USER MOD reduce.3.24.130724 H: found=0, std=0, add=811, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 805 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 693 HIS : no HD1:sc= -0.0784 X(o=-0.24,f=-0.35) USER MOD Set 1.2: A 695 HIS : no HD1:sc= -0.165 X(o=-0.24,f=-0.091) USER MOD Set 2.1: A 691 THR OG1 : rot -94:sc= 0.0723 USER MOD Set 2.2: A 692 HIS : no HD1:sc= -0.217 K(o=-0.14,f=-2.8!) USER MOD Set 3.1: A 677 ASN : amide:sc= -0.45 K(o=-2.6,f=-9.9!) USER MOD Set 3.2: A 679 GLN : amide:sc= -2.13 K(o=-2.6,f=-6.4!) USER MOD Set 4.1: A 616 SER OG : rot -93:sc= 0.498 USER MOD Set 4.2: A 659 MET CE :methyl -122:sc= 0 (180deg=-1.06) USER MOD Set 5.1: A 638 TYR OH : rot 53:sc= 0.142 USER MOD Set 5.2: A 646 LYS NZ :NH3+ -124:sc= 0.535 (180deg=-0.0104) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 602 SER OG : rot 81:sc= 1.75 USER MOD Single : A 605 LYS NZ :NH3+ -175:sc= 0.535 (180deg=0.511) USER MOD Single : A 609 GLN : amide:sc= 0.156 X(o=0.16,f=-0.081) USER MOD Single : A 610 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 615 ASN : amide:sc= 0.502 K(o=0.5,f=-0.58) USER MOD Single : A 618 LYS NZ :NH3+ -119:sc= 0.865 (180deg=-0.136!) USER MOD Single : A 620 ASN : amide:sc= -0.797 X(o=-0.8,f=-0.79) USER MOD Single : A 623 LYS NZ :NH3+ 146:sc= 1.26 (180deg=1.02) USER MOD Single : A 624 GLN : amide:sc= -0.654 X(o=-0.65,f=-0.36) USER MOD Single : A 629 SER OG : rot 180:sc= -0.0901 USER MOD Single : A 633 HIS : no HE2:sc= 0.877 K(o=0.88,f=-3.4!) USER MOD Single : A 634 TYR OH : rot 63:sc= 0.767 USER MOD Single : A 642 SER OG : rot 79:sc= 0.798 USER MOD Single : A 643 SER OG : rot 180:sc= 0 USER MOD Single : A 653 SER OG : rot 180:sc= 0.00205 USER MOD Single : A 655 SER OG : rot -110:sc= 0.666 USER MOD Single : A 657 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 661 LYS NZ :NH3+ 180:sc= 2.16 (180deg=2.16) USER MOD Single : A 662 SER OG : rot -62:sc= 0.0588 USER MOD Single : A 666 ASN : amide:sc= 0.375 K(o=0.38,f=-3.2!) USER MOD Single : A 669 TYR OH : rot 53:sc= 0.581! USER MOD Single : A 672 TYR OH : rot 180:sc= 0 USER MOD Single : A 678 GLN : amide:sc= -0.504 X(o=-0.5,f=-0.83) USER MOD Single : A 681 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0764) USER MOD Single : A 682 SER OG : rot 83:sc= 0.818 USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 686 HIS : no HD1:sc=-0.000474 X(o=-0.00047,f=-0.00047) USER MOD Single : A 694 HIS : no HD1:sc= -0.0951 X(o=-0.095,f=-0.095) USER MOD Single : A 696 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.4) USER MOD Single : A 697 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 595 1.137 1.949 -1.689 1.00 25.00 N ATOM 2 CA MET A 595 2.238 1.632 -2.636 1.00 25.00 C ATOM 3 C MET A 595 2.501 0.125 -2.719 1.00 25.00 C ATOM 4 O MET A 595 1.873 -0.544 -3.507 1.00 25.00 O ATOM 5 CB MET A 595 3.506 2.418 -2.309 1.00 25.00 C ATOM 6 CG MET A 595 4.556 2.346 -3.407 1.00 25.00 C ATOM 7 SD MET A 595 6.005 3.320 -3.010 1.00 25.00 S ATOM 8 CE MET A 595 6.817 3.377 -4.629 1.00 25.00 C ATOM 0 HA MET A 595 1.913 1.950 -3.627 1.00 25.00 H new ATOM 0 HB2 MET A 595 3.244 3.461 -2.134 1.00 25.00 H new ATOM 0 HB3 MET A 595 3.933 2.037 -1.381 1.00 25.00 H new ATOM 0 HG2 MET A 595 4.848 1.307 -3.562 1.00 25.00 H new ATOM 0 HG3 MET A 595 4.126 2.700 -4.344 1.00 25.00 H new ATOM 0 HE1 MET A 595 7.741 3.951 -4.553 1.00 25.00 H new ATOM 0 HE2 MET A 595 7.046 2.363 -4.957 1.00 25.00 H new ATOM 0 HE3 MET A 595 6.154 3.851 -5.352 1.00 25.00 H new ATOM 20 N GLN A 596 3.425 -0.415 -1.929 1.00 25.00 N ATOM 21 CA GLN A 596 3.829 -1.832 -2.049 1.00 25.00 C ATOM 22 C GLN A 596 2.729 -2.918 -2.183 1.00 25.00 C ATOM 23 O GLN A 596 2.879 -3.818 -2.999 1.00 25.00 O ATOM 24 CB GLN A 596 4.752 -2.195 -0.882 1.00 25.00 C ATOM 25 CG GLN A 596 6.074 -1.429 -0.886 1.00 25.00 C ATOM 26 CD GLN A 596 6.899 -1.722 0.345 1.00 25.00 C ATOM 27 OE1 GLN A 596 6.479 -1.449 1.453 1.00 25.00 O ATOM 28 NE2 GLN A 596 8.073 -2.266 0.157 1.00 25.00 N ATOM 0 H GLN A 596 3.914 0.099 -1.196 1.00 25.00 H new ATOM 0 HA GLN A 596 4.318 -1.860 -3.023 1.00 25.00 H new ATOM 0 HB2 GLN A 596 4.232 -2.000 0.056 1.00 25.00 H new ATOM 0 HB3 GLN A 596 4.961 -3.264 -0.914 1.00 25.00 H new ATOM 0 HG2 GLN A 596 6.644 -1.694 -1.776 1.00 25.00 H new ATOM 0 HG3 GLN A 596 5.873 -0.359 -0.942 1.00 25.00 H new ATOM 0 HE21 GLN A 596 8.390 -2.480 -0.788 1.00 25.00 H new ATOM 0 HE22 GLN A 596 8.672 -2.476 0.956 1.00 25.00 H new ATOM 37 N PRO A 597 1.622 -2.854 -1.407 1.00 25.00 N ATOM 38 CA PRO A 597 0.622 -3.919 -1.620 1.00 25.00 C ATOM 39 C PRO A 597 -0.277 -3.758 -2.864 1.00 25.00 C ATOM 40 O PRO A 597 -1.271 -4.466 -3.005 1.00 25.00 O ATOM 41 CB PRO A 597 -0.229 -3.815 -0.354 1.00 25.00 C ATOM 42 CG PRO A 597 -0.225 -2.371 -0.054 1.00 25.00 C ATOM 43 CD PRO A 597 1.184 -1.934 -0.336 1.00 25.00 C ATOM 0 HA PRO A 597 1.116 -4.874 -1.798 1.00 25.00 H new ATOM 0 HB2 PRO A 597 -1.240 -4.188 -0.518 1.00 25.00 H new ATOM 0 HB3 PRO A 597 0.196 -4.396 0.464 1.00 25.00 H new ATOM 0 HG2 PRO A 597 -0.940 -1.834 -0.677 1.00 25.00 H new ATOM 0 HG3 PRO A 597 -0.500 -2.180 0.983 1.00 25.00 H new ATOM 0 HD2 PRO A 597 1.225 -0.894 -0.659 1.00 25.00 H new ATOM 0 HD3 PRO A 597 1.815 -2.018 0.549 1.00 25.00 H new ATOM 51 N VAL A 598 0.050 -2.827 -3.750 1.00 25.00 N ATOM 52 CA VAL A 598 -0.783 -2.522 -4.914 1.00 25.00 C ATOM 53 C VAL A 598 -0.017 -2.752 -6.224 1.00 25.00 C ATOM 54 O VAL A 598 1.150 -2.400 -6.343 1.00 25.00 O ATOM 55 CB VAL A 598 -1.266 -1.041 -4.824 1.00 25.00 C ATOM 56 CG1 VAL A 598 -2.001 -0.617 -6.089 1.00 25.00 C ATOM 57 CG2 VAL A 598 -2.165 -0.849 -3.593 1.00 25.00 C ATOM 0 H VAL A 598 0.896 -2.262 -3.686 1.00 25.00 H new ATOM 0 HA VAL A 598 -1.643 -3.192 -4.913 1.00 25.00 H new ATOM 0 HB VAL A 598 -0.385 -0.407 -4.723 1.00 25.00 H new ATOM 0 HG11 VAL A 598 -2.324 0.420 -5.992 1.00 25.00 H new ATOM 0 HG12 VAL A 598 -1.334 -0.711 -6.946 1.00 25.00 H new ATOM 0 HG13 VAL A 598 -2.872 -1.256 -6.235 1.00 25.00 H new ATOM 0 HG21 VAL A 598 -2.495 0.189 -3.542 1.00 25.00 H new ATOM 0 HG22 VAL A 598 -3.034 -1.503 -3.671 1.00 25.00 H new ATOM 0 HG23 VAL A 598 -1.605 -1.096 -2.691 1.00 25.00 H new ATOM 67 N ARG A 599 -0.694 -3.345 -7.204 1.00 25.00 N ATOM 68 CA ARG A 599 -0.101 -3.603 -8.524 1.00 25.00 C ATOM 69 C ARG A 599 -0.028 -2.344 -9.389 1.00 25.00 C ATOM 70 O ARG A 599 -0.709 -1.347 -9.133 1.00 25.00 O ATOM 71 CB ARG A 599 -0.911 -4.673 -9.279 1.00 25.00 C ATOM 72 CG ARG A 599 -2.368 -4.272 -9.576 1.00 25.00 C ATOM 73 CD ARG A 599 -3.047 -5.259 -10.530 1.00 25.00 C ATOM 74 NE ARG A 599 -2.614 -5.055 -11.928 1.00 25.00 N ATOM 75 CZ ARG A 599 -3.228 -4.283 -12.823 1.00 25.00 C ATOM 76 NH1 ARG A 599 -4.323 -3.624 -12.553 1.00 25.00 N ATOM 77 NH2 ARG A 599 -2.731 -4.183 -14.024 1.00 25.00 N ATOM 0 H ARG A 599 -1.660 -3.660 -7.113 1.00 25.00 H new ATOM 0 HA ARG A 599 0.915 -3.953 -8.342 1.00 25.00 H new ATOM 0 HB2 ARG A 599 -0.409 -4.895 -10.220 1.00 25.00 H new ATOM 0 HB3 ARG A 599 -0.912 -5.592 -8.693 1.00 25.00 H new ATOM 0 HG2 ARG A 599 -2.929 -4.224 -8.643 1.00 25.00 H new ATOM 0 HG3 ARG A 599 -2.388 -3.273 -10.012 1.00 25.00 H new ATOM 0 HD2 ARG A 599 -2.816 -6.279 -10.223 1.00 25.00 H new ATOM 0 HD3 ARG A 599 -4.129 -5.143 -10.464 1.00 25.00 H new ATOM 0 HE ARG A 599 -1.774 -5.547 -12.233 1.00 25.00 H new ATOM 0 HH11 ARG A 599 -4.742 -3.689 -11.625 1.00 25.00 H new ATOM 0 HH12 ARG A 599 -4.759 -3.044 -13.270 1.00 25.00 H new ATOM 0 HH21 ARG A 599 -1.882 -4.693 -14.269 1.00 25.00 H new ATOM 0 HH22 ARG A 599 -3.191 -3.595 -14.719 1.00 25.00 H new ATOM 91 N GLU A 600 0.785 -2.421 -10.430 1.00 25.00 N ATOM 92 CA GLU A 600 0.937 -1.323 -11.385 1.00 25.00 C ATOM 93 C GLU A 600 -0.342 -1.207 -12.212 1.00 25.00 C ATOM 94 O GLU A 600 -1.067 -2.195 -12.380 1.00 25.00 O ATOM 95 CB GLU A 600 2.126 -1.585 -12.330 1.00 25.00 C ATOM 96 CG GLU A 600 3.484 -1.516 -11.677 1.00 25.00 C ATOM 97 CD GLU A 600 3.892 -0.082 -11.438 1.00 25.00 C ATOM 98 OE1 GLU A 600 3.275 0.556 -10.564 1.00 25.00 O ATOM 99 OE2 GLU A 600 4.812 0.420 -12.126 1.00 25.00 O ATOM 0 H GLU A 600 1.357 -3.239 -10.641 1.00 25.00 H new ATOM 0 HA GLU A 600 1.123 -0.400 -10.836 1.00 25.00 H new ATOM 0 HB2 GLU A 600 2.004 -2.571 -12.778 1.00 25.00 H new ATOM 0 HB3 GLU A 600 2.092 -0.859 -13.142 1.00 25.00 H new ATOM 0 HG2 GLU A 600 3.465 -2.056 -10.730 1.00 25.00 H new ATOM 0 HG3 GLU A 600 4.222 -2.008 -12.310 1.00 25.00 H new ATOM 106 N PRO A 601 -0.644 -0.008 -12.740 1.00 25.00 N ATOM 107 CA PRO A 601 -1.863 0.113 -13.546 1.00 25.00 C ATOM 108 C PRO A 601 -1.728 -0.477 -14.956 1.00 25.00 C ATOM 109 O PRO A 601 -0.632 -0.664 -15.490 1.00 25.00 O ATOM 110 CB PRO A 601 -2.076 1.627 -13.614 1.00 25.00 C ATOM 111 CG PRO A 601 -0.719 2.204 -13.504 1.00 25.00 C ATOM 112 CD PRO A 601 0.080 1.276 -12.640 1.00 25.00 C ATOM 0 HA PRO A 601 -2.692 -0.442 -13.106 1.00 25.00 H new ATOM 0 HB2 PRO A 601 -2.555 1.918 -14.549 1.00 25.00 H new ATOM 0 HB3 PRO A 601 -2.720 1.973 -12.805 1.00 25.00 H new ATOM 0 HG2 PRO A 601 -0.262 2.305 -14.488 1.00 25.00 H new ATOM 0 HG3 PRO A 601 -0.758 3.202 -13.066 1.00 25.00 H new ATOM 0 HD2 PRO A 601 1.107 1.185 -12.993 1.00 25.00 H new ATOM 0 HD3 PRO A 601 0.128 1.630 -11.610 1.00 25.00 H new ATOM 120 N SER A 602 -2.871 -0.755 -15.554 1.00 25.00 N ATOM 121 CA SER A 602 -2.972 -1.320 -16.891 1.00 25.00 C ATOM 122 C SER A 602 -2.871 -0.208 -17.907 1.00 25.00 C ATOM 123 O SER A 602 -3.165 0.945 -17.601 1.00 25.00 O ATOM 124 CB SER A 602 -4.316 -2.021 -17.076 1.00 25.00 C ATOM 125 OG SER A 602 -4.536 -2.953 -16.037 1.00 25.00 O ATOM 0 H SER A 602 -3.777 -0.591 -15.116 1.00 25.00 H new ATOM 0 HA SER A 602 -2.166 -2.041 -17.026 1.00 25.00 H new ATOM 0 HB2 SER A 602 -5.119 -1.284 -17.087 1.00 25.00 H new ATOM 0 HB3 SER A 602 -4.338 -2.530 -18.040 1.00 25.00 H new ATOM 0 HG SER A 602 -4.863 -2.484 -15.241 1.00 25.00 H new ATOM 131 N ALA A 603 -2.451 -0.552 -19.114 1.00 25.00 N ATOM 132 CA ALA A 603 -2.370 0.425 -20.187 1.00 25.00 C ATOM 133 C ALA A 603 -3.739 1.122 -20.329 1.00 25.00 C ATOM 134 O ALA A 603 -4.797 0.490 -20.133 1.00 25.00 O ATOM 135 CB ALA A 603 -1.975 -0.269 -21.503 1.00 25.00 C ATOM 0 H ALA A 603 -2.162 -1.495 -19.374 1.00 25.00 H new ATOM 0 HA ALA A 603 -1.608 1.170 -19.955 1.00 25.00 H new ATOM 0 HB1 ALA A 603 -1.917 0.471 -22.301 1.00 25.00 H new ATOM 0 HB2 ALA A 603 -1.005 -0.751 -21.383 1.00 25.00 H new ATOM 0 HB3 ALA A 603 -2.724 -1.019 -21.758 1.00 25.00 H new ATOM 141 N PRO A 604 -3.741 2.425 -20.656 1.00 25.00 N ATOM 142 CA PRO A 604 -5.031 3.102 -20.808 1.00 25.00 C ATOM 143 C PRO A 604 -5.821 2.536 -21.975 1.00 25.00 C ATOM 144 O PRO A 604 -5.263 1.977 -22.916 1.00 25.00 O ATOM 145 CB PRO A 604 -4.632 4.564 -21.026 1.00 25.00 C ATOM 146 CG PRO A 604 -3.288 4.489 -21.586 1.00 25.00 C ATOM 147 CD PRO A 604 -2.621 3.345 -20.914 1.00 25.00 C ATOM 0 HA PRO A 604 -5.691 2.974 -19.950 1.00 25.00 H new ATOM 0 HB2 PRO A 604 -5.319 5.067 -21.706 1.00 25.00 H new ATOM 0 HB3 PRO A 604 -4.643 5.123 -20.091 1.00 25.00 H new ATOM 0 HG2 PRO A 604 -3.324 4.339 -22.665 1.00 25.00 H new ATOM 0 HG3 PRO A 604 -2.741 5.416 -21.411 1.00 25.00 H new ATOM 0 HD2 PRO A 604 -1.861 2.890 -21.549 1.00 25.00 H new ATOM 0 HD3 PRO A 604 -2.126 3.649 -19.992 1.00 25.00 H new ATOM 155 N LYS A 605 -7.135 2.659 -21.883 1.00 25.00 N ATOM 156 CA LYS A 605 -8.032 2.095 -22.890 1.00 25.00 C ATOM 157 C LYS A 605 -8.005 3.017 -24.102 1.00 25.00 C ATOM 158 O LYS A 605 -7.768 4.204 -23.958 1.00 25.00 O ATOM 159 CB LYS A 605 -9.438 1.965 -22.292 1.00 25.00 C ATOM 160 CG LYS A 605 -9.741 0.578 -21.637 1.00 25.00 C ATOM 161 CD LYS A 605 -8.651 0.032 -20.653 1.00 25.00 C ATOM 162 CE LYS A 605 -8.520 0.842 -19.350 1.00 25.00 C ATOM 163 NZ LYS A 605 -7.343 0.347 -18.523 1.00 25.00 N ATOM 0 H LYS A 605 -7.609 3.145 -21.122 1.00 25.00 H new ATOM 0 HA LYS A 605 -7.718 1.099 -23.201 1.00 25.00 H new ATOM 0 HB2 LYS A 605 -9.573 2.744 -21.541 1.00 25.00 H new ATOM 0 HB3 LYS A 605 -10.171 2.149 -23.077 1.00 25.00 H new ATOM 0 HG2 LYS A 605 -10.685 0.651 -21.098 1.00 25.00 H new ATOM 0 HG3 LYS A 605 -9.884 -0.154 -22.432 1.00 25.00 H new ATOM 0 HD2 LYS A 605 -8.887 -1.002 -20.403 1.00 25.00 H new ATOM 0 HD3 LYS A 605 -7.687 0.025 -21.162 1.00 25.00 H new ATOM 0 HE2 LYS A 605 -8.387 1.898 -19.585 1.00 25.00 H new