USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1052 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 650 CYS SG : rot -8:sc= 0.387 USER MOD Set 1.2: A 719 GLN : amide:sc= -2.66 K(o=-2.3,f=-5.4!) USER MOD Set 2.1: A 579 THR OG1 : rot 137:sc= -0.0865 USER MOD Set 2.2: A 697 ASN : amide:sc= 0.312 K(o=0.23,f=-7.4!) USER MOD Set 3.1: A 664 MET CE :methyl -177:sc= -3.82 (180deg=-3.96) USER MOD Set 3.2: A 668 THR OG1 : rot -75:sc= -0.307 USER MOD Set 4.1: A 654 THR OG1 : rot -11:sc= 0.0833 USER MOD Set 4.2: A 666 GLN :FLIP amide:sc= -1.67! C(o=-2.9!,f=-1.6!) USER MOD Set 5.1: A 622 HIS :FLIP no HD1:sc= -13.1! C(o=-23!,f=-21!) USER MOD Set 5.2: A 623 CYS SG : rot -82:sc= -2.17! USER MOD Set 5.3: A 649 TYR OH : rot -5:sc= 0.626 USER MOD Set 5.4: A 651 HIS : no HD1:sc= -6.26! C(o=-21!,f=-34!) USER MOD Set 5.5: A 657 SER OG : rot -124:sc= -0.596 USER MOD Single : A 581 LYS NZ :NH3+ -106:sc= -0.292 (180deg=-1.04) USER MOD Single : A 586 SER OG : rot -165:sc= -4.36! USER MOD Single : A 589 GLN : amide:sc= -2.76! C(o=-2.8!,f=-2.7!) USER MOD Single : A 591 SER OG : rot 180:sc= 0 USER MOD Single : A 595 GLN :FLIP amide:sc= -0.64 F(o=-3.3,f=-0.64) USER MOD Single : A 596 GLN :FLIP amide:sc= -0.132 F(o=-2.7,f=-0.13) USER MOD Single : A 599 ASN : amide:sc= -2.32! C(o=-2.3!,f=-2.4!) USER MOD Single : A 606 SER OG : rot 180:sc= 0 USER MOD Single : A 609 CYS SG : rot 114:sc= -6.94! USER MOD Single : A 610 ASN : amide:sc= -5.33! C(o=-5.3!,f=-5.5!) USER MOD Single : A 611 CYS SG : rot 170:sc= -13.1! USER MOD Single : A 612 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 616 ASN : amide:sc= -0.0738 X(o=-0.074,f=0) USER MOD Single : A 619 SER OG : rot 180:sc= -0.147 USER MOD Single : A 627 LYS NZ :NH3+ 150:sc= -0.286 (180deg=-0.885) USER MOD Single : A 628 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 630 HIS : no HE2:sc= -0.628 K(o=-0.63,f=-1.6) USER MOD Single : A 652 THR OG1 : rot 109:sc= -0.886! USER MOD Single : A 655 ASN :FLIP amide:sc= -0.716 F(o=-1.7!,f=-0.72) USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 660 ASN : amide:sc= -0.14 X(o=-0.14,f=0) USER MOD Single : A 661 ASN : amide:sc= -1.05 K(o=-1,f=-3.3!) USER MOD Single : A 662 ASN : amide:sc= -1.76! C(o=-1.8!,f=-3.5!) USER MOD Single : A 669 LYS NZ :NH3+ -153:sc= -0.0167 (180deg=-0.328) USER MOD Single : A 673 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 679 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 684 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 685 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 686 ASN : amide:sc= -0.0062 X(o=-0.0062,f=0) USER MOD