.290 -8.247 -0.732 1.00 0.00 H new ATOM 0 HB2 PRO A 682 -14.106 -8.273 -0.043 1.00 0.00 H new ATOM 0 HB3 PRO A 682 -12.845 -7.560 0.942 1.00 0.00 H new ATOM 0 HG2 PRO A 682 -14.735 -6.245 -0.947 1.00 0.00 H new ATOM 0 HG3 PRO A 682 -13.998 -5.607 0.510 1.00 0.00 H new ATOM 0 HD2 PRO A 682 -13.170 -4.830 -1.934 1.00 0.00 H new ATOM 0 HD3 PRO A 682 -12.046 -4.963 -0.596 1.00 0.00 H new ATOM 1805 N VAL A 683 -13.907 -8.878 -2.636 1.00 0.00 N ATOM 1806 CA VAL A 683 -14.591 -9.920 -3.426 1.00 0.00 C ATOM 1807 C VAL A 683 -15.195 -11.010 -2.510 1.00 0.00 C ATOM 1808 O VAL A 683 -14.500 -11.673 -1.724 1.00 0.00 O ATOM 1809 CB VAL A 683 -13.688 -10.548 -4.539 1.00 0.00 C ATOM 1810 CG1 VAL A 683 -14.432 -11.638 -5.308 1.00 0.00 C ATOM 1811 CG2 VAL A 683 -13.205 -9.469 -5.498 1.00 0.00 C ATOM 0 H VAL A 683 -14.388 -7.979 -2.647 1.00 0.00 H new ATOM 0 HA VAL A 683 -15.406 -9.419 -3.948 1.00 0.00 H new ATOM 0 HB VAL A 683 -12.827 -11.005 -4.052 1.00 0.00 H new ATOM 0 HG11 VAL A 683 -13.778 -12.054 -6.074 1.00 0.00 H new ATOM 0 HG12 VAL A 683 -14.733 -12.428 -4.620 1.00 0.00 H new ATOM 0 HG13 VAL A 683 -15.317 -11.211 -5.780 1.00 0.00 H new ATOM 0 HG21 VAL A 683 -12.578 -9.920 -6.267 1.00 0.00 H new ATOM 0 HG22 VAL A 683 -14.064 -8.987 -5.966 1.00 0.00 H new ATOM 0 HG23 VAL A 683 -12.627 -8.726 -4.948 1.00 0.00 H new ATOM 1815 N CYS A 684 -16.489 -11.154 -2.584 1.00 0.00 N ATOM 1816 CA CYS A 684 -17.195 -12.103 -1.758 1.00 0.00 C ATOM 1817 C CYS A 684 -17.880 -13.156 -2.603 1.00 0.00 C ATOM 1818 O CYS A 684 -18.188 -12.915 -3.779 1.00 0.00 O ATOM 1819 CB CYS A 684 -18.220 -11.366 -0.953 1.00 0.00 C ATOM 1820 SG CYS A 684 -17.514 -9.949 -0.104 1.00 0.00 S ATOM 0 H CYS A 684 -17.086 -10.620 -3.216 1.00 0.00 H new ATOM 0 HA CYS A 684 -16.481 -12.604 -1.104 1.00 0.00 H new ATOM 0 HB2 CYS A 684 -19.025 -11.033 -1.608 1.00 0.00 H new ATOM 0 HB3 CYS A 684 -18.663 -12.043 -0.223 1.00 0.00 H new ATOM 1825 N ILE A 685 -18.119 -14.297 -2.007 1.00 0.00 N ATOM 1826 CA ILE A 685 -18.761 -15.425 -2.653 1.00 0.00 C ATOM 1827 C ILE A 685 -19.759 -16.044 -1.709 1.00 0.00 C ATOM 1828 O ILE A 685 -19.565 -15.974 -0.515 1.00 0.00 O ATOM 1829 CB ILE A 685 -17.763 -16.535 -3.114 1.00 0.00 C ATOM 1830 CG1 ILE A 685 -16.740 -16.928 -1.995 1.00 0.00 C ATOM 1831 CG2 ILE A 685 -17.067 -16.144 -4.401 1.00 0.00 C ATOM 1832 CD1 ILE A 685 -15.558 -15.988 -1.823 1.00 0.00 C ATOM 0 H ILE A 685 -17.868 -14.476 -1.035 1.00 0.00 H new ATOM 0 HA ILE A 685 -19.243 -15.030 -3.547 1.00 0.00 H new ATOM 0 HB ILE A 685 -18.353 -17.429 -3.313 1.00 0.00 H new ATOM 0 HG12 ILE A 685 -17.273 -16.989 -1.046 1.00 0.00 H new ATOM 0 HG13 ILE A 685 -16.359 -17.926 -2.211 1.00 0.00 H new ATOM 0 HG21 ILE A 685 -16.379 -16.936 -4.697 1.00 0.00 H new ATOM 0 HG22 ILE A 685 -17.809 -15.996 -5.185 1.00 0.00 H new ATOM 0 HG23 ILE A 685 -16.512 -15.219 -4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 685 -14.915 -16.355 -1.023 1.00 0.00 H new ATOM 0 HD12 ILE A 685 -14.991 -15.943 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 685 -15.920 -14.991 -1.570 1.00 0.00 H new ATOM 1839 N VAL A 686 -20.827 -16.619 -2.240 1.00 0.00 N ATOM 1840 CA VAL A 686 -21.855 -17.252 -1.411 1.00 0.00 C ATOM 1841 C VAL A 686 -21.258 -18.418 -0.641 1.00 0.00 C ATOM 1842 O VAL A 686 -20.535 -19.245 -1.220 1.00 0.00 O ATOM 1843 CB VAL A 686 -23.081 -17.750 -2.240 1.00 0.00 C ATOM 1844 CG1 VAL A 686 -24.129 -18.404 -1.343 1.00 0.00 C ATOM 1845 CG2 VAL A 686 -23.710 -16.611 -3.007 1.00 0.00 C ATOM 0 H VAL A 686 -21.010 -16.663 -3.243 1.00 0.00 H new ATOM 0 HA VAL A 686 -22.217 -16.489 -0.722 1.00 0.00 H new ATOM 0 HB VAL A 686 -22.714 -18.495 -2.946 1.00 0.00 H new ATOM 0 HG11 VAL A 686 -24.969 -18.740 -1.950 1.00 0.00 H new ATOM 0 HG12 VAL A 686 -23.687 -19.259 -0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 686 -24.480 -17.681 -0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 686 -24.562 -16.983 -3.577 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -24.047 -15.845 -2.309 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -22.976 -16.183 -3.690 1.00 0.00 H new ATOM 1849 N GLU A 687 -21.547 -18.455 0.641 1.00 0.00 N ATOM 1850 CA GLU A 687 -21.054 -19.470 1.544 1.00 0.00 C ATOM 1851 C GLU A 687 -21.661 -20.849 1.258 1.00 0.00 C ATOM 1852 O GLU A 687 -20.943 -21.729 0.734 1.00 0.00 O ATOM 1853 CB GLU A 687 -21.256 -19.038 3.001 1.00 0.00 C ATOM 1854 CG GLU A 687 -22.635 -18.527 3.329 1.00 0.00 C ATOM 1855 CD GLU A 687 -22.776 -18.126 4.766 1.00 0.00 C ATOM 1856 OE1 GLU A 687 -22.941 -19.010 5.629 1.00 0.00 O ATOM 1857 OE2 GLU A 687 -22.756 -16.918 5.073 1.00 0.00 O ATOM 1858 OXT GLU A 687 -22.867 -21.061 1.512 1.00 0.00 O ATOM 0 H GLU A 687 -22.145 -17.764 1.094 1.00 0.00 H new ATOM 0 HA GLU A 687 -19.983 -19.575 1.372 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -21.036 -19.886 3.649 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -20.531 -18.259 3.237 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -22.862 -17.671 2.693 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -23.369 -19.299 3.098 1.00 0.00 H new