ATOM 0 HE3 LYS A 605 -9.439 0.758 -18.770 1.00 25.00 H new ATOM 0 HZ1 LYS A 605 -7.324 0.848 -17.612 1.00 25.00 H new ATOM 0 HZ2 LYS A 605 -7.443 -0.674 -18.354 1.00 25.00 H new ATOM 0 HZ3 LYS A 605 -6.457 0.528 -19.037 1.00 25.00 H new ATOM 177 N LEU A 606 -8.226 2.483 -25.291 1.00 25.00 N ATOM 178 CA LEU A 606 -8.164 3.288 -26.506 1.00 25.00 C ATOM 179 C LEU A 606 -9.258 2.837 -27.449 1.00 25.00 C ATOM 180 O LEU A 606 -9.244 1.716 -27.927 1.00 25.00 O ATOM 181 CB LEU A 606 -6.777 3.146 -27.167 1.00 25.00 C ATOM 182 CG LEU A 606 -6.447 3.981 -28.425 1.00 25.00 C ATOM 183 CD1 LEU A 606 -6.967 3.343 -29.718 1.00 25.00 C ATOM 184 CD2 LEU A 606 -6.974 5.409 -28.307 1.00 25.00 C ATOM 0 H LEU A 606 -8.449 1.500 -25.444 1.00 25.00 H new ATOM 0 HA LEU A 606 -8.313 4.340 -26.262 1.00 25.00 H new ATOM 0 HB2 LEU A 606 -6.029 3.384 -26.411 1.00 25.00 H new ATOM 0 HB3 LEU A 606 -6.645 2.096 -27.427 1.00 25.00 H new ATOM 0 HG LEU A 606 -5.359 4.007 -28.483 1.00 25.00 H new ATOM 0 HD11 LEU A 606 -6.705 3.975 -30.567 1.00 25.00 H new ATOM 0 HD12 LEU A 606 -6.516 2.359 -29.845 1.00 25.00 H new ATOM 0 HD13 LEU A 606 -8.051 3.241 -29.663 1.00 25.00 H new ATOM 0 HD21 LEU A 606 -6.723 5.965 -29.210 1.00 25.00 H new ATOM 0 HD22 LEU A 606 -8.057 5.388 -28.183 1.00 25.00 H new ATOM 0 HD23 LEU A 606 -6.519 5.895 -27.444 1.00 25.00 H new ATOM 196 N GLU A 607 -10.200 3.734 -27.714 1.00 25.00 N ATOM 197 CA GLU A 607 -11.331 3.414 -28.587 1.00 25.00 C ATOM 198 C GLU A 607 -11.266 4.166 -29.924 1.00 25.00 C ATOM 199 O GLU A 607 -12.080 3.938 -30.807 1.00 25.00 O ATOM 200 CB GLU A 607 -12.651 3.712 -27.866 1.00 25.00 C ATOM 201 CG GLU A 607 -12.689 3.249 -26.400 1.00 25.00 C ATOM 202 CD GLU A 607 -12.234 1.810 -26.190 1.00 25.00 C ATOM 203 OE1 GLU A 607 -11.303 1.606 -25.370 1.00 25.00 O ATOM 204 OE2 GLU A 607 -12.795 0.895 -26.822 1.00 25.00 O ATOM 0 H GLU A 607 -10.207 4.684 -27.342 1.00 25.00 H new ATOM 0 HA GLU A 607 -11.277 2.350 -28.818 1.00 25.00 H new ATOM 0 HB2 GLU A 607 -12.836 4.786 -27.901 1.00 25.00 H new ATOM 0 HB3 GLU A 607 -13.465 3.230 -28.408 1.00 25.00 H new ATOM 0 HG2 GLU A 607 -12.057 3.909 -25.805 1.00 25.00 H new ATOM 0 HG3 GLU A 607 -13.706 3.356 -26.023 1.00 25.00 H new ATOM 211 N GLY A 608 -10.282 5.054 -30.063 1.00 25.00 N ATOM 212 CA GLY A 608 -10.045 5.750 -31.331 1.00 25.00 C ATOM 213 C GLY A 608 -11.224 6.521 -31.902 1.00 25.00 C ATOM 214 O GLY A 608 -11.457 6.507 -33.107 1.00 25.00 O ATOM 0 H GLY A 608 -9.636 5.309 -29.316 1.00 25.00 H new ATOM 0 HA2 GLY A 608 -9.216 6.444 -31.191 1.00 25.00 H new ATOM 0 HA3 GLY A 608 -9.725 5.016 -32.070 1.00 25.00 H new ATOM 218 N GLN A 609 -11.984 7.185 -31.047 1.00 25.00 N ATOM 219 CA GLN A 609 -13.201 7.865 -31.484 1.00 25.00 C ATOM 220 C GLN A 609 -12.853 9.189 -32.135 1.00 25.00 C ATOM 221 O GLN A 609 -12.248 10.045 -31.508 1.00 25.00 O ATOM 222 CB GLN A 609 -14.116 8.092 -30.288 1.00 25.00 C ATOM 223 CG GLN A 609 -14.605 6.788 -29.660 1.00 25.00 C ATOM 224 CD GLN A 609 -15.460 5.983 -30.611 1.00 25.00 C ATOM 225 OE1 GLN A 609 -16.505 6.431 -31.047 1.00 25.00 O ATOM 226 NE2 GLN A 609 -15.015 4.804 -30.942 1.00 25.00 N ATOM 0 H GLN A 609 -11.785 7.270 -30.050 1.00 25.00 H new ATOM 0 HA GLN A 609 -13.717 7.243 -32.216 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -13.585 8.675 -29.536 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -14.976 8.684 -30.602 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -13.747 6.191 -29.351 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -15.178 7.012 -28.760 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -14.135 4.464 -30.555 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -15.547 4.221 -31.588 1.00 25.00 H new ATOM 235 N MET A 610 -13.233 9.336 -33.396 1.00 25.00 N ATOM 236 CA MET A 610 -12.906 10.521 -34.195 1.00 25.00 C ATOM 237 C MET A 610 -13.418 11.821 -33.576 1.00 25.00 C ATOM 238 O MET A 610 -14.488 11.851 -32.972 1.00 25.00 O ATOM 239 CB MET A 610 -13.505 10.369 -35.595 1.00 25.00 C ATOM 240 CG MET A 610 -13.124 9.065 -36.278 1.00 25.00 C ATOM 241 SD MET A 610 -13.672 9.033 -37.996 1.00 25.00 S ATOM 242 CE MET A 610 -13.255 7.345 -38.461 1.00 25.00 C ATOM 0 H MET A 610 -13.779 8.638 -33.901 1.00 25.00 H new ATOM 0 HA MET A 610 -11.819 10.586 -34.235 1.00 25.00 H new ATOM 0 HB2 MET A 610 -14.591 10.430 -35.526 1.00 25.00 H new ATOM 0 HB3 MET A 610 -13.178 11.204 -36.215 1.00 25.00 H new ATOM 0 HG2 MET A 610 -12.043 8.934 -36.238 1.00 25.00 H new ATOM 0 HG3 MET A 610 -13.566 8.228 -35.738 1.00 25.00 H new ATOM 0 HE1 MET A 610 -13.535 7.174 -39.500 1.00 25.00 H new ATOM 0 HE2 MET A 610 -12.182 7.190 -38.344 1.00 25.00 H new ATOM 0 HE3 MET A 610 -13.794 6.647 -37.820 1.00 25.00 H new ATOM 252 N GLY A 611 -12.655 12.894 -33.741 1.00 25.00 N ATOM 253 CA GLY A 611 -13.047 14.188 -33.203 1.00 25.00 C ATOM 254 C GLY A 611 -13.968 14.937 -34.138 1.00 25.00 C ATOM 255 O GLY A 611 -13.578 15.312 -35.240 1.00 25.00 O ATOM 0 H GLY A 611 -11.766 12.893 -34.241 1.00 25.00 H new ATOM 0 HA2 GLY A 611 -13.543 14.046 -32.243 1.00 25.00 H new ATOM 0 HA3 GLY A 611 -12.156 14.787 -33.016 1.00 25.00 H new ATOM 259 N GLU A 612 -15.191 15.159 -33.689 1.00 25.00 N ATOM 260 CA GLU A 612 -16.215 15.847 -34.476 1.00 25.00 C ATOM 261 C GLU A 612 -15.904 17.335 -34.631 1.00 25.00 C ATOM 262 O GLU A 612 -16.363 17.976 -35.566 1.00 25.00 O ATOM 263 CB GLU A 612 -17.601 15.660 -33.825 1.00 25.00 C ATOM 264 CG GLU A 612 -17.747 16.190 -32.379 1.00 25.00 C ATOM 265 CD GLU A 612 -17.289 15.182 -31.327 1.00 25.00 C ATOM 266 OE1 GLU A 612 -16.063 15.082 -31.058 1.00 25.00 O ATOM 267 OE2 GLU A 612 -18.146 14.473 -30.763 1.00 25.00 O ATOM 0 H GLU A 612 -15.509 14.868 -32.765 1.00 25.00 H new ATOM 0 HA GLU A 612 -16.221 15.403 -35.472 1.00 25.00 H new ATOM 0 HB2 GLU A 612 -18.344 16.156 -34.450 1.00 25.00 H new ATOM 0 HB3 GLU A 612 -17.841 14.597 -33.827 1.00 25.00 H new ATOM 0 HG2 GLU A 612 -17.167 17.107 -32.273 1.00 25.00 H new ATOM 0 HG3 GLU A 612 -18.790 16.450 -32.196 1.00 25.00 H new ATOM 274 N ASP A 613 -15.108 17.869 -33.714 1.00 25.00 N ATOM 275 CA ASP A 613 -14.711 19.280 -33.756 1.00 25.00 C ATOM 276 C ASP A 613 -13.733 19.535 -34.899 1.00 25.00 C ATOM 277 O ASP A 613 -13.545 20.669 -35.337 1.00 25.00 O ATOM 278 CB ASP A 613 -13.989 19.664 -32.457 1.00 25.00 C ATOM 279 CG ASP A 613 -14.898 19.660 -31.246 1.00 25.00 C ATOM 280 OD1 ASP A 613 -14.481 19.070 -30.219 1.00 25.00 O ATOM 281 OD2 ASP A 613 -15.991 20.243 -31.289 1.00 25.00 O ATOM 0 H ASP A 613 -14.721 17.348 -32.927 1.00 25.00 H new ATOM 0 HA ASP A 613 -15.619 19.868 -33.892 1.00 25.00 H new ATOM 0 HB2 ASP A 613 -13.166 18.970 -32.288 1.00 25.00 H new ATOM 0 HB3 ASP A 613 -13.551 20.656 -32.572 1.00 25.00 H new ATOM 286 N GLY A 614 -13.083 18.471 -35.358 1.00 25.00 N ATOM 287 CA GLY A 614 -12.018 18.603 -36.337 1.00 25.00 C ATOM 288 C GLY A 614 -10.757 19.038 -35.609 1.00 25.00 C ATOM 289 O GLY A 614 -10.847 19.577 -34.503 1.00 25.00 O ATOM 0 H GLY A 614 -13.276 17.513 -35.067 1.00 25.00 H new ATOM 0 HA2 GLY A 614 -11.853 17.655 -36.850 1.00 25.00 H new ATOM 0 HA3 GLY A 614 -12.289 19.335 -37.098 1.00 25.00 H new ATOM 293 N ASN A 615 -9.583 18.798 -36.198 1.00 25.00 N ATOM 294 CA ASN A 615 -8.296 19.186 -35.581 1.00 25.00 C ATOM 295 C ASN A 615 -8.201 18.589 -34.153 1.00 25.00 C ATOM 296 O ASN A 615 -7.572 19.166 -33.247 1.00 25.00 O ATOM 297 CB ASN A 615 -8.209 20.732 -35.576 1.00 25.00 C ATOM 298 CG ASN A 615 -6.796 21.252 -35.672 1.00 25.00 C ATOM 299 OD1 ASN A 615 -6.388 21.773 -36.691 1.00 25.00 O ATOM 300 ND2 ASN A 615 -6.060 21.131 -34.619 1.00 25.00 N ATOM 0 H ASN A 615 -9.489 18.337 -37.103 1.00 25.00 H new ATOM 0 HA ASN A 615 -7.453 18.793 -36.149 1.00 25.00 H new ATOM 0 HB2 ASN A 615 -8.790 21.124 -36.411 1.00 25.00 H new ATOM 0 HB3 ASN A 615 -8.667 21.112 -34.663 1.00 25.00 H new ATOM 0 HD21 ASN A 615 -5.101 21.479 -34.624 1.00 25.00 H new ATOM 0 HD22 ASN A 615 -6.437 20.688 -33.781 1.00 25.00 H new ATOM 307 N SER A 616 -8.870 17.452 -33.957 1.00 25.00 N ATOM 308 CA SER A 616 -9.038 16.850 -32.636 1.00 25.00 C ATOM 309 C SER A 616 -9.416 15.364 -32.675 1.00 25.00 C ATOM 310 O SER A 616 -9.771 14.844 -33.735 1.00 25.00 O ATOM 311 CB SER A 616 -10.183 17.587 -31.963 1.00 25.00 C ATOM 312 OG SER A 616 -11.362 17.448 -32.730 1.00 25.00 O ATOM 0 H SER A 616 -9.310 16.923 -34.710 1.00 25.00 H new ATOM 0 HA SER A 616 -8.085 16.927 -32.113 1.00 25.00 H new ATOM 0 HB2 SER A 616 -10.342 17.191 -30.960 1.00 25.00 H new ATOM 0 HB3 SER A 616 -9.933 18.642 -31.853 1.00 25.00 H new ATOM 0 HG SER A 616 -11.440 18.203 -33.349 1.00 25.00 H new ATOM 318 N ILE A 617 -9.357 14.695 -31.520 1.00 25.00 N ATOM 319 CA ILE A 617 -9.771 13.284 -31.390 1.00 25.00 C ATOM 320 C ILE A 617 -10.015 12.898 -29.919 1.00 25.00 C ATOM 321 O ILE A 617 -9.464 13.525 -29.016 1.00 25.00 O ATOM 322 CB ILE A 617 -8.708 12.335 -32.021 1.00 25.00 C ATOM 323 CG1 ILE A 617 -9.311 10.940 -32.234 1.00 0.00 C ATOM 324 CG2 ILE A 617 -7.415 12.266 -31.165 1.00 25.00 C ATOM 325 CD1 ILE A 617 -8.843 10.227 -33.475 1.00 25.00 C ATOM 0 H ILE A 617 -9.023 15.109 -30.649 1.00 25.00 H new ATOM 0 HA ILE A 617 -10.711 13.171 -31.930 1.00 25.00 H new ATOM 0 HB ILE A 617 -8.421 12.743 -32.990 1.00 25.00 H new ATOM 0 HG12 ILE A 617 -9.075 10.322 -31.367 1.00 0.00 H new ATOM 0 HG13 ILE A 617 -10.396 11.032 -32.274 1.00 0.00 H new ATOM 0 HG21 ILE A 617 -6.700 11.594 -31.640 1.00 25.00 H new ATOM 0 HG22 ILE A 617 -6.979 13.262 -31.084 1.00 25.00 H new ATOM 0 HG23 ILE A 617 -7.657 11.894 -30.170 1.00 25.00 H new ATOM 0 HD11 ILE A 617 -9.324 9.251 -33.537 1.00 25.00 H new ATOM 0 HD12 ILE A 617 -9.104 10.817 -34.354 1.00 25.00 H new ATOM 0 HD13 ILE A 617 -7.762 10.096 -33.434 1.00 25.00 H new ATOM 337 N LYS A 618 -10.827 11.869 -29.674 1.00 25.00 N ATOM 338 CA LYS A 618 -11.103 11.399 -28.309 1.00 25.00 C ATOM 339 C LYS A 618 -10.450 10.042 -28.077 1.00 25.00 C ATOM 340 O LYS A 618 -10.796 9.048 -28.719 1.00 25.00 O ATOM 341 CB LYS A 618 -12.613 11.266 -28.060 1.00 25.00 C ATOM 342 CG LYS A 618 -13.421 12.501 -28.420 1.00 25.00 C ATOM 343 CD LYS A 618 -14.138 12.323 -29.762 1.00 25.00 C ATOM 344 CE LYS A 618 -15.608 11.942 -29.606 1.00 25.00 C ATOM 345 NZ LYS A 618 -16.426 13.067 -29.054 1.00 25.00 N ATOM 0 H LYS A 618 -11.308 11.342 -30.403 1.00 25.00 H new ATOM 0 HA LYS A 618 -10.692 12.137 -27.620 1.00 25.00 H new ATOM 0 HB2 LYS A 618 -12.990 10.420 -28.635 1.00 25.00 H new ATOM 0 HB3 LYS A 618 -12.776 11.034 -27.007 1.00 25.00 H new ATOM 0 HG2 LYS A 618 -14.153 12.701 -27.637 1.00 25.00 H new ATOM 0 HG3 LYS A 618 -12.762 13.368 -28.469 1.00 25.00 H new ATOM 0 HD2 LYS A 618 -14.067 13.250 -30.332 1.00 25.00 H new ATOM 0 HD3 LYS A 618 -13.628 11.553 -30.341 1.00 25.00 H new ATOM 0 HE2 LYS A 618 -16.009 11.644 -30.575 1.00 25.00 H new ATOM 0 HE3 LYS A 618 -15.690 11.078 -28.947 1.00 25.00 H new ATOM 0 HZ1 LYS A 618 -16.848 12.778 -28.148 1.00 25.00 H new ATOM 0 HZ2 LYS A 618 -15.818 13.897 -28.903 1.00 25.00 H new ATOM 0 HZ3 LYS A 618 -17.182 13.309 -29.726 1.00 25.00 H new ATOM 359 N VAL A 619 -9.513 9.996 -27.150 1.00 25.00 N ATOM 360 CA VAL A 619 -8.835 8.748 -26.789 1.00 25.00 C ATOM 361 C VAL A 619 -9.315 8.483 -25.365 1.00 25.00 C ATOM 362 O VAL A 619 -9.505 9.423 -24.606 1.00 25.00 O ATOM 363 CB VAL A 619 -7.268 8.856 -26.952 1.00 25.00 C ATOM 364 CG1 VAL A 619 -6.831 10.298 -27.306 1.00 25.00 C ATOM 365 CG2 VAL A 619 -6.519 8.343 -25.717 1.00 25.00 C ATOM 0 H VAL A 619 -9.196 10.811 -26.625 1.00 25.00 H new ATOM 0 HA VAL A 619 -9.076 7.911 -27.444 1.00 25.00 H new ATOM 0 HB VAL A 619 -6.997 8.208 -27.786 1.00 25.00 H new ATOM 0 HG11 VAL A 619 -5.747 10.334 -27.410 1.00 25.00 H new ATOM 0 HG12 VAL A 619 -7.296 10.599 -28.245 1.00 25.00 H new ATOM 0 HG13 VAL A 619 -7.142 10.978 -26.513 1.00 25.00 H new ATOM 0 HG21 VAL A 619 -5.445 8.438 -25.877 1.00 25.00 H new ATOM 0 HG22 VAL A 619 -6.809 8.930 -24.846 1.00 25.00 H new ATOM 0 HG23 VAL A 619 -6.770 7.296 -25.549 1.00 25.00 H new ATOM 375 N ASN A 620 -9.556 7.229 -25.008 1.00 25.00 N ATOM 376 CA ASN A 620 -10.135 6.924 -23.699 1.00 25.00 C ATOM 377 C ASN A 620 -9.094 6.963 -22.590 1.00 25.00 C ATOM 378 O ASN A 620 -7.900 6.782 -22.816 1.00 25.00 O ATOM 379 CB ASN A 620 -10.846 5.573 -23.708 1.00 25.00 C