Single : A 687 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0869) USER MOD Single : A 693 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 699 THR OG1 : rot 6:sc= 0.904 USER MOD Single : A 700 THR OG1 : rot 180:sc= -0.0238 USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 720 THR OG1 : rot 180:sc= 0 USER MOD Single : A 724 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0876) USER MOD Single : A 728 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 29 N ARG A 576 -13.659 4.928 -12.693 1.00 0.00 N ATOM 30 CA ARG A 576 -12.540 4.252 -13.334 1.00 0.00 C ATOM 31 C ARG A 576 -11.605 5.265 -13.954 1.00 0.00 C ATOM 32 O ARG A 576 -12.027 6.145 -14.704 1.00 0.00 O ATOM 33 CB ARG A 576 -13.043 3.277 -14.398 1.00 0.00 C ATOM 34 CG ARG A 576 -12.008 2.248 -14.819 1.00 0.00 C ATOM 35 CD ARG A 576 -11.127 2.773 -15.940 1.00 0.00 C ATOM 36 NE ARG A 576 -11.908 3.183 -17.104 1.00 0.00 N ATOM 37 CZ ARG A 576 -12.527 2.331 -17.919 1.00 0.00 C ATOM 38 NH1 ARG A 576 -12.451 1.024 -17.705 1.00 0.00 N ATOM 39 NH2 ARG A 576 -13.222 2.788 -18.951 1.00 0.00 N ATOM 0 HA ARG A 576 -11.995 3.688 -12.577 1.00 0.00 H new ATOM 0 HB2 ARG A 576 -13.923 2.759 -14.017 1.00 0.00 H new ATOM 0 HB3 ARG A 576 -13.360 3.841 -15.275 1.00 0.00 H new ATOM 0 HG2 ARG A 576 -11.389 1.981 -13.962 1.00 0.00 H new ATOM 0 HG3 ARG A 576 -12.510 1.337 -15.145 1.00 0.00 H new ATOM 0 HD2 ARG A 576 -10.545 3.620 -15.577 1.00 0.00 H new ATOM 0 HD3 ARG A 576 -10.416 2.001 -16.234 1.00 0.00 H new ATOM 0 HE ARG A 576 -11.984 4.180 -17.304 1.00 0.00 H new ATOM 0 HH11 ARG A 576 -11.916 0.667 -16.913 1.00 0.00 H new ATOM 0 HH12 ARG A 576 -12.927 0.376 -18.332 1.00 0.00 H new ATOM 0 HH21 ARG A 576 -13.283 3.792 -19.121 1.00 0.00 H new ATOM 0 HH22 ARG A 576 -13.696 2.136 -19.575 1.00 0.00 H new ATOM 53 N PHE A 577 -10.338 5.145 -13.615 1.00 0.00 N ATOM 54 CA PHE A 577 -9.330 6.055 -14.113 1.00 0.00 C ATOM 55 C PHE A 577 -8.284 5.308 -14.922 1.00 0.00 C ATOM 56 O PHE A 577 -7.876 5.739 -16.000 1.00 0.00 O ATOM 57 CB PHE A 577 -8.680 6.770 -12.928 1.00 0.00 C ATOM 58 CG PHE A 577 -7.307 6.277 -12.561 1.00 0.00 C ATOM 59 CD1 PHE A 577 -7.150 5.224 -11.674 1.00 0.00 C ATOM 60 CD2 PHE A 577 -6.175 6.869 -13.099 1.00 0.00 C ATOM 61 CE1 PHE A 577 -5.890 4.770 -11.331 1.00 0.00 C ATOM 62 CE2 PHE A 577 -4.914 6.420 -12.760 1.00 0.00 C ATOM 63 CZ PHE A 577 -4.771 5.368 -11.874 1.00 0.00 C ATOM 0 H PHE A 577 -9.981 4.420 -12.992 1.00 0.00 H new ATOM 0 HA PHE A 577 -9.798 6.788 -14.771 1.00 0.00 H new ATOM 0 HB2 PHE A 577 -8.618 7.834 -13.155 1.00 0.00 H new ATOM 0 HB3 PHE A 577 -9.331 6.666 -12.060 1.00 0.00 