ATOM 380 CG ASN A 620 -12.326 5.710 -23.975 1.00 25.00 C ATOM 381 OD1 ASN A 620 -13.142 5.213 -23.233 1.00 25.00 O ATOM 382 ND2 ASN A 620 -12.673 6.398 -25.035 1.00 25.00 N ATOM 0 H ASN A 620 -9.365 6.415 -25.593 1.00 25.00 H new ATOM 0 HA ASN A 620 -10.870 7.703 -23.494 1.00 25.00 H new ATOM 0 HB2 ASN A 620 -10.399 4.934 -24.469 1.00 25.00 H new ATOM 0 HB3 ASN A 620 -10.696 5.079 -22.748 1.00 25.00 H new ATOM 0 HD21 ASN A 620 -13.660 6.529 -25.257 1.00 25.00 H new ATOM 0 HD22 ASN A 620 -11.956 6.802 -25.638 1.00 25.00 H new ATOM 389 N LEU A 621 -9.570 7.229 -21.389 1.00 25.00 N ATOM 390 CA LEU A 621 -8.725 7.311 -20.214 1.00 25.00 C ATOM 391 C LEU A 621 -9.245 6.372 -19.125 1.00 25.00 C ATOM 392 O LEU A 621 -10.433 6.071 -19.076 1.00 25.00 O ATOM 393 CB LEU A 621 -8.665 8.750 -19.740 1.00 25.00 C ATOM 394 CG LEU A 621 -7.339 9.193 -19.124 1.00 25.00 C ATOM 395 CD1 LEU A 621 -6.217 9.288 -20.163 1.00 25.00 C ATOM 396 CD2 LEU A 621 -7.563 10.545 -18.497 1.00 25.00 C ATOM 0 H LEU A 621 -10.559 7.395 -21.200 1.00 25.00 H new ATOM 0 HA LEU A 621 -7.712 6.992 -20.460 1.00 25.00 H new ATOM 0 HB2 LEU A 621 -8.886 9.401 -20.586 1.00 25.00 H new ATOM 0 HB3 LEU A 621 -9.455 8.904 -19.005 1.00 25.00 H new ATOM 0 HG LEU A 621 -7.025 8.453 -18.388 1.00 25.00 H new ATOM 0 HD11 LEU A 621 -5.296 9.607 -19.675 1.00 25.00 H new ATOM 0 HD12 LEU A 621 -6.065 8.312 -20.624 1.00 25.00 H new ATOM 0 HD13 LEU A 621 -6.491 10.013 -20.929 1.00 25.00 H new ATOM 0 HD21 LEU A 621 -6.635 10.895 -18.045 1.00 25.00 H new ATOM 0 HD22 LEU A 621 -7.883 11.252 -19.262 1.00 25.00 H new ATOM 0 HD23 LEU A 621 -8.333 10.467 -17.730 1.00 25.00 H new ATOM 408 N ILE A 622 -8.362 5.899 -18.260 1.00 25.00 N ATOM 409 CA ILE A 622 -8.786 5.086 -17.120 1.00 25.00 C ATOM 410 C ILE A 622 -9.642 6.030 -16.253 1.00 25.00 C ATOM 411 O ILE A 622 -9.233 7.145 -15.981 1.00 25.00 O ATOM 412 CB ILE A 622 -7.554 4.571 -16.306 1.00 25.00 C ATOM 413 CG1 ILE A 622 -6.694 3.617 -17.142 1.00 25.00 C ATOM 414 CG2 ILE A 622 -7.977 3.834 -15.043 1.00 25.00 C ATOM 415 CD1 ILE A 622 -5.285 4.087 -17.306 1.00 25.00 C ATOM 0 H ILE A 622 -7.356 6.059 -18.320 1.00 25.00 H new ATOM 0 HA ILE A 622 -9.337 4.202 -17.440 1.00 25.00 H new ATOM 0 HB ILE A 622 -6.979 5.457 -16.037 1.00 25.00 H new ATOM 0 HG12 ILE A 622 -6.690 2.634 -16.671 1.00 25.00 H new ATOM 0 HG13 ILE A 622 -7.147 3.497 -18.126 1.00 25.00 H new ATOM 0 HG21 ILE A 622 -7.091 3.493 -14.507 1.00 25.00 H new ATOM 0 HG22 ILE A 622 -8.551 4.506 -14.405 1.00 25.00 H new ATOM 0 HG23 ILE A 622 -8.592 2.975 -15.312 1.00 25.00 H new ATOM 0 HD11 ILE A 622 -4.729 3.368 -17.907 1.00 25.00 H new ATOM 0 HD12 ILE A 622 -5.280 5.057 -17.804 1.00 25.00 H new ATOM 0 HD13 ILE A 622 -4.816 4.180 -16.326 1.00 25.00 H new ATOM 427 N LYS A 623 -10.824 5.590 -15.835 1.00 25.00 N ATOM 428 CA LYS A 623 -11.703 6.422 -14.991 1.00 25.00 C ATOM 429 C LYS A 623 -12.081 5.799 -13.650 1.00 25.00 C ATOM 430 O LYS A 623 -12.969 6.282 -12.961 1.00 25.00 O ATOM 431 CB LYS A 623 -12.949 6.837 -15.787 1.00 25.00 C ATOM 432 CG LYS A 623 -13.815 5.699 -16.329 1.00 25.00 C ATOM 433 CD LYS A 623 -14.937 5.327 -15.391 1.00 25.00 C ATOM 434 CE LYS A 623 -15.847 4.371 -16.098 1.00 25.00 C ATOM 435 NZ LYS A 623 -16.888 5.124 -16.870 1.00 25.00 N ATOM 0 H LYS A 623 -11.202 4.670 -16.060 1.00 25.00 H new ATOM 0 HA LYS A 623 -11.121 7.304 -14.725 1.00 25.00 H new ATOM 0 HB2 LYS A 623 -13.570 7.465 -15.148 1.00 25.00 H new ATOM 0 HB3 LYS A 623 -12.629 7.454 -16.627 1.00 25.00 H new ATOM 0 HG2 LYS A 623 -14.233 5.992 -17.292 1.00 25.00 H new ATOM 0 HG3 LYS A 623 -13.190 4.824 -16.507 1.00 25.00 H new ATOM 0 HD2 LYS A 623 -14.538 4.871 -14.485 1.00 25.00 H new ATOM 0 HD3 LYS A 623 -15.486 6.217 -15.085 1.00 25.00 H new ATOM 0 HE2 LYS A 623 -15.270 3.739 -16.773 1.00 25.00 H new ATOM 0 HE3 LYS A 623 -16.326 3.711 -15.375 1.00 25.00 H new ATOM 0 HZ1 LYS A 623 -17.118 4.604 -17.741 1.00 25.00 H new ATOM 0 HZ2 LYS A 623 -17.746 5.224 -16.290 1.00 25.00 H new ATOM 0 HZ3 LYS A 623 -16.524 6.067 -17.115 1.00 25.00 H new ATOM 449 N GLN A 624 -11.410 4.723 -13.289 1.00 25.00 N ATOM 450 CA GLN A 624 -11.710 3.992 -12.061 1.00 25.00 C ATOM 451 C GLN A 624 -10.417 3.365 -11.569 1.00 25.00 C ATOM 452 O GLN A 624 -9.432 3.366 -12.302 1.00 25.00 O ATOM 453 CB GLN A 624 -12.771 2.901 -12.321 1.00 25.00 C ATOM 454 CG GLN A 624 -12.327 1.751 -13.255 1.00 25.00 C ATOM 455 CD GLN A 624 -12.263 2.147 -14.719 1.00 25.00 C ATOM 456 OE1 GLN A 624 -13.272 2.391 -15.354 1.00 25.00 O ATOM 457 NE2 GLN A 624 -11.072 2.202 -15.262 1.00 25.00 N ATOM 0 H GLN A 624 -10.643 4.327 -13.832 1.00 25.00 H new ATOM 0 HA GLN A 624 -12.115 4.670 -11.310 1.00 25.00 H new ATOM 0 HB2 GLN A 624 -13.070 2.474 -11.364 1.00 25.00 H new ATOM 0 HB3 GLN A 624 -13.655 3.373 -12.749 1.00 25.00 H new ATOM 0 HG2 GLN A 624 -11.346 1.397 -12.940 1.00 25.00 H new ATOM 0 HG3 GLN A 624 -13.018 0.916 -13.143 1.00 25.00 H new ATOM 0 HE21 GLN A 624 -10.246 1.992 -14.702 1.00 25.00 H new ATOM 0 HE22 GLN A 624 -10.971 2.455 -16.245 1.00 25.00 H new ATOM 466 N ASP A 625 -10.418 2.826 -10.358 1.00 25.00 N ATOM 467 CA ASP A 625 -9.243 2.142 -9.818 1.00 25.00 C ATOM 468 C ASP A 625 -8.832 1.037 -10.780 1.00 25.00 C ATOM 469 O ASP A 625 -9.661 0.271 -11.259 1.00 25.00 O ATOM 470 CB ASP A 625 -9.532 1.530 -8.445 1.00 25.00 C ATOM 471 CG ASP A 625 -9.568 2.566 -7.341 1.00 25.00 C ATOM 472 OD1 ASP A 625 -8.997 2.295 -6.269 1.00 25.00 O ATOM 473 OD2 ASP A 625 -10.152 3.652 -7.542 1.00 25.00 O ATOM 0 H ASP A 625 -11.219 2.847 -9.727 1.00 25.00 H new ATOM 0 HA ASP A 625 -8.442 2.872 -9.702 1.00 25.00 H new ATOM 0 HB2 ASP A 625 -10.488 1.007 -8.478 1.00 25.00 H new ATOM 0 HB3 ASP A 625 -8.769 0.786 -8.215 1.00 25.00 H new ATOM 478 N ASP A 626 -7.544 0.972 -11.078 1.00 25.00 N ATOM 479 CA ASP A 626 -7.045 -0.004 -12.042 1.00 25.00 C ATOM 480 C ASP A 626 -6.725 -1.333 -11.421 1.00 25.00 C ATOM 481 O ASP A 626 -6.967 -2.397 -11.981 1.00 25.00 O ATOM 482 CB ASP A 626 -5.750 0.492 -12.638 1.00 25.00 C ATOM 483 CG ASP A 626 -5.514 -0.069 -14.012 1.00 25.00 C ATOM 484 OD1 ASP A 626 -5.653 0.651 -15.017 1.00 25.00 O ATOM 485 OD2 ASP A 626 -5.170 -1.267 -14.091 1.00 25.00 O ATOM 0 H ASP A 626 -6.829 1.576 -10.672 1.00 25.00 H new ATOM 0 HA ASP A 626 -7.838 -0.126 -12.780 1.00 25.00 H new ATOM 0 HB2 ASP A 626 -5.767 1.581 -12.688 1.00 25.00 H new ATOM 0 HB3 ASP A 626 -4.921 0.216 -11.986 1.00 25.00 H new ATOM 490 N GLY A 627 -6.130 -1.240 -10.250 1.00 25.00 N ATOM 491 CA GLY A 627 -5.655 -2.409 -9.559 1.00 25.00 C ATOM 492 C GLY A 627 -6.049 -2.328 -8.111 1.00 25.00 C ATOM 493 O GLY A 627 -7.082 -2.813 -7.689 1.00 25.00 O ATOM 0 H GLY A 627 -5.966 -0.361 -9.759 1.00 25.00 H new ATOM 0 HA2 GLY A 627 -6.074 -3.308 -10.011 1.00 25.00 H new ATOM 0 HA3 GLY A 627 -4.571 -2.483 -9.649 1.00 25.00 H new ATOM 497 N GLY A 628 -5.166 -1.702 -7.356 1.00 25.00 N ATOM 498 CA GLY A 628 -5.370 -1.542 -5.919 1.00 25.00 C ATOM 499 C GLY A 628 -5.756 -0.146 -5.480 1.00 25.00 C ATOM 500 O GLY A 628 -6.225 0.049 -4.366 1.00 25.00 O ATOM 0 H GLY A 628 -4.300 -1.295 -7.708 1.00 25.00 H new ATOM 0 HA2 GLY A 628 -6.147 -2.236 -5.598 1.00 25.00 H new ATOM 0 HA3 GLY A 628 -4.454 -1.829 -5.403 1.00 25.00 H new ATOM 504 N SER A 629 -5.510 0.836 -6.336 1.00 25.00 N ATOM 505 CA SER A 629 -5.736 2.237 -5.994 1.00 25.00 C ATOM 506 C SER A 629 -6.016 3.023 -7.269 1.00 25.00 C ATOM 507 O SER A 629 -5.699 2.537 -8.377 1.00 25.00 O ATOM 508 CB SER A 629 -4.477 2.795 -5.319 1.00 25.00 C ATOM 509 OG SER A 629 -4.142 2.028 -4.178 1.00 25.00 O ATOM 0 H SER A 629 -5.151 0.688 -7.279 1.00 25.00 H new ATOM 0 HA SER A 629 -6.586 2.323 -5.317 1.00 25.00 H new ATOM 0 HB2 SER A 629 -3.646 2.789 -6.025 1.00 25.00 H new ATOM 0 HB3 SER A 629 -4.642 3.833 -5.030 1.00 25.00 H new ATOM 0 HG SER A 629 -3.336 2.397 -3.761 1.00 25.00 H new ATOM 515 N PRO A 630 -6.585 4.239 -7.150 1.00 25.00 N ATOM 516 CA PRO A 630 -6.773 5.023 -8.370 1.00 25.00 C ATOM 517 C PRO A 630 -5.458 5.565 -8.915 1.00 25.00 C ATOM 518 O PRO A 630 -4.395 5.469 -8.286 1.00 25.00 O ATOM 519 CB PRO A 630 -7.686 6.161 -7.905 1.00 25.00 C ATOM 520 CG PRO A 630 -7.302 6.371 -6.503 1.00 25.00 C ATOM 521 CD PRO A 630 -7.070 4.982 -5.967 1.00 25.00 C ATOM 0 HA PRO A 630 -7.188 4.433 -9.187 1.00 25.00 H new ATOM 0 HB2 PRO A 630 -7.536 7.062 -8.500 1.00 25.00 H new ATOM 0 HB3 PRO A 630 -8.738 5.891 -7.995 1.00 25.00 H new ATOM 0 HG2 PRO A 630 -6.403 6.983 -6.424 1.00 25.00 H new ATOM 0 HG3 PRO A 630 -8.087 6.885 -5.949 1.00 25.00 H new ATOM 0 HD2 PRO A 630 -6.336 4.979 -5.161 1.00 25.00 H new ATOM 0 HD3 PRO A 630 -7.986 4.547 -5.566 1.00 25.00 H new ATOM 529 N ILE A 631 -5.538 6.130 -10.105 1.00 25.00 N ATOM 530 CA ILE A 631 -4.384 6.713 -10.771 1.00 25.00 C ATOM 531 C ILE A 631 -4.141 8.087 -10.131 1.00 25.00 C ATOM 532 O ILE A 631 -5.089 8.762 -9.753 1.00 25.00 O ATOM 533 CB ILE A 631 -4.666 6.829 -12.304 1.00 25.00 C ATOM 534 CG1 ILE A 631 -4.311 5.516 -13.047 1.00 25.00 C ATOM 535 CG2 ILE A 631 -3.854 7.949 -12.933 1.00 25.00 C ATOM 536 CD1 ILE A 631 -5.043 4.280 -12.616 1.00 25.00 C ATOM 0 H ILE A 631 -6.404 6.199 -10.639 1.00 25.00 H new ATOM 0 HA ILE A 631 -3.495 6.093 -10.655 1.00 25.00 H new ATOM 0 HB ILE A 631 -5.731 7.037 -12.403 1.00 25.00 H new ATOM 0 HG12 ILE A 631 -4.494 5.667 -14.111 1.00 25.00 H new ATOM 0 HG13 ILE A 631 -3.242 5.337 -12.930 1.00 25.00 H new ATOM 0 HG21 ILE A 631 -4.073 8.003 -13.999 1.00 25.00 H new ATOM 0 HG22 ILE A 631 -4.114 8.896 -12.461 1.00 25.00 H new ATOM 0 HG23 ILE A 631 -2.791 7.752 -12.791 1.00 25.00 H new ATOM 0 HD11 ILE A 631 -4.706 3.431 -13.211 1.00 25.00 H new ATOM 0 HD12 ILE A 631 -4.842 4.087 -11.562 1.00 25.00 H new ATOM 0 HD13 ILE A 631 -6.114 4.422 -12.761 1.00 25.00 H new ATOM 548 N ARG A 632 -2.883 8.499 -10.004 1.00 25.00 N ATOM 549 CA ARG A 632 -2.564 9.820 -9.455 1.00 25.00 C ATOM 550 C ARG A 632 -2.671 10.858 -10.593 1.00 25.00 C ATOM 551 O ARG A 632 -3.373 11.853 -10.446 1.00 25.00 O ATOM 552 CB ARG A 632 -1.150 9.847 -8.838 1.00 25.00 C ATOM 553 CG ARG A 632 -1.008 9.270 -7.379 1.00 25.00 C ATOM 554 CD ARG A 632 0.418 9.493 -6.860 1.00 25.00 C ATOM 555 NE ARG A 632 0.716 10.902 -6.543 1.00 25.00 N ATOM 556 CZ ARG A 632 1.609 11.663 -7.170 1.00 25.00 C ATOM 557 NH1 ARG A 632 2.308 11.248 -8.194 1.00 25.00 N ATOM 558 NH2 ARG A 632 1.805 12.880 -6.743 1.00 25.00 N ATOM 0 H ARG A 632 -2.070 7.944 -10.271 1.00 25.00 H new ATOM 0 HA ARG A 632 -3.269 10.057 -8.658 1.00 25.00 H new ATOM 0 HB2 ARG A 632 -0.482 9.288 -9.493 1.00 25.00 H new ATOM 0 HB3 ARG A 632 -0.800 10.879 -8.832 1.00 25.00 H new ATOM 0 HG2 ARG A 632 -1.724 9.755 -6.716 1.00 25.00 H new ATOM 0 HG3 ARG A 632 -1.242 8.205 -7.376 1.00 25.00 H new ATOM 0 HD2 ARG A 632 0.569 8.888 -5.966 1.00 25.00 H new ATOM 0 HD3 ARG A 632 1.128 9.139 -7.608 1.00 25.00 H new ATOM 0 HE ARG A 632 0.193 11.329 -5.778 1.00 25.00 H new ATOM 0 HH11 ARG A 632 2.181 10.300 -8.548 1.00 25.00 H new ATOM 0 HH12 ARG A 632 2.981 11.872 -8.639 1.00 25.00 H new ATOM 0 HH21 ARG A 632 1.278 13.231 -5.943 1.00 25.00 H new ATOM 0 HH22 ARG A 632 2.485 13.481 -7.209 1.00 25.00 H new ATOM 572 N HIS A 633 -1.991 10.621 -11.714 1.00 25.00 N ATOM 573 CA HIS A 633 -2.004 11.545 -12.868 1.00 25.00 C ATOM 574 C HIS A 633 -1.975 10.817 -14.220 1.00 25.00 C ATOM 575 O HIS A 633 -1.625 9.642 -14.297 1.00 25.00 O ATOM 576 CB HIS A 633 -0.763 12.447 -12.850 1.00 25.00 C ATOM 577 CG HIS A 633 -0.530 13.144 -11.548 1.00 25.00 C ATOM 578 ND1 HIS A 633 0.567 12.938 -10.757 1.00 25.00 N ATOM 579 CD2 HIS A 633 -1.270 14.079 -10.890 1.00 25.00 C ATOM 580 CE1 HIS A 633 0.474 13.730 -9.701 1.00 25.00 C ATOM 581 NE2 HIS A 633 -0.631 14.446 -9.721 1.00 25.00 N ATOM 0 H HIS A 633 -1.416 9.791 -11.856 1.00 25.00 H new ATOM 0 HA HIS A 633 -2.930 12.111 -12.771 1.00 25.00 H new ATOM 0 HB2 HIS A 633 0.114 11.845 -13.089 1.00 25.00 H new ATOM 0 HB3 HIS A 633 -0.860 13.195 -13.637 1.00 25.00 H new ATOM 0 HD1 HIS A 633 1.327 12.285 -10.949 1.00 25.00 H new ATOM 0 HD2 HIS A 633 -2.215 14.475 -11.231 1.00 25.00 H new ATOM 0 HE1 HIS A 633 1.215 13.783 -8.917 1.00 25.00 H new ATOM 589 N TYR A 634 -2.307 11.530 -15.289 1.00 25.00 N ATOM 590 CA TYR A 634 -2.221 10.991 -16.649 1.00 25.00 C ATOM 591 C TYR A 634 -1.331 11.885 -17.478 1.00 25.00 C ATOM 592 O TYR A 634 -1.329 13.097 -17.291 1.00 25.00 O ATOM 593 CB TYR A 634 -3.592 10.936 -17.310 1.00 25.00 C ATOM 594 CG TYR A 634 -4.513 9.975 -16.630 1.00 25.00 C ATOM 595 CD1 TYR A 634 -5.539 10.436 -15.787 1.00 25.00 C ATOM 596 CD2 TYR A 634 -4.362 8.587 -16.811 1.00 25.00 C ATOM 597 CE1 TYR A 634 -6.385 9.523 -15.125 1.00 25.00 C ATOM 598 CE2 TYR A 634 -5.210 7.679 -16.141 1.00 25.00 C ATOM 599 CZ TYR A 634 -6.203 8.163 -15.290 1.00 25.00 C ATOM 600 OH TYR A 634 -6.998 7.303 -14.592 1.00 25.00 O ATOM 0 H TYR A 634 -2.642 12.492 -15.243 1.00 25.00 H new ATOM 0 HA TYR A 634 -1.817 9.980 -16.589 1.00 25.00 H new ATOM 0 HB2 TYR A 634 -4.037 11.931 -17.300 1.00 25.00 H new ATOM 0 HB3 TYR A 634 -3.477 10.648 -18.355 1.00 25.00 H new ATOM 0 HD1 TYR A 634 -5.680 11.497 -15.645 1.00 25.00 H new ATOM 0 HD2 TYR A 634 -3.591 8.214 -17.468 1.00 25.00 H new ATOM 0 HE1 TYR A 634 -7.177 9.887 -14.488 1.00 25.00 H new ATOM 0 HE2 TYR A 634 -5.090 6.616 -16.287 1.00 25.00 H new ATOM 0 HH TYR A 634 -7.931 7.424 -14.867 1.00 25.00 H new ATOM 610 N LEU A 635 -0.579 11.279 -18.386 1.00 25.00 N ATOM 611 CA LEU A 635 0.319 12.013 -19.268 1.00 25.00 C ATOM 612 C LEU A 635 0.046 11.565 -20.701 1.00 25.00 C ATOM 613 O LEU A 635 -0.045 10.364 -20.970 1.00 25.00 O ATOM 614 CB LEU A 635 1.789 11.739 -18.908 1.00 25.00 C ATOM 615 CG LEU A 635 2.253 12.062 -17.472 1.00 25.00 C ATOM 616 CD1 LEU A 635 2.113 10.852 -16.523 1.00 25.00 C ATOM 617 CD2 LEU A 635 3.717 12.492 -17.503 1.00 25.00 C ATOM 0 H LEU A 635 -0.573 10.270 -18.532 1.00 25.00 H new ATOM 0 HA LEU A 635 0.143 13.083 -19.159 1.00 25.00 H new ATOM 0 HB2 LEU A 635 1.988 10.684 -19.094 1.00 25.00 H new ATOM 0 HB3 LEU A 635 2.414 12.307 -19.597 1.00 25.00 H new ATOM 0 HG LEU A 635 1.615 12.861 -17.094 1.00 25.00 H new ATOM 0 HD11 LEU A 635 2.452 11.131 -15.525 1.00 25.00 H new ATOM 0 HD12 LEU A 635 1.068 10.544 -16.478 1.00 25.00 H new ATOM 0 HD13 LEU A 635 2.719 10.026 -16.895 1.00 25.00 H new ATOM 0 HD21 LEU A 635 4.050 12.722 -16.491 1.00 25.00 H new ATOM 0 HD22 LEU A 635 4.325 11.684 -17.911 1.00 25.00 H new ATOM 0 HD23 LEU A 635 3.823 13.378 -18.129 1.00 25.00 H new ATOM 629 N VAL A 636 -0.077 12.514 -21.617 1.00 25.00 N ATOM 630 CA VAL A 636 -0.312 12.205 -23.030 1.00 25.00 C ATOM 631 C VAL A 636 0.778 12.883 -23.853 1.00 25.00 C ATOM 632 O VAL A 636 1.021 14.076 -23.691 1.00 25.00 O ATOM 633 CB VAL A 636 -1.706 12.707 -23.517 1.00 25.00 C ATOM 634 CG1 VAL A 636 -2.018 12.147 -24.910 1.00 25.00 C ATOM 635 CG2 VAL A 636 -2.816 12.299 -22.530 1.00 25.00 C ATOM 0 H VAL A 636 -0.018 13.511 -21.411 1.00 25.00 H new ATOM 0 HA VAL A 636 -0.291 11.122 -23.154 1.00 25.00 H new ATOM 0 HB VAL A 636 -1.671 13.795 -23.568 1.00 25.00 H new ATOM 0 HG11 VAL A 636 -2.994 12.506 -25.236 1.00 25.00 H new ATOM 0 HG12 VAL A 636 -1.255 12.478 -25.615 1.00 25.00 H new ATOM 0 HG13 VAL A 636 -2.027 11.058 -24.871 1.00 25.00 H new ATOM 0 HG21 VAL A 636 -3.777 12.662 -22.894 1.00 25.00 H new ATOM 0 HG22 VAL A 636 -2.846 11.213 -22.445 1.00 25.00 H new ATOM 0 HG23 VAL A 636 -2.611 12.734 -21.552 1.00 25.00 H new ATOM 645 N ARG A 637 1.435 12.120 -24.717 1.00 25.00 N ATOM 646 CA ARG A 637 2.536 12.615 -25.538 1.00 25.00 C ATOM 647 C ARG A 637 2.192 12.320 -26.991 1.00 25.00 C ATOM 648 O ARG A 637 2.114 11.160 -27.375 1.00 25.00 O ATOM 649 CB ARG A 637 3.828 11.890 -25.133 1.00 25.00 C ATOM 650 CG ARG A 637 5.093 12.473 -25.750 1.00 25.00 C ATOM 651 CD ARG A 637 6.231 11.457 -25.774 1.00 25.00 C ATOM 652 NE ARG A 637 5.969 10.364 -26.730 1.00 25.00 N ATOM 653 CZ ARG A 637 6.796 9.358 -26.996 1.00 25.00 C ATOM 654 NH1 ARG A 637 7.968 9.247 -26.421 1.00 25.00 N ATOM 655 NH2 ARG A 637 6.438 8.448 -27.857 1.00 25.00 N ATOM 0 H ARG A 637 1.219 11.135 -24.870 1.00 25.00 H new ATOM 0 HA ARG A 637 2.684 13.686 -25.401 1.00 25.00 H new ATOM 0 HB2 ARG A 637 3.921 11.917 -24.047 1.00 25.00 H new ATOM 0 HB3 ARG A 637 3.748 10.841 -25.420 1.00 25.00 H new ATOM 0 HG2 ARG A 637 4.882 12.806 -26.766 1.00 25.00 H new ATOM 0 HG3 ARG A 637 5.402 13.352 -25.184 1.00 25.00 H new ATOM 0 HD2 ARG A 637 7.161 11.959 -26.041 1.00 25.00 H new ATOM 0 HD3 ARG A 637 6.369 11.042 -24.776 1.00 25.00 H new ATOM 0 HE ARG A 637 5.079 10.382 -27.228 1.00 25.00 H new ATOM 0 HH11 ARG A 637 8.272 9.947 -25.744 1.00 25.00 H new ATOM 0 HH12 ARG A 637 8.576 8.461 -26.650 1.00 25.00 H new ATOM 0 HH21 ARG A 637 5.531 8.512 -28.319 1.00 25.00 H new ATOM 0 HH22 ARG A 637 7.065 7.672 -28.069 1.00 25.00 H new ATOM 669 N TYR A 638 1.971 13.345 -27.797 1.00 25.00 N ATOM 670 CA TYR A 638 1.563 13.138 -29.194 1.00 25.00 C ATOM 671 C TYR A 638 2.383 13.986 -30.152 1.00 25.00 C ATOM 672 O TYR A 638 2.839 15.065 -29.792 1.00 25.00 O ATOM 673 CB TYR A 638 0.057 13.403 -29.372 1.00 25.00 C ATOM 674 CG TYR A 638 -0.407 14.819 -29.084 1.00 25.00 C ATOM 675 CD1 TYR A 638 -0.838 15.658 -30.135 1.00 25.00 C ATOM 676 CD2 TYR A 638 -0.436 15.328 -27.767 1.00 25.00 C ATOM 677 CE1 TYR A 638 -1.290 16.980 -29.874 1.00 25.00 C ATOM 678 CE2 TYR A 638 -0.873 16.651 -27.509 1.00 25.00 C ATOM 679 CZ TYR A 638 -1.296 17.463 -28.566 1.00 25.00 C ATOM 680 OH TYR A 638 -1.708 18.746 -28.318 1.00 25.00 O ATOM 0 H TYR A 638 2.063 14.323 -27.521 1.00 25.00 H new ATOM 0 HA TYR A 638 1.756 12.094 -29.439 1.00 25.00 H new ATOM 0 HB2 TYR A 638 -0.217 13.153 -30.397 1.00 25.00 H new ATOM 0 HB3 TYR A 638 -0.491 12.722 -28.721 1.00 25.00 H new ATOM 0 HD1 TYR A 638 -0.824 15.290 -31.150 1.00 25.00 H new ATOM 0 HD2 TYR A 638 -0.121 14.701 -26.946 1.00 25.00 H new ATOM 0 HE1 TYR A 638 -1.627 17.608 -30.685 1.00 25.00 H new ATOM 0 HE2 TYR A 638 -0.879 17.031 -26.498 1.00 25.00 H new ATOM 0 HH TYR A 638 -2.589 18.891 -28.722 1.00 25.00 H new ATOM 690 N ARG A 639 2.570 13.476 -31.360 1.00 25.00 N ATOM 691 CA ARG A 639 3.392 14.113 -32.398 1.00 25.00 C ATOM 692 C ARG A 639 2.564 14.053 -33.661 1.00 25.00 C ATOM 693 O ARG A 639 1.756 13.147 -33.807 1.00 25.00 O ATOM 694 CB ARG A 639 4.693 13.313 -32.576 1.00 25.00 C ATOM 695 CG ARG A 639 5.638 13.788 -33.660 1.00 25.00 C ATOM 696 CD ARG A 639 6.560 12.681 -34.132 1.00 25.00 C ATOM 697 NE ARG A 639 7.548 13.239 -35.067 1.00 25.00 N ATOM 698 CZ ARG A 639 8.690 13.811 -34.707 1.00 25.00 C ATOM 699 NH1 ARG A 639 9.061 13.875 -33.460 1.00 25.00 N ATOM 700 NH2 ARG A 639 9.468 14.335 -35.607 1.00 25.00 N ATOM 0 H ARG A 639 2.152 12.595 -31.659 1.00 25.00 H new ATOM 0 HA ARG A 639 3.662 15.138 -32.145 1.00 25.00 H new ATOM 0 HB2 ARG A 639 5.231 13.321 -31.628 1.00 25.00 H new ATOM 0 HB3 ARG A 639 4.430 12.276 -32.784 1.00 25.00 H new ATOM 0 HG2 ARG A 639 5.061 14.165 -34.505 1.00 25.00 H new ATOM 0 HG3 ARG A 639 6.233 14.620 -33.284 1.00 25.00 H new ATOM 0 HD2 ARG A 639 7.065 12.224 -33.281 1.00 25.00 H new ATOM 0 HD3 ARG A 639 5.984 11.895 -34.620 1.00 25.00 H new ATOM 0 HE ARG A 639 7.341 13.182 -36.064 1.00 25.00 H new ATOM 0 HH11 ARG A 639 8.468 13.479 -32.731 1.00 25.00 H new ATOM 0 HH12 ARG A 639 9.945 14.321 -33.213 1.00 25.00 H new ATOM 0 HH21 ARG A 639 9.201 14.307 -36.591 1.00 25.00 H new ATOM 0 HH22 ARG A 639 10.346 14.774 -35.329 1.00 25.00 H new ATOM 714 N ALA A 640 2.767 14.992 -34.567 1.00 25.00 N ATOM 715 CA ALA A 640 2.043 15.017 -35.826 1.00 25.00 C ATOM 716 C ALA A 640 3.054 15.225 -36.943 1.00 25.00 C ATOM 717 O ALA A 640 4.201 15.554 -36.673 1.00 25.00 O ATOM 718 CB ALA A 640 1.001 16.130 -35.803 1.00 25.00 C ATOM 0 H ALA A 640 3.434 15.755 -34.453 1.00 25.00 H new ATOM 0 HA ALA A 640 1.513 14.079 -35.989 1.00 25.00 H new ATOM 0 HB1 ALA A 640 0.462 16.143 -36.750 1.00 25.00 H new ATOM 0 HB2 ALA A 640 0.299 15.954 -34.988 1.00 25.00 H new ATOM 0 HB3 ALA A 640 1.497 17.089 -35.654 1.00 25.00 H new ATOM 724 N LEU A 641 2.643 15.051 -38.188 1.00 25.00 N ATOM 725 CA LEU A 641 3.551 15.258 -39.315 1.00 25.00 C ATOM 726 C LEU A 641 4.077 16.695 -39.309 1.00 25.00 C ATOM 727 O LEU A 641 5.228 16.945 -39.655 1.00 25.00 O ATOM 728 CB LEU A 641 2.827 14.958 -40.632 1.00 25.00 C ATOM 729 CG LEU A 641 3.403 13.790 -41.455 1.00 25.00 C ATOM 730 CD1 LEU A 641 3.360 12.454 -40.694 1.00 25.00 C ATOM 731 CD2 LEU A 641 2.617 13.655 -42.759 1.00 25.00 C ATOM 0 H LEU A 641 1.697 14.770 -38.447 1.00 25.00 H new ATOM 0 HA LEU A 641 4.398 14.578 -39.219 1.00 25.00 H new ATOM 0 HB2 LEU A 641 1.782 14.743 -40.411 1.00 25.00 H new ATOM 0 HB3 LEU A 641 2.844 15.857 -41.248 1.00 25.00 H new ATOM 0 HG LEU A 641 4.450 14.017 -41.656 1.00 25.00 H new ATOM 0 HD11 LEU A 641 3.778 11.665 -41.320 1.00 25.00 H new ATOM 0 HD12 LEU A 641 3.944 12.538 -39.778 1.00 25.00 H new ATOM 0 HD13 LEU A 641 2.327 12.210 -40.445 1.00 25.00 H new ATOM 0 HD21 LEU A 641 3.022 12.829 -43.344 1.00 25.00 H new ATOM 0 HD22 LEU A 641 1.569 13.460 -42.533 1.00 25.00 H new ATOM 0 HD23 LEU A 641 2.699 14.579 -43.331 1.00 25.00 H new ATOM 743 N SER A 642 3.230 17.628 -38.897 1.00 25.00 N ATOM 744 CA SER A 642 3.597 19.040 -38.810 1.00 25.00 C ATOM 745 C SER A 642 4.000 19.506 -37.404 1.00 25.00 C ATOM 746 O SER A 642 4.245 20.694 -37.198 1.00 25.00 O ATOM 747 CB SER A 642 2.415 19.887 -39.274 1.00 25.00 C ATOM 748 OG SER A 642 1.785 19.287 -40.393 1.00 25.00 O ATOM 0 H SER A 642 2.270 17.431 -38.613 1.00 25.00 H new ATOM 0 HA SER A 642 4.474 19.164 -39.445 1.00 25.00 H new ATOM 0 HB2 SER A 642 1.698 19.998 -38.461 1.00 25.00 H new ATOM 0 HB3 SER A 642 2.757 20.888 -39.535 1.00 25.00 H new ATOM 0 HG SER A 642 1.207 18.556 -40.090 1.00 25.00 H new ATOM 754 N SER A 643 4.046 18.606 -36.425 1.00 25.00 N ATOM 755 CA SER A 643 4.389 19.003 -35.049 1.00 25.00 C ATOM 756 C SER A 643 5.212 17.988 -34.261 1.00 25.00 C ATOM 757 O SER A 643 4.950 16.804 -34.292 1.00 25.00 O ATOM 758 CB SER A 643 3.112 19.275 -34.258 1.00 25.00 C ATOM 759 OG SER A 643 2.385 20.350 -34.822 1.00 25.00 O ATOM 0 H SER A 643 3.855 17.612 -36.548 1.00 25.00 H new ATOM 0 HA SER A 643 5.011 19.890 -35.167 1.00 25.00 H new ATOM 0 HB2 SER A 643 2.491 18.379 -34.244 1.00 25.00 H new ATOM 0 HB3 SER A 643 3.363 19.505 -33.223 1.00 25.00 H new ATOM 0 HG SER A 643 1.571 20.504 -34.299 1.00 25.00 H new ATOM 765 N GLU A 644 6.195 18.478 -33.527 1.00 25.00 N ATOM 766 CA GLU A 644 7.031 17.634 -32.666 1.00 25.00 C ATOM 767 C GLU A 644 6.221 17.104 -31.476 1.00 25.00 C ATOM 768 O GLU A 644 5.094 17.542 -31.238 1.00 25.00 O ATOM 769 CB GLU A 644 8.223 18.448 -32.137 1.00 25.00 C ATOM 770 CG GLU A 644 9.563 18.102 -32.798 1.00 25.00 C ATOM 771 CD GLU A 644 9.994 16.656 -32.552 1.00 25.00 C ATOM 772 OE1 GLU A 644 10.763 16.116 -33.379 1.00 25.00 O ATOM 773 OE2 GLU A 644 9.556 16.044 -31.549 1.00 25.00 O ATOM 0 H GLU A 644 6.442 19.467 -33.505 1.00 25.00 H new ATOM 0 HA GLU A 644 7.389 16.791 -33.258 1.00 25.00 H new ATOM 0 HB2 GLU A 644 8.020 19.508 -32.287 1.00 25.00 H new ATOM 0 HB3 GLU A 644 8.309 18.289 -31.062 1.00 25.00 H new ATOM 0 HG2 GLU A 644 9.488 18.275 -33.871 1.00 25.00 H new ATOM 0 HG3 GLU A 644 10.333 18.774 -32.420 1.00 25.00 H new ATOM 780 N TRP A 645 6.806 16.174 -30.732 1.00 25.00 N ATOM 781 CA TRP A 645 6.167 15.597 -29.551 1.00 25.00 C ATOM 782 C TRP A 645 5.766 16.634 -28.504 1.00 25.00 C ATOM 783 O TRP A 645 6.612 17.290 -27.898 1.00 25.00 O ATOM 784 CB TRP A 645 7.122 14.621 -28.856 1.00 25.00 C ATOM 785 CG TRP A 645 7.389 13.372 -29.619 1.00 25.00 C ATOM 786 CD1 TRP A 645 8.517 13.046 -30.293 1.00 25.00 C ATOM 787 CD2 TRP A 645 6.501 12.252 -29.791 1.00 25.00 C ATOM 788 NE1 TRP A 645 8.421 11.813 -30.869 1.00 25.00 N ATOM 789 CE2 TRP A 645 7.189 11.292 -30.590 1.00 25.00 C ATOM 790 CE3 TRP A 645 5.180 11.974 -29.382 1.00 25.00 C ATOM 791 CZ2 TRP A 645 6.603 10.076 -30.971 1.00 25.00 C ATOM 792 CZ3 TRP A 645 4.586 10.750 -29.765 1.00 25.00 C ATOM 793 CH2 TRP A 645 5.310 9.814 -30.557 1.00 25.00 C ATOM 0 H TRP A 645 7.734 15.798 -30.927 1.00 25.00 H new ATOM 0 HA TRP A 645 5.269 15.105 -29.924 1.00 25.00 H new ATOM 0 HB2 TRP A 645 8.069 15.128 -28.671 1.00 25.00 H new ATOM 0 HB3 TRP A 645 6.707 14.356 -27.884 1.00 25.00 H new ATOM 0 HD1 TRP A 645 9.386 13.683 -30.366 1.00 25.00 H new ATOM 0 HE1 TRP A 645 9.149 11.355 -31.418 1.00 25.00 H new ATOM 0 HE3 TRP A 645 4.630 12.686 -28.785 1.00 25.00 H new ATOM 0 HZ2 TRP A 645 7.148 9.363 -31.572 1.00 25.00 H new ATOM 0 HZ3 TRP A 645 3.577 10.523 -29.455 1.00 25.00 H new ATOM 0 HH2 TRP A 645 4.841 8.883 -30.839 