H new ATOM 0 HD1 PHE A 577 -8.022 4.752 -11.246 1.00 0.00 H new ATOM 0 HD2 PHE A 577 -6.281 7.691 -13.791 1.00 0.00 H new ATOM 0 HE1 PHE A 577 -5.782 3.948 -10.639 1.00 0.00 H new ATOM 0 HE2 PHE A 577 -4.040 6.890 -13.186 1.00 0.00 H new ATOM 0 HZ PHE A 577 -3.786 5.015 -11.608 1.00 0.00 H new ATOM 73 N LEU A 578 -7.854 4.187 -14.372 1.00 0.00 N ATOM 74 CA LEU A 578 -6.842 3.355 -15.012 1.00 0.00 C ATOM 75 C LEU A 578 -7.409 1.990 -15.370 1.00 0.00 C ATOM 76 O LEU A 578 -8.209 1.425 -14.624 1.00 0.00 O ATOM 77 CB LEU A 578 -5.628 3.201 -14.095 1.00 0.00 C ATOM 78 CG LEU A 578 -4.527 2.274 -14.614 1.00 0.00 C ATOM 79 CD1 LEU A 578 -4.075 2.706 -16.002 1.00 0.00 C ATOM 80 CD2 LEU A 578 -3.350 2.253 -13.649 1.00 0.00 C ATOM 0 H LEU A 578 -8.190 3.827 -13.479 1.00 0.00 H new ATOM 0 HA LEU A 578 -6.529 3.846 -15.934 1.00 0.00 H new ATOM 0 HB2 LEU A 578 -5.197 4.187 -13.922 1.00 0.00 H new ATOM 0 HB3 LEU A 578 -5.968 2.828 -13.129 1.00 0.00 H new ATOM 0 HG LEU A 578 -4.931 1.264 -14.685 1.00 0.00 H new ATOM 0 HD11 LEU A 578 -3.292 2.035 -16.355 1.00 0.00 H new ATOM 0 HD12 LEU A 578 -4.921 2.669 -16.688 1.00 0.00 H new ATOM 0 HD13 LEU A 578 -3.688 3.724 -15.958 1.00 0.00 H new ATOM 0 HD21 LEU A 578 -2.576 1.589 -14.034 1.00 0.00 H new ATOM 0 HD22 LEU A 578 -2.946 3.260 -13.546 1.00 0.00 H new ATOM 0 HD23 LEU A 578 -3.684 1.895 -12.675 1.00 0.00 H new ATOM 92 N THR A 579 -6.998 1.464 -16.519 1.00 0.00 N ATOM 93 CA THR A 579 -7.480 0.167 -16.967 1.00 0.00 C ATOM 94 C THR A 579 -6.339 -0.797 -17.265 1.00 0.00 C ATOM 95 O THR A 579 -5.578 -0.608 -18.211 1.00 0.00 O ATOM 96 CB THR A 579 -8.359 0.295 -18.224 1.00 0.00 C ATOM 97 OG1 THR A 579 -9.297 1.366 -18.062 1.00 0.00 O ATOM 98 CG2 THR A 579 -9.106 -1.004 -18.496 1.00 0.00 C ATOM 0 H THR A 579 -6.337 1.914 -17.152 1.00 0.00 H new ATOM 0 HA THR A 579 -8.074 -0.232 -16.145 1.00 0.00 H new ATOM 0 HB THR A 579 -7.710 0.508 -19.073 1.00 0.00 H new ATOM 0 HG1 THR A 579 -9.345 1.887 -18.891 1.00 0.00 H new ATOM 0 HG21 THR A 579 -9.721 -0.890 -19.389 1.00 0.00 H new ATOM 0 HG22 THR A 579 -8.389 -1.811 -18.649 1.00 0.00 H new ATOM 0 HG23 THR A 579 -9.743 -1.242 -17.645 1.00 0.00 H new ATOM 106 N LEU A 580 -6.265 -1.860 -16.475 1.00 0.00 N ATOM 107 CA LEU A 580 -5.268 -2.896 -16.664 1.00 0.00 C ATOM 108 C LEU A 580 -5.945 -4.051 -17.370 1.00 0.00 C ATOM 109 O LEU A 580 -6.814 -4.708 -16.798 1.00 0.00 O ATOM 110 CB LEU A 580 -4.695 -3.350 -15.320 1.00 0.00 C ATOM 111 CG LEU A 580 -3.276 -2.867 -15.029 1.00 0.00 C ATOM 112 CD1 LEU A 580 -2.780 -3.430 -13.705 1.00 0.00 C ATOM 113 CD2 LEU A 580 -2.339 -3.256 -16.164 1.00 0.00 C ATOM 