1.00 25.00 H new ATOM 804 N LYS A 646 4.470 16.750 -28.259 1.00 25.00 N ATOM 805 CA LYS A 646 3.972 17.574 -27.162 1.00 25.00 C ATOM 806 C LYS A 646 4.303 16.701 -25.956 1.00 25.00 C ATOM 807 O LYS A 646 4.033 15.503 -25.993 1.00 25.00 O ATOM 808 CB LYS A 646 2.464 17.827 -27.266 1.00 25.00 C ATOM 809 CG LYS A 646 2.063 18.907 -28.289 1.00 25.00 C ATOM 810 CD LYS A 646 2.076 18.388 -29.735 1.00 25.00 C ATOM 811 CE LYS A 646 1.732 19.477 -30.742 1.00 25.00 C ATOM 812 NZ LYS A 646 0.355 20.035 -30.551 1.00 25.00 N ATOM 0 H LYS A 646 3.743 16.286 -28.803 1.00 25.00 H new ATOM 0 HA LYS A 646 4.409 18.572 -27.133 1.00 25.00 H new ATOM 0 HB2 LYS A 646 1.970 16.893 -27.532 1.00 25.00 H new ATOM 0 HB3 LYS A 646 2.089 18.118 -26.285 1.00 25.00 H new ATOM 0 HG2 LYS A 646 1.066 19.277 -28.049 1.00 25.00 H new ATOM 0 HG3 LYS A 646 2.745 19.753 -28.205 1.00 25.00 H new ATOM 0 HD2 LYS A 646 3.061 17.982 -29.964 1.00 25.00 H new ATOM 0 HD3 LYS A 646 1.363 17.569 -29.831 1.00 25.00 H new ATOM 0 HE2 LYS A 646 2.460 20.284 -30.659 1.00 25.00 H new ATOM 0 HE3 LYS A 646 1.818 19.072 -31.750 1.00 25.00 H new ATOM 0 HZ1 LYS A 646 -0.183 19.942 -31.436 1.00 25.00 H new ATOM 0 HZ2 LYS A 646 -0.130 19.512 -29.794 1.00 25.00 H new ATOM 0 HZ3 LYS A 646 0.421 21.040 -30.290 1.00 25.00 H new ATOM 826 N PRO A 647 4.914 17.263 -24.902 1.00 25.00 N ATOM 827 CA PRO A 647 5.385 16.372 -23.833 1.00 25.00 C ATOM 828 C PRO A 647 4.337 15.793 -22.879 1.00 25.00 C ATOM 829 O PRO A 647 4.428 14.627 -22.506 1.00 25.00 O ATOM 830 CB PRO A 647 6.366 17.264 -23.068 1.00 25.00 C ATOM 831 CG PRO A 647 5.816 18.643 -23.230 1.00 25.00 C ATOM 832 CD PRO A 647 5.264 18.673 -24.639 1.00 25.00 C ATOM 0 HA PRO A 647 5.793 15.463 -24.276 1.00 25.00 H new ATOM 0 HB2 PRO A 647 6.425 16.980 -22.017 1.00 25.00 H new ATOM 0 HB3 PRO A 647 7.374 17.188 -23.476 1.00 25.00 H new ATOM 0 HG2 PRO A 647 5.037 18.848 -22.495 1.00 25.00 H new ATOM 0 HG3 PRO A 647 6.591 19.397 -23.092 1.00 25.00 H new ATOM 0 HD2 PRO A 647 4.393 19.324 -24.715 1.00 25.00 H new ATOM 0 HD3 PRO A 647 6.001 19.043 -25.351 1.00 25.00 H new ATOM 840 N GLU A 648 3.368 16.599 -22.465 1.00 25.00 N ATOM 841 CA GLU A 648 2.386 16.169 -21.477 1.00 25.00 C ATOM 842 C GLU A 648 1.088 16.953 -21.638 1.00 25.00 C ATOM 843 O GLU A 648 1.102 18.119 -22.037 1.00 25.00 O ATOM 844 CB GLU A 648 2.948 16.428 -20.065 1.00 25.00 C ATOM 845 CG GLU A 648 2.082 15.895 -18.918 1.00 25.00 C ATOM 846 CD GLU A 648 2.609 16.313 -17.556 1.00 25.00 C ATOM 847 OE1 GLU A 648 3.753 15.948 -17.215 1.00 25.00 O ATOM 848 OE2 GLU A 648 1.873 17.020 -16.832 1.00 25.00 O ATOM 0 H GLU A 648 3.241 17.555 -22.798 1.00 25.00 H new ATOM 0 HA GLU A 648 2.183 15.108 -21.621 1.00 25.00 H new ATOM 0 HB2 GLU A 648 3.937 15.975 -19.995 1.00 25.00 H new ATOM 0 HB3 GLU A 648 3.079 17.502 -19.933 1.00 25.00 H new ATOM 0 HG2 GLU A 648 1.061 16.258 -19.037 1.00 25.00 H new ATOM 0 HG3 GLU A 648 2.042 14.807 -18.971 1.00 25.00 H new ATOM 855 N ILE A 649 -0.019 16.311 -21.299 1.00 25.00 N ATOM 856 CA ILE A 649 -1.326 16.940 -21.227 1.00 25.00 C ATOM 857 C ILE A 649 -1.847 16.466 -19.872 1.00 25.00 C ATOM 858 O ILE A 649 -1.837 15.272 -19.595 1.00 25.00 O ATOM 859 CB ILE A 649 -2.287 16.474 -22.374 1.00 25.00 C ATOM 860 CG1 ILE A 649 -1.722 16.861 -23.761 1.00 25.00 C ATOM 861 CG2 ILE A 649 -3.713 17.067 -22.185 1.00 25.00 C ATOM 862 CD1 ILE A 649 -1.645 18.392 -24.056 1.00 25.00 C ATOM 0 H ILE A 649 -0.033 15.319 -21.062 1.00 25.00 H new ATOM 0 HA ILE A 649 -1.269 18.023 -21.337 1.00 25.00 H new ATOM 0 HB ILE A 649 -2.359 15.388 -22.323 1.00 25.00 H new ATOM 0 HG12 ILE A 649 -0.721 16.440 -23.856 1.00 25.00 H new ATOM 0 HG13 ILE A 649 -2.338 16.392 -24.528 1.00 25.00 H new ATOM 0 HG21 ILE A 649 -4.359 16.727 -22.995 1.00 25.00 H new ATOM 0 HG22 ILE A 649 -4.122 16.734 -21.231 1.00 25.00 H new ATOM 0 HG23 ILE A 649 -3.659 18.156 -22.197 1.00 25.00 H new ATOM 0 HD11 ILE A 649 -1.235 18.550 -25.054 1.00 25.00 H new ATOM 0 HD12 ILE A 649 -2.644 18.824 -24.002 1.00 25.00 H new ATOM 0 HD13 ILE A 649 -1.002 18.873 -23.319 1.00 25.00 H new ATOM 874 N ARG A 650 -2.284 17.406 -19.043 1.00 25.00 N ATOM 875 CA ARG A 650 -2.786 17.114 -17.687 1.00 25.00 C ATOM 876 C ARG A 650 -4.069 16.357 -17.796 1.00 25.00 C ATOM 877 O ARG A 650 -4.810 16.670 -18.687 1.00 25.00 O ATOM 878 CB ARG A 650 -3.165 18.430 -16.970 1.00 25.00 C ATOM 879 CG ARG A 650 -4.531 19.084 -17.501 1.00 25.00 C ATOM 880 CD ARG A 650 -4.773 20.474 -16.947 1.00 25.00 C ATOM 881 NE ARG A 650 -6.037 21.039 -17.454 1.00 25.00 N ATOM 882 CZ ARG A 650 -6.504 22.250 -17.168 1.00 25.00 C ATOM 883 NH1 ARG A 650 -5.867 23.080 -16.377 1.00 25.00 N ATOM 884 NH2 ARG A 650 -7.636 22.631 -17.691 1.00 25.00 N ATOM 0 H ARG A 650 -2.304 18.397 -19.283 1.00 25.00 H new ATOM 0 HA ARG A 650 -2.012 16.564 -17.152 1.00 25.00 H new ATOM 0 HB2 ARG A 650 -3.256 18.238 -15.901 1.00 25.00 H new ATOM 0 HB3 ARG A 650 -2.355 19.149 -17.097 1.00 25.00 H new ATOM 0 HG2 ARG A 650 -4.506 19.131 -18.590 1.00 25.00 H new ATOM 0 HG3 ARG A 650 -5.367 18.439 -17.229 1.00 25.00 H new ATOM 0 HD2 ARG A 650 -4.801 20.434 -15.858 1.00 25.00 H new ATOM 0 HD3 ARG A 650 -3.944 21.127 -17.221 1.00 25.00 H new ATOM 0 HE ARG A 650 -6.598 20.454 -18.074 1.00 25.00 H new ATOM 0 HH11 ARG A 650 -4.980 22.804 -15.957 1.00 25.00 H new ATOM 0 HH12 ARG A 650 -6.259 24.001 -16.182 1.00 25.00 H new ATOM 0 HH21 ARG A 650 -8.149 22.003 -18.309 1.00 25.00 H new ATOM 0 HH22 ARG A 650 -8.008 23.557 -17.482 1.00 25.00 H new ATOM 898 N LEU A 651 -4.356 15.397 -16.928 1.00 25.00 N ATOM 899 CA LEU A 651 -5.753 14.958 -16.731 1.00 25.00 C ATOM 900 C LEU A 651 -6.000 14.461 -15.303 1.00 25.00 C ATOM 901 O LEU A 651 -5.091 13.904 -14.682 1.00 25.00 O ATOM 902 CB LEU A 651 -6.240 13.964 -17.801 1.00 25.00 C ATOM 903 CG LEU A 651 -7.078 14.536 -18.986 1.00 25.00 C ATOM 904 CD1 LEU A 651 -7.761 15.970 -18.771 1.00 25.00 C ATOM 905 CD2 LEU A 651 -6.215 14.573 -20.242 1.00 25.00 C ATOM 0 H LEU A 651 -3.667 14.910 -16.355 1.00 25.00 H new ATOM 0 HA LEU A 651 -6.370 15.846 -16.868 1.00 25.00 H new ATOM 0 HB2 LEU A 651 -5.366 13.463 -18.218 1.00 25.00 H new ATOM 0 HB3 LEU A 651 -6.838 13.200 -17.304 1.00 25.00 H new ATOM 0 HG LEU A 651 -7.920 13.849 -19.073 1.00 25.00 H new ATOM 0 HD11 LEU A 651 -8.312 16.249 -19.669 1.00 25.00 H new ATOM 0 HD12 LEU A 651 -8.446 15.923 -17.925 1.00 25.00 H new ATOM 0 HD13 LEU A 651 -6.990 16.714 -18.573 1.00 25.00 H new ATOM 0 HD21 LEU A 651 -6.798 14.972 -21.072 1.00 25.00 H new ATOM 0 HD22 LEU A 651 -5.347 15.209 -20.069 1.00 25.00 H new ATOM 0 HD23 LEU A 651 -5.882 13.564 -20.485 1.00 25.00 H new ATOM 917 N PRO A 652 -7.225 14.662 -14.758 1.00 25.00 N ATOM 918 CA PRO A 652 -7.482 14.174 -13.398 1.00 25.00 C ATOM 919 C PRO A 652 -7.714 12.670 -13.364 1.00 25.00 C ATOM 920 O PRO A 652 -7.987 12.057 -14.390 1.00 25.00 O ATOM 921 CB PRO A 652 -8.753 14.931 -13.002 1.00 25.00 C ATOM 922 CG PRO A 652 -9.489 15.054 -14.265 1.00 25.00 C ATOM 923 CD PRO A 652 -8.431 15.313 -15.311 1.00 25.00 C ATOM 0 HA PRO A 652 -6.641 14.342 -12.725 1.00 25.00 H new ATOM 0 HB2 PRO A 652 -9.328 14.385 -12.254 1.00 25.00 H new ATOM 0 HB3 PRO A 652 -8.522 15.907 -12.576 1.00 25.00 H new ATOM 0 HG2 PRO A 652 -10.048 14.145 -14.486 1.00 25.00 H new ATOM 0 HG3 PRO A 652 -10.211 15.870 -14.223 1.00 25.00 H new ATOM 0 HD2 PRO A 652 -8.709 14.888 -16.275 1.00 25.00 H new ATOM 0 HD3 PRO A 652 -8.274 16.380 -15.466 1.00 25.00 H new ATOM 931 N SER A 653 -7.614 12.099 -12.172 1.00 25.00 N ATOM 932 CA SER A 653 -7.694 10.652 -11.950 1.00 25.00 C ATOM 933 C SER A 653 -8.915 9.899 -12.496 1.00 25.00 C ATOM 934 O SER A 653 -8.808 8.714 -12.800 1.00 25.00 O ATOM 935 CB SER A 653 -7.633 10.418 -10.446 1.00 25.00 C ATOM 936 OG SER A 653 -8.601 11.221 -9.787 1.00 25.00 O ATOM 0 H SER A 653 -7.473 12.632 -11.314 1.00 25.00 H new ATOM 0 HA SER A 653 -6.860 10.244 -12.521 1.00 25.00 H new ATOM 0 HB2 SER A 653 -7.812 9.365 -10.226 1.00 25.00 H new ATOM 0 HB3 SER A 653 -6.637 10.656 -10.073 1.00 25.00 H new ATOM 0 HG SER A 653 -8.555 11.062 -8.821 1.00 25.00 H new ATOM 942 N GLY A 654 -10.059 10.565 -12.606 1.00 25.00 N ATOM 943 CA GLY A 654 -11.286 9.897 -13.035 1.00 25.00 C ATOM 944 C GLY A 654 -11.942 10.401 -14.307 1.00 25.00 C ATOM 945 O GLY A 654 -13.161 10.377 -14.404 1.00 25.00 O ATOM 0 H GLY A 654 -10.164 11.560 -12.406 1.00 25.00 H new ATOM 0 HA2 GLY A 654 -11.066 8.837 -13.166 1.00 25.00 H new ATOM 0 HA3 GLY A 654 -12.013 9.974 -12.227 1.00 25.00 H new ATOM 949 N SER A 655 -11.172 10.865 -15.280 1.00 25.00 N ATOM 950 CA SER A 655 -11.767 11.340 -16.539 1.00 25.00 C ATOM 951 C SER A 655 -12.020 10.134 -17.443 1.00 25.00 C ATOM 952 O SER A 655 -11.180 9.262 -17.529 1.00 25.00 O ATOM 953 CB SER A 655 -10.835 12.327 -17.244 1.00 25.00 C ATOM 954 OG SER A 655 -11.474 12.904 -18.375 1.00 25.00 O ATOM 0 H SER A 655 -10.155 10.926 -15.234 1.00 25.00 H new ATOM 0 HA SER A 655 -12.703 11.855 -16.322 1.00 25.00 H new ATOM 0 HB2 SER A 655 -10.537 13.112 -16.549 1.00 25.00 H new ATOM 0 HB3 SER A 655 -9.925 11.815 -17.557 1.00 25.00 H new ATOM 0 HG SER A 655 -11.062 12.560 -19.195 1.00 25.00 H new ATOM 960 N ASP A 656 -13.160 10.088 -18.123 1.00 25.00 N ATOM 961 CA ASP A 656 -13.481 8.962 -19.018 1.00 25.00 C ATOM 962 C ASP A 656 -12.650 8.969 -20.292 1.00 25.00 C ATOM 963 O ASP A 656 -12.362 7.924 -20.875 1.00 25.00 O ATOM 964 CB ASP A 656 -14.951 9.025 -19.441 1.00 25.00 C ATOM 965 CG ASP A 656 -15.896 8.676 -18.316 1.00 25.00 C ATOM 966 OD1 ASP A 656 -16.344 9.598 -17.612 1.00 25.00 O ATOM 967 OD2 ASP A 656 -16.205 7.475 -18.141 1.00 25.00 O ATOM 0 H ASP A 656 -13.880 10.809 -18.078 1.00 25.00 H new ATOM 0 HA ASP A 656 -13.262 8.057 -18.452 1.00 25.00 H new ATOM 0 HB2 ASP A 656 -15.178 10.028 -19.803 1.00 25.00 H new ATOM 0 HB3 ASP A 656 -15.115 8.341 -20.273 1.00 25.00 H new ATOM 972 N HIS A 657 -12.271 10.151 -20.745 1.00 25.00 N ATOM 973 CA HIS A 657 -11.525 10.273 -21.986 1.00 25.00 C ATOM 974 C HIS A 657 -10.761 11.579 -22.009 1.00 25.00 C ATOM 975 O HIS A 657 -10.943 12.434 -21.140 1.00 25.00 O ATOM 976 CB HIS A 657 -12.478 10.209 -23.196 1.00 25.00 C ATOM 977 CG HIS A 657 -13.260 11.464 -23.422 1.00 25.00 C ATOM 978 ND1 HIS A 657 -14.383 11.821 -22.718 1.00 25.00 N ATOM 979 CD2 HIS A 657 -13.071 12.473 -24.318 1.00 25.00 C ATOM 980 CE1 HIS A 657 -14.815 12.989 -23.189 1.00 25.00 C ATOM 981 NE2 HIS A 657 -14.053 13.430 -24.171 1.00 25.00 N ATOM 0 H HIS A 657 -12.466 11.035 -20.276 1.00 25.00 H new ATOM 0 HA HIS A 657 -10.820 9.444 -22.047 1.00 25.00 H new ATOM 0 HB2 HIS A 657 -11.897 9.989 -24.092 1.00 25.00 H new ATOM 0 HB3 HIS A 657 -13.173 9.381 -23.055 1.00 25.00 H new ATOM 0 HD2 HIS A 657 -12.268 12.517 -25.039 1.00 25.00 H new ATOM 0 HE1 HIS A 657 -15.683 13.511 -22.813 1.00 25.00 H new ATOM 0 HE2 HIS A 657 -14.166 14.291 -24.705 1.00 25.00 H new ATOM 989 N VAL A 658 -9.920 11.733 -23.016 1.00 25.00 N ATOM 990 CA VAL A 658 -9.186 12.965 -23.238 1.00 25.00 C ATOM 991 C VAL A 658 -9.491 13.417 -24.661 1.00 25.00 C ATOM 992 O VAL A 658 -9.253 12.696 -25.635 1.00 25.00 O ATOM 993 CB VAL A 658 -7.654 12.787 -22.986 1.00 25.00 C ATOM 994 CG1 VAL A 658 -7.148 11.427 -23.459 1.00 25.00 C ATOM 995 CG2 VAL A 658 -6.848 13.919 -23.649 1.00 25.00 C ATOM 0 H VAL A 658 -9.727 11.005 -23.704 1.00 25.00 H new ATOM 0 HA VAL A 658 -9.501 13.729 -22.527 1.00 25.00 H new ATOM 0 HB VAL A 658 -7.504 12.837 -21.908 1.00 25.00 H new ATOM 0 HG11 VAL A 658 -6.079 11.349 -23.264 1.00 25.00 H new ATOM 0 HG12 VAL A 658 -7.674 10.637 -22.923 1.00 25.00 H new ATOM 0 HG13 VAL A 658 -7.330 11.323 -24.529 1.00 25.00 H new ATOM 0 HG21 VAL A 658 -5.785 13.770 -23.457 1.00 25.00 H new ATOM 0 HG22 VAL A 658 -7.027 13.912 -24.724 1.00 25.00 H new ATOM 0 HG23 VAL A 658 -7.160 14.878 -23.236 1.00 25.00 H new ATOM 1005 N MET A 659 -10.038 14.619 -24.765 1.00 25.00 N ATOM 1006 CA MET A 659 -10.365 15.217 -26.053 1.00 25.00 C ATOM 1007 C MET A 659 -9.148 16.030 -26.512 1.00 25.00 C ATOM 1008 O MET A 659 -9.034 17.227 -26.235 1.00 25.00 O ATOM 1009 CB MET A 659 -11.624 16.090 -25.920 1.00 25.00 C ATOM 1010 CG MET A 659 -12.515 16.048 -27.147 1.00 25.00 C ATOM 1011 SD MET A 659 -11.654 16.575 -28.635 1.00 25.00 S ATOM 1012 CE MET A 659 -12.791 16.031 -29.926 1.00 25.00 C ATOM 0 H MET A 659 -10.267 15.206 -23.963 1.00 25.00 H new ATOM 0 HA MET A 659 -10.586 14.453 -26.799 1.00 25.00 H new ATOM 0 HB2 MET A 659 -12.196 15.761 -25.053 1.00 25.00 H new ATOM 0 HB3 MET A 659 -11.325 17.121 -25.732 1.00 25.00 H new ATOM 0 HG2 MET A 659 -12.889 15.034 -27.287 1.00 25.00 H new ATOM 0 HG3 MET A 659 -13.382 16.689 -26.986 1.00 25.00 H new ATOM 0 HE1 MET A 659 -12.275 15.349 -30.602 1.00 25.00 H new ATOM 0 HE2 MET A 659 -13.639 15.519 -29.472 1.00 25.00 H new ATOM 0 HE3 MET A 659 -13.147 16.896 -30.485 1.00 25.00 H new ATOM 1022 N LEU A 660 -8.225 15.370 -27.194 1.00 25.00 N ATOM 1023 CA LEU A 660 -7.019 16.039 -27.672 1.00 25.00 C ATOM 1024 C LEU A 660 -7.400 16.990 -28.786 1.00 25.00 C ATOM 1025 O LEU A 660 -8.242 16.674 -29.611 1.00 25.00 O ATOM 1026 CB LEU A 660 -6.002 15.043 -28.238 1.00 25.00 C ATOM 1027 CG LEU A 660 -5.186 14.176 -27.272 1.00 25.00 C ATOM 1028 CD1 LEU A 660 -4.222 13.339 -28.090 1.00 25.00 C ATOM 1029 CD2 LEU A 660 -4.401 15.041 -26.275 1.00 25.00 C ATOM 0 H LEU A 660 -8.284 14.379 -27.429 1.00 25.00 H new ATOM 0 HA LEU A 660 -6.569 16.560 -26.827 1.00 25.00 H new ATOM 0 HB2 LEU A 660 -6.539 14.371 -28.908 1.00 25.00 H new ATOM 0 HB3 LEU A 660 -5.297 15.606 -28.849 1.00 25.00 H new ATOM 0 HG LEU A 660 -5.862 13.541 -26.699 1.00 25.00 H new ATOM 0 HD11 LEU A 660 -3.629 12.712 -27.424 1.00 25.00 H new ATOM 0 HD12 LEU A 660 -4.783 12.707 -28.779 1.00 25.00 H new ATOM 0 HD13 LEU A 660 -3.560 13.995 -28.656 1.00 25.00 H new ATOM 0 HD21 LEU A 660 -3.833 14.397 -25.604 1.00 25.00 H new ATOM 0 HD22 LEU A 660 -3.717 15.693 -26.819 1.00 25.00 H new ATOM 0 HD23 LEU A 660 -5.096 15.648 -25.694 1.00 25.00 H new ATOM 1041 N LYS A 661 -6.758 18.147 -28.805 1.00 25.00 N ATOM 1042 CA LYS A 661 -6.969 19.163 -29.834 1.00 25.00 C ATOM 1043 C LYS A 661 -5.582 19.649 -30.209 1.00 25.00 C ATOM 1044 O LYS A 661 -4.612 19.239 -29.578 1.00 25.00 O ATOM 1045 CB LYS A 661 -7.842 20.312 -29.301 1.00 25.00 C ATOM 1046 CG LYS A 661 -9.316 19.930 -29.170 1.00 25.00 C ATOM 1047 CD LYS A 661 -10.206 21.112 -28.865 1.00 25.00 C ATOM 1048 CE LYS A 661 -11.611 20.821 -29.384 1.00 25.00 C ATOM 1049 NZ LYS A 661 -12.322 19.751 -28.609 1.00 25.00 N ATOM 0 H LYS A 661 -6.069 18.414 -28.102 1.00 25.00 H new ATOM 0 HA LYS A 661 -7.498 18.762 -30.699 1.00 25.00 H new ATOM 0 HB2 LYS A 661 -7.466 20.626 -28.327 1.00 25.00 H new ATOM 0 HB3 LYS A 661 -7.752 21.169 -29.968 1.00 25.00 H new ATOM 0 HG2 LYS A 661 -9.648 19.461 -30.096 1.00 25.00 H new ATOM 0 HG3 LYS A 661 -9.424 19.187 -28.380 1.00 25.00 H new ATOM 0 HD2 LYS A 661 -10.232 21.297 -27.791 1.00 25.00 H new ATOM 0 HD3 LYS A 661 -9.810 22.013 -29.334 1.00 25.00 H new ATOM 0 HE2 LYS A 661 -12.200 21.737 -29.349 1.00 25.00 H new ATOM 0 HE3 LYS A 661 -11.549 20.521 -30.430 1.00 25.00 H new ATOM 0 HZ1 LYS A 661 -13.269 19.602 -29.012 1.00 25.00 H new ATOM 0 HZ2 LYS A 661 -11.780 18.865 -28.662 1.00 25.00 H new ATOM 0 HZ3 LYS A 661 -12.411 20.043 -27.615 1.00 25.00 H new ATOM 1063 N SER A 662 -5.501 20.515 -31.212 1.00 25.00 N ATOM 1064 CA SER A 662 -4.228 21.078 -31.696 1.00 25.00 C ATOM 1065 C SER A 662 -3.325 19.979 -32.261 1.00 25.00 C ATOM 1066 O SER A 662 -2.149 19.867 -31.905 1.00 25.00 O ATOM 1067 CB SER A 662 -3.503 21.867 -30.592 1.00 25.00 C ATOM 1068 OG SER A 662 -2.464 22.660 -31.138 1.00 25.00 O ATOM 0 H SER A 662 -6.317 20.854 -31.721 1.00 25.00 H new ATOM 0 HA SER A 662 -4.463 21.776 -32.500 1.00 25.00 H new ATOM 0 HB2 SER A 662 -4.215 22.504 -30.067 1.00 25.00 H new ATOM 0 HB3 SER A 662 -3.091 21.176 -29.856 1.00 25.00 H new ATOM 0 HG SER A 662 -1.799 22.080 -31.564 1.00 25.00 H new ATOM 1074 N LEU A 663 -3.892 19.181 -33.152 1.00 25.00 N ATOM 1075 CA LEU A 663 -3.188 18.090 -33.815 1.00 25.00 C ATOM 1076 C LEU A 663 -3.572 18.138 -35.287 1.00 25.00 C ATOM 1077 O LEU A 663 -4.589 18.741 -35.637 1.00 25.00 O ATOM 1078 CB LEU A 663 -3.569 16.747 -33.171 1.00 25.00 C ATOM 1079 CG LEU A 663 -5.071 16.419 -32.999 1.00 25.00 C ATOM 1080 CD1 LEU A 663 -5.719 15.872 -34.261 1.00 25.00 C ATOM 1081 CD2 LEU A 663 -5.206 15.403 -31.878 1.00 25.00 C ATOM 0 H LEU A 663 -4.866 19.272 -33.440 1.00 25.00 H new ATOM 0 HA LEU A 663 -2.108 18.193 -33.712 1.00 25.00 H new ATOM 0 HB2 LEU A 663 -3.121 15.953 -33.768 1.00 25.00 H new ATOM 0 HB3 LEU A 663 -3.104 16.706 -32.186 1.00 25.00 H new ATOM 0 HG LEU A 663 -5.590 17.349 -32.768 1.00 25.00 H new ATOM 0 HD11 LEU A 663 -6.772 15.664 -34.069 1.00 25.00 H new ATOM 0 HD12 LEU A 663 -5.635 16.607 -35.061 1.00 25.00 H new ATOM 0 HD13 LEU A 663 -5.216 14.952 -34.559 1.00 25.00 H new ATOM 0 HD21 LEU A 663 -6.258 15.155 -31.737 1.00 25.00 H new ATOM 0 HD22 LEU A 663 -4.652 14.501 -32.136 1.00 25.00 H new ATOM 0 HD23 LEU A 663 -4.805 15.824 -30.956 1.00 25.00 H new ATOM 1093 N ASP A 664 -2.768 17.527 -36.141 1.00 25.00 N ATOM 1094 CA ASP A 664 -3.035 17.543 -37.578 1.00 25.00 C ATOM 1095 C ASP A 664 -4.286 16.730 -37.848 1.00 25.00 C ATOM 1096 O ASP A 664 -4.499 15.701 -37.236 1.00 25.00 O ATOM 1097 CB ASP A 664 -1.887 16.910 -38.371 1.00 25.00 C ATOM 1098 CG ASP A 664 -0.609 17.738 -38.339 1.00 25.00 C ATOM 1099 OD1 ASP A 664 -0.586 18.820 -37.724 1.00 25.00 O ATOM 1100 OD2 ASP A 664 0.394 17.283 -38.932 1.00 25.00 O ATOM 0 H ASP A 664 -1.928 17.015 -35.871 1.00 25.00 H new ATOM 0 HA ASP A 664 -3.151 18.581 -37.889 1.00 25.00 H new ATOM 0 HB2 ASP A 664 -1.680 15.918 -37.969 1.00 25.00 H new ATOM 0 HB3 ASP A 664 -2.200 16.776 -39.407 1.00 25.00 H new ATOM 1105 N TRP A 665 -5.111 17.181 -38.776 1.00 25.00 N ATOM 1106 CA TRP A 665 -6.316 16.434 -39.141 1.00 25.00 C ATOM 1107 C TRP A 665 -6.207 15.933 -40.571 1.00 25.00 C ATOM 1108 O TRP A 665 -6.621 14.829 -40.872 1.00 25.00 O ATOM 1109 CB TRP A 665 -7.560 17.308 -38.959 1.00 25.00 C ATOM 1110 CG TRP A 665 -7.407 18.693 -39.524 1.00 25.00 C ATOM 1111 CD1 TRP A 665 -6.781 19.752 -38.953 1.00 25.00 C ATOM 1112 CD2 TRP A 665 -7.893 19.181 -40.792 1.00 25.00 C ATOM 1113 NE1 TRP A 665 -6.820 20.854 -39.749 1.00 25.00 N ATOM 1114 CE2 TRP A 665 -7.492 20.546 -40.898 1.00 25.00 C ATOM 1115 CE3 TRP A 665 -8.625 18.606 -41.848 1.00 25.00 C ATOM 1116 CZ2 TRP A 665 -7.790 21.336 -42.027 1.00 25.00 C ATOM 1117 CZ3 TRP A 665 -8.933 19.399 -42.987 1.00 25.00 C ATOM 1118 CH2 TRP A 665 -8.506 20.758 -43.061 1.00 25.00 C ATOM 0 H TRP A 665 -4.977 18.052 -39.290 1.00 25.00 H new ATOM 0 HA TRP A 665 -6.411 15.571 -38.482 1.00 25.00 H new ATOM 0 HB2 TRP A 665 -8.410 16.821 -39.437 1.00 25.00 H new ATOM 0 HB3 TRP A 665 -7.791 17.381 -37.896 1.00 25.00 H new ATOM 0 HD1 TRP A 665 -6.308 19.724 -37.982 1.00 25.00 H new ATOM 0 HE1 TRP A 665 -6.414 21.762 -39.525 1.00 25.00 H new ATOM 0 HE3 TRP A 665 -8.948 17.577 -41.794 1.00 25.00 H new ATOM 0 HZ2 TRP A 665 -7.468 22.365 -42.084 1.00 25.00 H new ATOM 0 HZ3 TRP A 665 -9.495 18.969 -43.803 1.00 25.00 H new ATOM 0 HH2 TRP A 665 -8.745 21.344 -43.936 1.00 25.00 H new ATOM 1129 N ASN A 666 -5.635 16.755 -41.437 1.00 25.00 N ATOM 1130 CA ASN A 666 -5.462 16.434 -42.855 1.00 25.00 C ATOM 1131 C ASN A 666 -4.120 15.755 -43.106 1.00 25.00 C ATOM 1132 O ASN A 666 -3.716 15.565 -44.251 1.00 25.00 O ATOM 1133 CB ASN A 666 -5.511 17.726 -43.678 1.00 25.00 C ATOM 1134 CG ASN A 666 -4.372 18.658 -43.349 1.00 25.00 C ATOM 1135 OD1 ASN A 666 -4.217 19.095 -42.214 1.00 25.00 O ATOM 1136 ND2 ASN A 666 -3.567 18.956 -44.325 1.00 25.00 N ATOM 0 H ASN A 666 -5.273 17.673 -41.178 1.00 25.00 H new ATOM 0 HA ASN A 666 -6.264 15.756 -43.148 1.00 25.00 H new ATOM 0 HB2 ASN A 666 -5.481 17.479 -44.739 1.00 25.00 H new ATOM 0 HB3 ASN A 666 -6.458 18.234 -43.496 1.00 25.00 H new ATOM 0 HD21 ASN A 666 -2.772 19.574 -44.160 1.00 25.00 H new ATOM 0 HD22 ASN A 666 -3.730 18.572 -45.256 1.00 25.00 H new ATOM 1143 N ALA A 667 -3.432 15.404 -42.033 1.00 25.00 N ATOM 1144 CA ALA A 667 -2.139 14.743 -42.113 1.00 25.00 C ATOM 1145 C ALA A 667 -2.111 13.748 -40.962 1.00 25.00 C ATOM 1146 O ALA A 667 -2.958 13.804 -40.070 1.00 25.00 O ATOM 1147 CB ALA A 667 -0.989 15.762 -42.008 1.00 25.00 C ATOM 0 H ALA A 667 -3.754 15.569 -41.079 1.00 25.00 H new ATOM 0 HA ALA A 667 -2.004 14.240 -43.070 1.00 25.00 H new ATOM 0 HB1 ALA A 667 -0.034 15.240 -42.071 1.00 25.00 H new ATOM 0 HB2 ALA A 667 -1.064 16.481 -42.824 1.00 25.00 H new ATOM 0 HB3 ALA A 667 -1.054 16.287 -41.055 1.00 25.00 H new ATOM 1153 N GLU A 668 -1.162 12.831 -41.000 1.00 25.00 N ATOM 1154 CA GLU A 668 -1.094 11.741 -40.037 1.00 25.00 C ATOM 1155 C GLU A 668 -0.409 12.163 -38.737 1.00 25.00 C ATOM 1156 O GLU A 668 0.529 12.969 -38.745 1.00 25.00 O ATOM 1157 CB GLU A 668 -0.342 10.582 -40.703 1.00 25.00 C ATOM 1158 CG GLU A 668 -0.393 9.270 -39.951 1.00 25.00 C ATOM 1159 CD GLU A 668 -0.563 8.073 -40.888 1.00 25.00 C ATOM 1160 OE1 GLU A 668 0.185 7.966 -41.876 1.00 25.00 O ATOM 1161 OE2 GLU A 668 -1.467 7.239 -40.639 1.00 25.00 O ATOM 0 H GLU A 668 -0.417 12.818 -41.697 1.00 25.00 H new ATOM 0 HA GLU A 668 -2.103 11.437 -39.759 1.00 25.00 H new ATOM 0 HB2 GLU A 668 -0.753 10.428 -41.701 1.00 25.00 H new ATOM 0 HB3 GLU A 668 0.701 10.871 -40.829 1.00 25.00 H new ATOM 0 HG2 GLU A 668 0.523 9.149 -39.372 1.00 25.00 H new ATOM 0 HG3 GLU A 668 -1.219 9.293 -39.240 1.00 25.00 H new ATOM 1168 N TYR A 669 -0.873 11.618 -37.621 1.00 25.00 N ATOM 1169 CA TYR A 669 -0.294 11.910 -36.316 1.00 25.00 C ATOM 1170 C TYR A 669 -0.383 10.681 -35.423 1.00 25.00 C ATOM 1171 O TYR A 669 -1.196 9.789 -35.665 1.00 25.00 O ATOM 1172 CB TYR A 669 -1.022 13.091 -35.665 1.00 25.00 C ATOM 1173 CG TYR A 669 -2.464 12.830 -35.340 1.00 25.00 C ATOM 1174 CD1 TYR A 669 -3.464 13.042 -36.304 1.00 25.00 C ATOM 1175 CD2 TYR A 669 -2.848 12.380 -34.059 1.00 25.00 C ATOM 1176 CE1 TYR A 669 -4.818 12.825 -35.999 1.00 25.00 C ATOM 1177 CE2 TYR A 669 -4.211 12.160 -33.751 1.00 25.00 C ATOM 1178 CZ TYR A 669 -5.179 12.393 -34.728 1.00 25.00 C ATOM 1179 OH TYR A 669 -6.498 12.210 -34.442 1.00 25.00 O ATOM 0 H TYR A 669 -1.656 10.965 -37.594 1.00 25.00 H new ATOM 0 HA TYR A 669 0.755 12.177 -36.447 1.00 25.00 H new ATOM 0 HB2 TYR A 669 -0.499 13.363 -34.748 1.00 25.00 H new ATOM 0 HB3 TYR A 669 -0.963 13.951 -36.332 1.00 25.00 H new ATOM 0 HD1 TYR A 669 -3.188 13.376 -37.293 1.00 25.00 H new ATOM 0 HD2 TYR A 669 -2.094 12.202 -33.306 1.00 25.00 H new ATOM 0 HE1 TYR A 669 -5.576 12.993 -36.750 1.00 25.00 H new ATOM 0 HE2 TYR A 669 -4.499 11.815 -32.769 1.00 25.00 H new ATOM 0 HH TYR A 669 -6.900 11.621 -35.114 1.00 25.00 H new ATOM 1189 N GLU A 670 0.461 10.639 -34.403 1.00 25.00 N ATOM 1190 CA GLU A 670 0.527 9.512 -33.476 1.00 25.00 C ATOM 1191 C GLU A 670 0.345 10.006 -32.043 1.00 25.00 C ATOM 1192 O GLU A 670 0.786 11.103 -31.685 1.00 25.00 O ATOM 1193 CB GLU A 670 1.869 8.777 -33.626 1.00 25.00 C ATOM 1194 CG GLU A 670 3.104 9.645 -33.351 1.00 25.00 C ATOM 1195 CD GLU A 670 4.413 8.887 -33.530 1.00 25.00 C ATOM 1196 OE1 GLU A 670 4.472 7.688 -33.169 1.00 25.00 O ATOM 1197 OE2 GLU A 670 5.391 9.496 -34.016 1.00 25.00 O ATOM 0 H GLU A 670 1.123 11.386 -34.192 1.00 25.00 H new ATOM 0 HA GLU A 670 -0.276 8.813 -33.710 1.00 25.00 H new ATOM 0 HB2 GLU A 670 1.880 7.925 -32.946 1.00 25.00 H new ATOM 0 HB3 GLU A 670 1.939 8.378 -34.638 1.00 25.00 H new ATOM 0 HG2 GLU A 670 3.094 10.505 -34.020 1.00 25.00 H new ATOM 0 HG3 GLU A 670 3.050 10.032 -32.334 1.00 25.00 H new ATOM 1204 N VAL A 671 -0.318 9.203 -31.222 1.00 25.00 N ATOM 1205 CA VAL A 671 -0.596 9.569 -29.834 1.00 25.00 C ATOM 1206 C VAL A 671 -0.164 8.459 -28.894 1.00 25.00 C ATOM 1207 O VAL A 671 -0.506 7.311 -29.119 1.00 25.00 O ATOM 1208 CB VAL A 671 -2.127 9.775 -29.626 1.00 25.00 C ATOM 1209 CG1 VAL A 671 -2.448 10.152 -28.168 1.00 25.00 C ATOM 1210 CG2 VAL A 671 -2.673 10.848 -30.580 1.00 25.00 C ATOM 0 H VAL A 671 -0.677 8.287 -31.493 1.00 25.00 H new ATOM 0 HA VAL A 671 -0.048 10.487 -29.622 1.00 25.00 H new ATOM 0 HB VAL A 671 -2.616 8.827 -29.851 1.00 25.00 H new ATOM 0 HG11 VAL A 671 -3.524 10.289 -28.056 1.00 25.00 H new ATOM 0 HG12 VAL A 671 -2.112 9.356 -27.504 1.00 25.00 H new ATOM 0 HG13 VAL A 671 -1.936 11.079 -27.911 1.00 25.00 H new ATOM 0 HG21 VAL A 671 -3.743 10.972 -30.414 1.00 25.00 H new ATOM 0 HG22 VAL A 671 -2.165 11.794 -30.393 1.00 25.00 H new ATOM 0 HG23 VAL A 671 -2.499 10.541 -31.611 1.00 25.00 H new ATOM 1220 N TYR A 672 0.560 8.809 -27.838 1.00 25.00 N ATOM 1221 CA TYR A 672 0.934 7.867 -26.778 1.00 25.00 C ATOM 1222 C TYR A 672 0.334 8.404 -25.498 1.00 25.00 C ATOM 1223 O TYR A 672 0.348 9.606 -25.266 1.00 25.00 O ATOM 1224 CB TYR A 672 2.454 7.776 -26.615 1.00 25.00 C ATOM 1225 CG TYR A 672 3.098 6.936 -27.680 1.00 25.00 C ATOM 1226 CD1 TYR A 672 3.555 5.633 -27.392 1.00 25.00 C ATOM 1227 CD2 TYR A 672 3.241 7.424 -28.987 1.00 25.00 C ATOM 1228 CE1 TYR A 672 4.124 4.823 -28.408 1.00 25.00 C ATOM 1229 CE2 TYR A 672 3.820 6.622 -30.002 1.00 25.00 C ATOM 1230 CZ TYR A 672 4.256 5.332 -29.706 1.00 25.00 C ATOM 1231 OH TYR A 672 4.803 4.564 -30.699 1.00 25.00 O ATOM 0 H TYR A 672 0.908 9.756 -27.688 1.00 25.00 H new ATOM 0 HA TYR A 672 0.571 6.869 -27.023 1.00 25.00 H new ATOM 0 HB2 TYR A 672 2.880 8.779 -26.641 1.00 25.00 H new ATOM 0 HB3 TYR A 672 2.687 7.357 -25.636 1.00 25.00 H new ATOM 0 HD1 TYR A 672 3.471 5.248 -26.387 1.00 25.00 H new ATOM 0 HD2 TYR A 672 2.906 8.423 -29.223 1.00 25.00 H new ATOM 0 HE1 TYR A 672 4.453 3.820 -28.182 1.00 25.00 H new ATOM 0 HE2 TYR A 672 3.923 7.010 -31.004 1.00 25.00 H new ATOM 0 HH TYR A 672 4.817 5.073 -31.536 1.00 25.00 H new ATOM 1241 N VAL A 673 -0.201 7.528 -24.668 1.00 25.00 N ATOM 1242 CA VAL A 673 -0.807 7.943 -23.407 1.00 25.00 C ATOM 1243 C VAL A 673 -0.412 6.925 -22.337 1.00 25.00 C ATOM 1244 O VAL A 673 -0.364 5.715 -22.603 1.00 25.00 O ATOM 1245 CB VAL A 673 -2.364 8.098 -23.575 1.00 25.00 C ATOM 1246 CG1 VAL A 673 -2.971 6.886 -24.305 1.00 25.00 C ATOM 1247 CG2 VAL A 673 -3.059 8.347 -22.227 1.00 25.00 C ATOM 0 H VAL A 673 -0.231 6.523 -24.840 1.00 25.00 H new ATOM 0 HA VAL A 673 -0.444 8.922 -23.095 1.00 25.00 H new ATOM 0 HB VAL A 673 -2.538 8.978 -24.195 1.00 25.00 H new ATOM 0 HG11 VAL A 673 -4.048 7.023 -24.405 1.00 25.00 H new ATOM 0 HG12 VAL A 673 -2.523 6.795 -25.295 1.00 25.00 H new ATOM 0 HG13 VAL A 673 -2.773 5.980 -23.733 1.00 25.00 H new ATOM 0 HG21 VAL A 673 -4.133 8.449 -22.385 1.00 25.00 H new ATOM 0 HG22 VAL A 673 -2.868 7.507 -21.559 1.00 25.00 H new ATOM 0 HG23 VAL A 673 -2.670 9.262 -21.780 1.00 25.00 H new ATOM 1257 N VAL A 674 -0.108 7.419 -21.144 1.00 25.00 N ATOM 1258 CA VAL A 674 0.280 6.585 -20.005 1.00 25.00 C ATOM 1259 C VAL A 674 -0.417 7.087 -18.747 1.00 25.00 C ATOM 1260 O VAL A 674 -0.866 8.238 -18.680 1.00 25.00 O ATOM 1261 CB VAL A 674 1.829 6.604 -19.739 1.00 25.00 C ATOM 1262 CG1 VAL A 674 2.585 5.952 -20.883 1.00 25.00 C ATOM 1263 CG2 VAL A 674 2.343 8.029 -19.533 1.00 25.00 C ATOM 0 H VAL A 674 -0.123 8.417 -20.934 1.00 25.00 H new ATOM 0 HA VAL A 674 -0.015 5.564 -20.248 1.00 25.00 H new ATOM 0 HB VAL A 674 2.004 6.035 -18.826 1.00 25.00 H new ATOM 0 HG11 VAL A 674 3.654 5.978 -20.674 1.00 25.00 H new ATOM 0 HG12 VAL A 674 2.261 4.917 -20.990 1.00 25.00 H new ATOM 0 HG13 VAL A 674 2.383 6.492 -21.808 1.00 25.00 H new ATOM 0 HG21 VAL A 674 3.418 8.006 -19.351 1.00 25.00 H new ATOM 0 HG22 VAL A 674 2.138 8.622 -20.424 1.00 25.00 H new ATOM 0 HG23 VAL A 674 1.840 8.477 -18.676 1.00 25.00 H new ATOM 1273 N ALA A 675 -0.490 6.222 -17.751 1.00 25.00 N ATOM 1274 CA ALA A 675 -1.050 6.561 -16.454 1.00 25.00 C ATOM 1275 C ALA A 675 0.093 6.493 -15.452 1.00 25.00 C ATOM 1276 O ALA A 675 0.986 5.658 -15.589 1.00 25.00 O ATOM 1277 CB ALA A 675 -2.143 5.575 -16.088 1.00 25.00 C ATOM 0 H ALA A 675 -0.161 5.259 -17.819 1.00 25.00 H new ATOM 0 HA ALA A 675 -1.496 7.556 -16.462 1.00 25.00 H new ATOM 0 HB1 ALA A 675 -2.558 5.836 -15.114 1.00 25.00 H new ATOM 0 HB2 ALA A 675 -2.932 5.611 -16.840 1.00 25.00 H new ATOM 0 HB3 ALA A 675 -1.726 4.569 -16.047 1.00 25.00 H new ATOM 1283 N GLU A 676 0.058 7.355 -14.451 1.00 25.00 N ATOM 1284 CA GLU A 676 1.041 7.358 -13.376 1.00 25.00 C ATOM 1285 C GLU A 676 0.254 7.274 -12.089 1.00 25.00 C ATOM 1286 O GLU A 676 -0.637 8.080 -11.856 1.00 25.00 O ATOM 1287 CB GLU A 676 1.872 8.648 -13.409 1.00 25.00 C ATOM 1288 CG GLU A 676 2.894 8.773 -12.275 1.00 25.00 C ATOM 1289 CD GLU A 676 2.404 9.666 -11.131 1.00 25.00 C ATOM 1290 OE1 GLU A 676 2.474 10.906 -11.270 1.00 25.00 O ATOM 1291 OE2 GLU A 676 1.960 9.140 -10.087 1.00 25.00 O ATOM 0 H GLU A 676 -0.656 8.077 -14.358 1.00 25.00 H new ATOM 0 HA GLU A 676 1.737 6.525 -13.474 1.00 25.00 H new ATOM 0 HB2 GLU A 676 2.397 8.703 -14.362 1.00 25.00 H new ATOM 0 HB3 GLU A 676 1.196 9.502 -13.368 1.00 25.00 H new ATOM 0 HG2 GLU A 676 3.120 7.781 -11.884 1.00 25.00 H new ATOM 0 HG3 GLU A 676 3.824 9.178 -12.673 1.00 25.00 H new ATOM 1298 N ASN A 677 0.558 6.303 -11.250 1.00 25.00 N ATOM 1299 CA ASN A 677 -0.143 6.174 -9.989 1.00 25.00 C ATOM 1300 C ASN A 677 0.852 6.109 -8.854 1.00 25.00 C ATOM 1301 O ASN A 677 2.052 6.217 -9.046 1.00 25.00 O ATOM 1302 CB ASN A 677 -1.173 5.016 -10.001 1.00 25.00 C ATOM 1303 CG ASN A 677 -0.557 3.644 -9.877 1.00 25.00 C ATOM 1304 OD1 ASN A 677 0.643 3.480 -9.827 1.00 25.00 O ATOM 1305 ND2 ASN A 677 -1.403 2.642 -9.817 1.00 25.00 N ATOM 0 H ASN A 677 1.278 5.599 -11.416 1.00 25.00 H new ATOM 0 HA ASN A 677 -0.750 7.065 -9.828 1.00 25.00 H new ATOM 0 HB2 ASN A 677 -1.878 5.162 -9.182 1.00 25.00 H new ATOM 0 HB3 ASN A 677 -1.746 5.063 -10.927 1.00 25.00 H new ATOM 0 HD21 ASN A 677 -1.057 1.687 -9.725 1.00 25.00 H new ATOM 0 HD22 ASN A 677 -2.407 2.818 -9.862 1.00 25.00 H new ATOM 1312 N GLN A 678 0.327 5.954 -7.658 1.00 25.00 N ATOM 1313 CA GLN A 678 1.105 6.001 -6.433 1.00 25.00 C ATOM 1314 C GLN A 678 2.097 4.824 -6.267 1.00 25.00 C ATOM 1315 O GLN A 678 2.802 4.730 -5.271 1.00 25.00 O ATOM 1316 CB GLN A 678 0.085 6.146 -5.299 1.00 25.00 C ATOM 1317 CG GLN A 678 0.592 6.846 -4.017 1.00 25.00 C ATOM 1318 CD GLN A 678 1.389 5.945 -3.069 1.00 25.00 C ATOM 1319 OE1 GLN A 678 0.943 4.872 -2.665 1.00 25.00 O ATOM 1320 NE2 GLN A 678 2.565 6.391 -2.701 1.00 25.00 N ATOM 0 H GLN A 678 -0.668 5.789 -7.504 1.00 25.00 H new ATOM 0 HA GLN A 678 1.788 6.851 -6.437 1.00 25.00 H new ATOM 0 HB2 GLN A 678 -0.773 6.702 -5.678 1.00 25.00 H new ATOM 0 HB3 GLN A 678 -0.273 5.152 -5.029 1.00 25.00 H new ATOM 0 HG2 GLN A 678 1.217 7.692 -4.304 1.00 25.00 H new ATOM 0 HG3 GLN A 678 -0.264 7.251 -3.478 1.00 25.00 H new ATOM 0 HE21 GLN A 678 2.905 7.285 -3.055 1.00 25.00 H new ATOM 0 HE22 GLN A 678 3.140 5.844 -2.061 1.00 25.00 H new ATOM 1329 N GLN A 679 2.151 3.941 -7.258 1.00 25.00 N ATOM 1330 CA GLN A 679 3.080 2.816 -7.255 1.00 25.00 C ATOM 1331 C GLN A 679 4.088 2.904 -8.397 1.00 25.00 C ATOM 1332 O GLN A 679 5.253 2.546 -8.227 1.00 25.00 O ATOM 1333 CB GLN A 679 2.306 1.508 -7.423 1.00 25.00 C ATOM 1334 CG GLN A 679 1.501 1.112 -6.212 1.00 25.00 C ATOM 1335 CD GLN A 679 0.292 1.998 -5.934 1.00 25.00 C ATOM 1336 OE1 GLN A 679 0.088 2.452 -4.819 1.00 25.00 O ATOM 1337 NE2 GLN A 679 -0.511 2.233 -6.929 1.00 25.00 N ATOM 0 H GLN A 679 1.554 3.984 -8.084 1.00 25.00 H new ATOM 0 HA GLN A 679 3.613 2.845 -6.305 1.00 25.00 H new ATOM 0 HB2 GLN A 679 1.636 1.602 -8.277 1.00 25.00 H new ATOM 0 HB3 GLN A 679 3.010 0.709 -7.656 1.00 25.00 H new ATOM 0 HG2 GLN A 679 1.160 0.085 -6.339 1.00 25.00 H new ATOM 0 HG3 GLN A 679 2.153 1.126 -5.339 1.00 25.00 H new ATOM 0 HE21 GLN A 679 -0.312 1.839 -7.849 1.00 25.00 H new ATOM 0 HE22 GLN A 679 -1.340 2.811 -6.790 1.00 25.00 H new ATOM 1346 N GLY A 680 3.638 3.378 -9.546 1.00 25.00 N ATOM 1347 CA GLY A 680 4.483 3.418 -10.724 1.00 25.00 C ATOM 1348 C GLY A 680 3.704 3.881 -11.931 1.00 25.00 C ATOM 1349 O GLY A 680 2.843 4.752 -11.820 1.00 25.00 O ATOM 0 H GLY A 680 2.695 3.739 -9.687 1.00 25.00 H new ATOM 0 HA2 GLY A 680 5.324 4.089 -10.550 1.00 25.00 H new ATOM 0 HA3 GLY A 680 4.898 2.428 -10.912 1.00 25.00 H new ATOM 1353 N LYS A 681 4.003 3.324 -13.098 1.00 25.00 N ATOM 1354 CA LYS A 681 3.344 3.749 -14.338 1.00 25.00 C ATOM 1355 C LYS A 681 2.797 2.603 -15.162 1.00 25.00 C ATOM 1356 O LYS A 681 3.210 1.461 -15.025 1.00 25.00 O ATOM 1357 CB LYS A 681 4.283 4.594 -15.195 1.00 25.00 C ATOM 1358 CG LYS A 681 4.632 5.931 -14.549 1.00 25.00 C ATOM 1359 CD LYS A 681 4.987 6.982 -15.594 1.00 25.00 C ATOM 1360 CE LYS A 681 6.296 6.667 -16.305 1.00 25.00 C ATOM 1361 NZ LYS A 681 7.474 6.838 -15.382 1.00 25.00 N ATOM 0 H LYS A 681 4.692 2.581 -13.217 1.00 25.00 H new ATOM 0 HA LYS A 681 2.490 4.348 -14.021 1.00 25.00 H new ATOM 0 HB2 LYS A 681 5.200 4.035 -15.380 1.00 25.00 H new ATOM 0 HB3 LYS A 681 3.819 4.775 -16.164 1.00 25.00 H new ATOM 0 HG2 LYS A 681 3.788 6.279 -13.953 1.00 25.00 H new ATOM 0 HG3 LYS A 681 5.471 5.798 -13.866 1.00 25.00 H new ATOM 0 HD2 LYS A 681 4.184 7.048 -16.328 1.00 25.00 H new ATOM 0 HD3 LYS A 681 5.062 7.958 -15.114 1.00 25.00 H new ATOM 0 HE2 LYS A 681 6.271 5.644 -16.681 1.00 25.00 H new ATOM 0 HE3 LYS A 681 6.410 7.322 -17.169 1.00 25.00 H new ATOM 0 HZ1 LYS A 681 8.356 6.767 -15.928 1.00 25.00 H new ATOM 0 HZ2 LYS A 681 7.424 7.771 -14.925 1.00 25.00 H new ATOM 0 HZ3 LYS A 681 7.456 6.095 -14.655 1.00 25.00 H new ATOM 1375 N SER A 682 1.863 2.935 -16.033 1.00 25.00 N ATOM 1376 CA SER A 682 1.229 1.948 -16.896 1.00 25.00 C ATOM 1377 C SER A 682 2.034 1.773 -18.169 1.00 25.00 C ATOM 1378 O SER A 682 2.881 2.607 -18.503 1.00 25.00 O ATOM 1379 CB SER A 682 -0.180 2.409 -17.269 1.00 25.00 C ATOM 1380 OG SER A 682 -0.144 3.374 -18.313 1.00 25.00 O ATOM 0 H SER A 682 1.522 3.887 -16.164 1.00 25.00 H new ATOM 0 HA SER A 682 1.180 1.001 -16.358 1.00 25.00 H new ATOM 0 HB2 SER A 682 -0.775 1.551 -17.583 1.00 25.00 H new ATOM 0 HB3 SER A 682 -0.670 2.834 -16.393 1.00 25.00 H new ATOM 0 HG SER A 682 -0.080 2.918 -19.178 1.00 25.00 H new ATOM 1386 N LYS A 683 1.754 0.709 -18.907 1.00 25.00 N ATOM 1387 CA LYS A 683 2.383 0.526 -20.210 1.00 25.00 C ATOM 1388 C LYS A 683 1.735 1.575 -21.102 1.00 25.00 C ATOM 1389 O LYS A 683 0.559 1.885 -20.926 1.00 25.00 O ATOM 1390 CB LYS A 683 2.106 -0.868 -20.777 1.00 25.00 C ATOM 1391 CG LYS A 683 3.068 -1.266 -21.909 1.00 25.00 C ATOM 1392 CD LYS A 683 2.527 -2.411 -22.766 1.00 25.00 C ATOM 1393 CE LYS A 683 1.430 -1.907 -23.708 1.00 25.00 C ATOM 1394 NZ LYS A 683 0.955 -2.959 -24.672 1.00 25.00 N ATOM 0 H LYS A 683 1.107 -0.030 -18.634 1.00 25.00 H new ATOM 0 HA LYS A 683 3.466 0.626 -20.144 1.00 25.00 H new ATOM 0 HB2 LYS A 683 2.179 -1.601 -19.973 1.00 25.00 H new ATOM 0 HB3 LYS A 683 1.082 -0.904 -21.150 1.00 25.00 H new ATOM 0 HG2 LYS A 683 3.255 -0.399 -22.543 1.00 25.00 H new ATOM 0 HG3 LYS A 683 4.026 -1.560 -21.480 1.00 25.00 H new ATOM 0 HD2 LYS A 683 3.337 -2.853 -23.346 1.00 25.00 H new ATOM 0 HD3 LYS A 683 2.130 -3.197 -22.124 1.00 25.00 H new ATOM 0 HE2 LYS A 683 0.584 -1.555 -23.117 1.00 25.00 H new ATOM 0 HE3 LYS A 683 1.805 -1.051 -24.269 1.00 25.00 H new ATOM 0 HZ1 LYS A 683 0.214 -2.561 -25.283 1.00 25.00 H new ATOM 0 HZ2 LYS A 683 1.753 -3.278 -25.258 1.00 25.00 H new ATOM 0 HZ3 LYS A 683 0.570 -3.767 -24.142 1.00 25.00 H new ATOM 1408 N ALA A 684 2.475 2.111 -22.053 1.00 25.00 N ATOM 1409 CA ALA A 684 1.913 3.079 -22.979 1.00 25.00 C ATOM 1410 C ALA A 684 0.950 2.391 -23.939 1.00 25.00 C ATOM 1411 O ALA A 684 1.174 1.248 -24.344 1.00 25.00 O ATOM 1412 CB ALA A 684 3.039 3.756 -23.766 1.00 25.00 C ATOM 0 H ALA A 684 3.460 1.896 -22.206 1.00 25.00 H new ATOM 0 HA ALA A 684 1.366 3.833 -22.414 1.00 25.00 H new ATOM 0 HB1 ALA A 684 2.613 4.481 -24.459 1.00 25.00 H new ATOM 0 HB2 ALA A 684 3.711 4.266 -23.075 1.00 25.00 H new ATOM 0 HB3 ALA A 684 3.596 3.004 -24.325 1.00 25.00 H new ATOM 1418 N ALA A 685 -0.094 3.106 -24.320 1.00 25.00 N ATOM 1419 CA ALA A 685 -1.001 2.655 -25.363 1.00 25.00 C ATOM 1420 C ALA A 685 -0.831 3.713 -26.439 1.00 25.00 C ATOM 1421 O ALA A 685 -0.717 4.899 -26.115 1.00 25.00 O ATOM 1422 CB ALA A 685 -2.445 2.599 -24.861 1.00 25.00 C ATOM 0 H ALA A 685 -0.337 4.011 -23.918 1.00 25.00 H new ATOM 0 HA ALA A 685 -0.785 1.646 -25.713 1.00 25.00 H new ATOM 0 HB1 ALA A 685 -3.097 2.258 -25.665 1.00 25.00 H new ATOM 0 HB2 ALA A 685 -2.512 1.907 -24.022 1.00 25.00 H new ATOM 0 HB3 ALA A 685 -2.757 3.592 -24.538 1.00 25.00 H new ATOM 1428 N HIS A 686 -0.787 3.298 -27.695 1.00 25.00 N ATOM 1429 CA HIS A 686 -0.585 4.221 -28.795 1.00 25.00 C ATOM 1430 C HIS A 686 -1.410 3.906 -30.022 1.00 25.00 C ATOM 1431 O HIS A 686 -1.713 2.744 -30.295 1.00 25.00 O ATOM 1432 CB HIS A 686 0.887 4.236 -29.171 1.00 25.00 C ATOM 1433 CG HIS A 686 1.463 2.873 -29.401 1.00 25.00 C ATOM 1434 ND1 HIS A 686 1.484 2.233 -30.614 1.00 25.00 N ATOM 1435 CD2 HIS A 686 2.060 2.007 -28.535 1.00 25.00 C ATOM 1436 CE1 HIS A 686 2.064 1.046 -30.448 1.00 25.00 C ATOM 1437 NE2 HIS A 686 2.427 0.853 -29.195 1.00 25.00 N ATOM 0 H HIS A 686 -0.889 2.323 -27.976 1.00 25.00 H new ATOM 0 HA HIS A 686 -0.917 5.198 -28.443 1.00 25.00 H new ATOM 0 HB2 HIS A 686 1.016 4.833 -30.074 1.00 25.00 H new ATOM 0 HB3 HIS A 686 1.450 4.730 -28.379 1.00 25.00 H new ATOM 0 HD2 HIS A 686 2.222 2.197 -27.484 1.00 25.00 H new ATOM 0 HE1 HIS A 686 2.218 0.330 -31.242 1.00 25.00 H new ATOM 0 HE2 HIS A 686 2.881 0.029 -28.800 1.00 25.00 H new ATOM 1445 N PHE A 687 -1.774 4.948 -30.755 1.00 25.00 N ATOM 1446 CA PHE A 687 -2.536 4.799 -31.987 1.00 25.00 C ATOM 1447 C PHE A 687 -2.182 5.920 -32.955 1.00 25.00 C ATOM 1448 O PHE A 687 -1.686 6.971 -32.538 1.00 25.00 O ATOM 1449 CB PHE A 687 -4.040 4.751 -31.703 1.00 25.00 C ATOM 1450 CG PHE A 687 -4.691 6.103 -31.530 1.00 25.00 C ATOM 1451 CD1 PHE A 687 -4.521 6.852 -30.348 1.00 25.00 C ATOM 1452 CD2 PHE A 687 -5.507 6.622 -32.554 1.00 25.00 C ATOM 1453 CE1 PHE A 687 -5.185 8.101 -30.181 1.00 25.00 C ATOM 1454 CE2 PHE A 687 -6.166 7.858 -32.395 1.00 25.00 C ATOM 1455 CZ PHE A 687 -6.015 8.593 -31.205 1.00 25.00 C ATOM 0 H PHE A 687 -1.552 5.914 -30.515 1.00 25.00 H new ATOM 0 HA PHE A 687 -2.270 3.850 -32.452 1.00 25.00 H new ATOM 0 HB2 PHE A 687 -4.534 4.226 -32.521 1.00 25.00 H new ATOM 0 HB3 PHE A 687 -4.207 4.164 -30.800 1.00 25.00 H new ATOM 0 HD1 PHE A 687 -3.882 6.476 -29.563 1.00 25.00 H new ATOM 0 HD2 PHE A 687 -5.629 6.066 -33.472 1.00 25.00 H new ATOM 0 HE1 PHE A 687 -5.052 8.668 -29.272 1.00 25.00 H new ATOM 0 HE2 PHE A 687 -6.789 8.242 -33.189 1.00 25.00 H new ATOM 0 HZ PHE A 687 -6.534 9.531 -31.078 1.00 25.00 H new ATOM 1465 N VAL A 688 -2.415 5.671 -34.233 1.00 25.00 N ATOM 1466 CA VAL A 688 -2.076 6.603 -35.309 1.00 25.00 C ATOM 1467 C VAL A 688 -3.376 6.901 -36.057 1.00 25.00 C ATOM 1468 O VAL A 688 -4.197 5.998 -36.232 1.00 25.00 O ATOM 1469 CB VAL A 688 -1.019 5.954 -36.261 1.00 25.00 C ATOM 1470 CG1 VAL A 688 -0.630 6.893 -37.386 1.00 25.00 C ATOM 1471 CG2 VAL A 688 0.243 5.564 -35.468 1.00 25.00 C ATOM 0 H VAL A 688 -2.849 4.809 -34.562 1.00 25.00 H new ATOM 0 HA VAL A 688 -1.640 7.523 -34.920 1.00 25.00 H new ATOM 0 HB VAL A 688 -1.474 5.064 -36.696 1.00 25.00 H new ATOM 0 HG11 VAL A 688 0.106 6.408 -38.027 1.00 25.00 H new ATOM 0 HG12 VAL A 688 -1.514 7.143 -37.973 1.00 25.00 H new ATOM 0 HG13 VAL A 688 -0.202 7.804 -36.968 1.00 25.00 H new ATOM 0 HG21 VAL A 688 0.971 5.113 -36.142 1.00 25.00 H new ATOM 0 HG22 VAL A 688 0.675 6.454 -35.010 1.00 25.00 H new ATOM 0 HG23 VAL A 688 -0.023 4.848 -34.690 1.00 25.00 H new ATOM 1481 N PHE A 689 -3.581 8.145 -36.474 1.00 25.00 N ATOM 1482 CA PHE A 689 -4.826 8.539 -37.141 1.00 25.00 C ATOM 1483 C PHE A 689 -4.629 9.719 -38.106 1.00 25.00 C ATOM 1484 O PHE A 689 -3.668 10.471 -37.985 1.00 25.00 O ATOM 1485 CB PHE A 689 -5.844 8.919 -36.051 1.00 25.00 C ATOM 1486 CG PHE A 689 -7.229 9.210 -36.571 1.00 25.00 C ATOM 1487 CD1 PHE A 689 -7.637 10.537 -36.816 1.00 25.00 C ATOM 1488 CD2 PHE A 689 -8.139 8.166 -36.808 1.00 25.00 C ATOM 1489 CE1 PHE A 689 -8.934 10.824 -37.280 1.00 25.00 C ATOM 1490 CE2 PHE A 689 -9.445 8.443 -37.285 1.00 25.00 C ATOM 1491 CZ PHE A 689 -9.839 9.780 -37.518 1.00 25.00 C ATOM 0 H PHE A 689 -2.905 8.901 -36.364 1.00 25.00 H new ATOM 0 HA PHE A 689 -5.181 7.702 -37.742 1.00 25.00 H new ATOM 0 HB2 PHE A 689 -5.904 8.107 -35.327 1.00 25.00 H new ATOM 0 HB3 PHE A 689 -5.477 9.796 -35.517 1.00 25.00 H new ATOM 0 HD1 PHE A 689 -6.943 11.346 -36.645 1.00 25.00 H new ATOM 0 HD2 PHE A 689 -7.841 7.144 -36.625 1.00 25.00 H new ATOM 0 HE1 PHE A 689 -9.232 11.848 -37.453 1.00 25.00 H new ATOM 0 HE2 PHE A 689 -10.137 7.635 -37.470 1.00 25.00 H new ATOM 0 HZ PHE A 689 -10.834 9.997 -37.878 1.00 25.00 H new ATOM 1501 N ARG A 690 -5.562 9.864 -39.046 1.00 25.00 N ATOM 1502 CA ARG A 690 -5.657 11.005 -39.976 1.00 25.00 C ATOM 1503 C ARG A 690 -7.102 10.971 -40.441 1.00 25.00 C ATOM 1504 O ARG A 690 -7.752 9.933 -40.317 1.00 25.00 O ATOM 1505 CB ARG A 690 -4.729 10.919 -41.209 1.00 25.00 C ATOM 1506 CG ARG A 690 -3.924 9.643 -41.392 1.00 25.00 C ATOM 1507 CD ARG A 690 -4.735 8.499 -41.949 1.00 25.00 C ATOM 1508 NE ARG A 690 -3.900 7.295 -41.959 1.00 25.00 N ATOM 1509 CZ ARG A 690 -4.225 6.125 -42.475 1.00 25.00 C ATOM 1510 NH1 ARG A 690 -5.375 5.912 -43.068 1.00 25.00 N ATOM 1511 NH2 ARG A 690 -3.358 5.157 -42.394 1.00 25.00 N ATOM 0 H ARG A 690 -6.298 9.173 -39.192 1.00 25.00 H new ATOM 0 HA ARG A 690 -5.349 11.919 -39.468 1.00 25.00 H new ATOM 0 HB2 ARG A 690 -5.340 11.063 -42.100 1.00 25.00 H new ATOM 0 HB3 ARG A 690 -4.030 11.754 -41.163 1.00 25.00 H new ATOM 0 HG2 ARG A 690 -3.086 9.843 -42.059 1.00 25.00 H new ATOM 0 HG3 ARG A 690 -3.503 9.347 -40.431 1.00 25.00 H new ATOM 0 HD2 ARG A 690 -5.626 8.336 -41.342 1.00 25.00 H new ATOM 0 HD3 ARG A 690 -5.075 8.732 -42.958 1.00 25.00 H new ATOM 0 HE ARG A 690 -2.980 7.368 -41.526 1.00 25.00 H new ATOM 0 HH11 ARG A 690 -6.057 6.666 -43.143 1.00 25.00 H new ATOM 0 HH12 ARG A 690 -5.587 4.992 -43.454 1.00 25.00 H new ATOM 0 HH21 ARG A 690 -2.458 5.315 -41.941 1.00 25.00 H new ATOM 0 HH22 ARG A 690 -3.579 4.240 -42.783 1.00 25.00 H new ATOM 1525 N THR A 691 -7.599 12.073 -40.975 1.00 25.00 N ATOM 1526 CA THR A 691 -8.969 12.154 -41.487 1.00 25.00 C ATOM 1527 C THR A 691 -8.929 13.099 -42.696 1.00 25.00 C ATOM 1528 O THR A 691 -7.851 13.533 -43.083 1.00 25.00 O ATOM 1529 CB THR A 691 -9.951 12.631 -40.362 1.00 25.00 C ATOM 1530 OG1 THR A 691 -11.287 12.726 -40.870 1.00 25.00 O ATOM 1531 CG2 THR A 691 -9.546 13.978 -39.778 1.00 25.00 C ATOM 0 H THR A 691 -7.070 12.940 -41.069 1.00 25.00 H new ATOM 0 HA THR A 691 -9.346 11.181 -41.802 1.00 25.00 H new ATOM 0 HB THR A 691 -9.905 11.886 -39.568 1.00 25.00 H new ATOM 0 HG1 THR A 691 -11.459 13.643 -41.169 1.00 25.00 H new ATOM 0 HG21 THR A 691 -10.256 14.267 -39.003 1.00 25.00 H new ATOM 0 HG22 THR A 691 -8.548 13.902 -39.346 1.00 25.00 H new ATOM 0 HG23 THR A 691 -9.544 14.731 -40.566 1.00 25.00 H new ATOM 1539 N HIS A 692 -10.083 13.400 -43.288 1.00 25.00 N ATOM 1540 CA HIS A 692 -10.182 14.310 -44.447 1.00 25.00 C ATOM 1541 C HIS A 692 -9.227 13.886 -45.569 1.00 25.00 C ATOM 1542 O HIS A 692 -8.493 14.695 -46.136 1.00 25.00 O ATOM 1543 CB HIS A 692 -9.923 15.768 -44.030 1.00 25.00 C ATOM 1544 CG HIS A 692 -11.017 16.357 -43.192 1.00 25.00 C ATOM 1545 ND1 HIS A 692 -11.329 15.956 -41.916 1.00 25.00 N ATOM 1546 CD2 HIS A 692 -11.898 17.358 -43.468 1.00 25.00 C ATOM 1547 CE1 HIS A 692 -12.339 16.702 -41.479 1.00 25.00 C ATOM 1548 NE2 HIS A 692 -12.729 17.570 -42.387 1.00 25.00 N ATOM 0 H HIS A 692 -10.981 13.024 -42.984 1.00 25.00 H new ATOM 0 HA HIS A 692 -11.200 14.245 -44.831 1.00 25.00 H new ATOM 0 HB2 HIS A 692 -8.986 15.817 -43.476 1.00 25.00 H new ATOM 0 HB3 HIS A 692 -9.796 16.376 -44.926 1.00 25.00 H new ATOM 0 HD2 HIS A 692 -11.940 17.906 -44.398 1.00 25.00 H new ATOM 0 HE1 HIS A 692 -12.784 16.607 -40.500 1.00 25.00 H new ATOM 0 HE2 HIS A 692 -13.483 18.253 -42.309 1.00 25.00 H new ATOM 1556 N HIS A 693 -9.241 12.598 -45.874 1.00 25.00 N ATOM 1557 CA HIS A 693 -8.389 12.051 -46.920 1.00 25.00 C ATOM 1558 C HIS A 693 -8.798 12.610 -48.277 1.00 25.00 C ATOM 1559 O HIS A 693 -9.920 13.076 -48.460 1.00 25.00 O ATOM 1560 CB HIS A 693 -8.518 10.533 -46.972 1.00 25.00 C ATOM 1561 CG HIS A 693 -8.353 9.859 -45.645 1.00 25.00 C ATOM 1562 ND1 HIS A 693 -9.051 8.742 -45.264 1.00 25.00 N ATOM 1563 CD2 HIS A 693 -7.539 10.146 -44.590 1.00 25.00 C ATOM 1564 CE1 HIS A 693 -8.663 8.406 -44.040 1.00 25.00 C ATOM 1565 NE2 HIS A 693 -7.736 9.221 -43.582 1.00 25.00 N ATOM 0 H HIS A 693 -9.834 11.910 -45.411 1.00 25.00 H new ATOM 0 HA HIS A 693 -7.360 12.329 -46.694 1.00 25.00 H new ATOM 0 HB2 HIS A 693 -9.496 10.276 -47.379 1.00 25.00 H new ATOM 0 HB3 HIS A 693 -7.772 10.139 -47.663 1.00 25.00 H new ATOM 0 HD2 HIS A 693 -6.844 10.972 -44.548 1.00 25.00 H new ATOM 0 HE1 HIS A 693 -9.059 7.567 -43.487 1.00 25.00 H new ATOM 0 HE2 HIS A 693 -7.265 9.179 -42.678 1.00 25.00 H new ATOM 1573 N HIS A 694 -7.883 12.537 -49.232 1.00 25.00 N ATOM 1574 CA HIS A 694 -8.108 13.037 -50.591 1.00 25.00 C ATOM 1575 C HIS A 694 -8.990 12.120 -51.459 1.00 25.00 C ATOM 1576 O HIS A 694 -8.784 12.006 -52.664 1.00 25.00 O ATOM 1577 CB HIS A 694 -6.749 13.244 -51.269 1.00 25.00 C ATOM 1578 CG HIS A 694 -5.677 13.703 -50.330 1.00 25.00 C ATOM 1579 ND1 HIS A 694 -5.735 14.853 -49.580 1.00 25.00 N ATOM 1580 CD2 HIS A 694 -4.484 13.131 -50.005 1.00 25.00 C ATOM 1581 CE1 HIS A 694 -4.627 14.928 -48.848 1.00 25.00 C ATOM 1582 NE2 HIS A 694 -3.827 13.904 -49.070 1.00 25.00 N ATOM 0 H HIS A 694 -6.959 12.129 -49.091 1.00 25.00 H new ATOM 0 HA HIS A 694 -8.655 13.975 -50.499 1.00 25.00 H new ATOM 0 HB2 HIS A 694 -6.438 12.309 -51.734 1.00 25.00 H new ATOM 0 HB3 HIS A 694 -6.859 13.977 -52.069 1.00 25.00 H new ATOM 0 HD2 HIS A 694 -4.108 12.207 -50.419 1.00 25.00 H new ATOM 0 HE1 HIS A 694 -4.410 15.729 -48.157 1.00 25.00 H new ATOM 0 HE2 HIS A 694 -2.919 13.722 -48.643 1.00 25.00 H new ATOM 1590 N HIS A 695 -9.973 11.479 -50.846 1.00 25.00 N ATOM 1591 CA HIS A 695 -10.919 10.623 -51.551 1.00 25.00 C ATOM 1592 C HIS A 695 -12.232 10.702 -50.789 1.00 25.00 C ATOM 1593 O HIS A 695 -12.241 10.888 -49.569 1.00 25.00 O ATOM 1594 CB HIS A 695 -10.414 9.174 -51.665 1.00 25.00 C ATOM 1595 CG HIS A 695 -10.034 8.545 -50.358 1.00 25.00 C ATOM 1596 ND1 HIS A 695 -8.753 8.180 -50.024 1.00 25.00 N ATOM 1597 CD2 HIS A 695 -10.791 8.195 -49.280 1.00 25.00 C ATOM 1598 CE1 HIS A 695 -8.776 7.632 -48.814 1.00 25.00 C ATOM 1599 NE2 HIS A 695 -9.992 7.622 -48.306 1.00 25.00 N ATOM 0 H HIS A 695 -10.139 11.537 -49.841 1.00 25.00 H new ATOM 0 HA HIS A 695 -11.047 10.964 -52.578 1.00 25.00 H new ATOM 0 HB2 HIS A 695 -11.189 8.568 -52.134 1.00 25.00 H new ATOM 0 HB3 HIS A 695 -9.549 9.155 -52.328 1.00 25.00 H new ATOM 0 HD2 HIS A 695 -11.858 8.343 -49.198 1.00 25.00 H new ATOM 0 HE1 HIS A 695 -7.905 7.242 -48.308 1.00 25.00 H new ATOM 0 HE2 HIS A 695 -10.281 7.269 -47.394 1.00 25.00 H new ATOM 1607 N HIS A 696 -13.336 10.585 -51.510 1.00 25.00 N ATOM 1608 CA HIS A 696 -14.667 10.752 -50.933 1.00 25.00 C ATOM 1609 C HIS A 696 -15.583 9.663 -51.483 1.00 25.00 C ATOM 1610 O HIS A 696 -15.115 8.743 -52.148 1.00 25.00 O ATOM 1611 CB HIS A 696 -15.218 12.143 -51.293 1.00 25.00 C ATOM 1612 CG HIS A 696 -14.216 13.247 -51.133 1.00 25.00 C ATOM 1613 ND1 HIS A 696 -13.576 13.557 -49.958 1.00 25.00 N ATOM 1614 CD2 HIS A 696 -13.725 14.133 -52.044 1.00 25.00 C ATOM 1615 CE1 HIS A 696 -12.752 14.573 -50.187 1.00 25.00 C ATOM 1616 NE2 HIS A 696 -12.803 14.968 -51.443 1.00 25.00 N ATOM 0 H HIS A 696 -13.339 10.373 -52.508 1.00 25.00 H new ATOM 0 HA HIS A 696 -14.615 10.669 -49.847 1.00 25.00 H new ATOM 0 HB2 HIS A 696 -15.569 12.129 -52.325 1.00 25.00 H new ATOM 0 HB3 HIS A 696 -16.083 12.355 -50.665 1.00 25.00 H new ATOM 0 HD2 HIS A 696 -14.014 14.176 -53.084 1.00 25.00 H new ATOM 0 HE1 HIS A 696 -12.118 15.021 -49.436 1.00 25.00 H new ATOM 0 HE2 HIS A 696 -12.276 15.726 -51.877 1.00 25.00 H new ATOM 1624 N HIS A 697 -16.875 9.781 -51.213 1.00 25.00 N ATOM 1625 CA HIS A 697 -17.874 8.833 -51.694 1.00 25.00 C ATOM 1626 C HIS A 697 -19.064 9.676 -52.107 1.00 25.00 C ATOM 1627 O HIS A 697 -20.089 9.123 -52.548 1.00 25.00 O ATOM 1628 CB HIS A 697 -18.284 7.846 -50.590 1.00 25.00 C ATOM 1629 CG HIS A 697 -19.076 8.473 -49.480 1.00 25.00 C ATOM 1630 ND1 HIS A 697 -20.361 8.995 -49.654 1.00 25.00 N ATOM 1631 CD2 HIS A 697 -18.800 8.674 -48.164 1.00 25.00 C ATOM 1632 CE1 HIS A 697 -20.796 9.466 -48.494 1.00 25.00 C ATOM 1633 NE2 HIS A 697 -19.874 9.283 -47.586 1.00 25.00 N ATOM 1634 OXT HIS A 697 -18.951 10.905 -51.928 1.00 25.00 O ATOM 0 H HIS A 697 -17.263 10.539 -50.652 1.00 25.00 H new ATOM 0 HA HIS A 697 -17.484 8.235 -52.517 1.00 25.00 H new ATOM 0 HB2 HIS A 697 -18.872 7.042 -51.034 1.00 25.00 H new ATOM 0 HB3 HIS A 697 -17.387 7.391 -50.171 1.00 25.00 H new ATOM 0 HD1 HIS A 697 -20.880 9.011 -50.532 1.00 25.00 H new ATOM 0 HD2 HIS A 697 -17.885 8.398 -47.662 1.00 25.00 H new ATOM 0 HE1 HIS A 697 -21.758 9.927 -48.326 1.00 25.00 H new TER 1642 HIS A 697