0 H LEU A 580 -6.894 -2.025 -15.689 1.00 0.00 H new ATOM 0 HA LEU A 580 -4.436 -2.518 -17.258 1.00 0.00 H new ATOM 0 HB2 LEU A 580 -5.353 -3.000 -14.524 1.00 0.00 H new ATOM 0 HB3 LEU A 580 -4.706 -4.439 -15.286 1.00 0.00 H new ATOM 0 HG LEU A 580 -3.290 -1.780 -14.953 1.00 0.00 H new ATOM 0 HD11 LEU A 580 -1.767 -3.075 -13.515 1.00 0.00 H new ATOM 0 HD12 LEU A 580 -3.437 -3.100 -12.900 1.00 0.00 H new ATOM 0 HD13 LEU A 580 -2.780 -4.519 -13.750 1.00 0.00 H new ATOM 0 HD21 LEU A 580 -1.332 -2.904 -15.941 1.00 0.00 H new ATOM 0 HD22 LEU A 580 -2.329 -4.341 -16.272 1.00 0.00 H new ATOM 0 HD23 LEU A 580 -2.684 -2.802 -17.093 1.00 0.00 H new ATOM 125 N LYS A 581 -5.598 -4.266 -18.624 1.00 0.00 N ATOM 126 CA LYS A 581 -6.251 -5.318 -19.396 1.00 0.00 C ATOM 127 C LYS A 581 -5.360 -6.529 -19.655 1.00 0.00 C ATOM 128 O LYS A 581 -4.545 -6.521 -20.578 1.00 0.00 O ATOM 129 CB LYS A 581 -6.762 -4.766 -20.737 1.00 0.00 C ATOM 130 CG LYS A 581 -6.238 -3.381 -21.086 1.00 0.00 C ATOM 131 CD LYS A 581 -6.944 -2.810 -22.305 1.00 0.00 C ATOM 132 CE LYS A 581 -8.441 -2.683 -22.072 1.00 0.00 C ATOM 133 NZ LYS A 581 -9.191 -3.841 -22.633 1.00 0.00 N ATOM 0 H LYS A 581 -4.883 -3.741 -19.127 1.00 0.00 H new ATOM 0 HA LYS A 581 -7.086 -5.660 -18.784 1.00 0.00 H new ATOM 0 HB2 LYS A 581 -6.482 -5.458 -21.531 1.00 0.00 H new ATOM 0 HB3 LYS A 581 -7.851 -4.734 -20.711 1.00 0.00 H new ATOM 0 HG2 LYS A 581 -6.379 -2.713 -20.236 1.00 0.00 H new ATOM 0 HG3 LYS A 581 -5.166 -3.434 -21.276 1.00 0.00 H new ATOM 0 HD2 LYS A 581 -6.527 -1.831 -22.543 1.00 0.00 H new ATOM 0 HD3 LYS A 581 -6.762 -3.452 -23.167 1.00 0.00 H new ATOM 0 HE2 LYS A 581 -8.637 -2.608 -21.002 1.00 0.00 H new ATOM 0 HE3 LYS A 581 -8.802 -1.761 -22.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 -9.687 -3.547 -23.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 -8.527 -4.609 -22.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 -9.884 -4.177 -21.934 1.00 0.00 H new ATOM 147 N PRO A 582 -5.546 -7.618 -18.881 1.00 0.00 N ATOM 148 CA PRO A 582 -4.790 -8.843 -19.102 1.00 0.00 C ATOM 149 C PRO A 582 -5.012 -9.311 -20.537 1.00 0.00 C ATOM 150 O PRO A 582 -6.042 -9.902 -20.858 1.00 0.00 O ATOM 151 CB PRO A 582 -5.356 -9.858 -18.101 1.00 0.00 C ATOM 152 CG PRO A 582 -6.472 -9.183 -17.364 1.00 0.00 C ATOM 153 CD PRO A 582 -6.535 -7.736 -17.801 1.00 0.00 C ATOM 0 HA PRO A 582 -3.717 -8.711 -18.961 1.00 0.00 H new ATOM 0 HB2 PRO A 582 -5.719 -10.746 -18.618 1.00 0.00 H new ATOM 0 HB3 PRO A 582 -4.582 -10.187 -17.408 1.00 0.00 H new ATOM 0 HG2 PRO A 582 -7.418 -9.682 -17.572 1.00 0.00 H new ATOM 0 HG3 PRO A 582 -6.307 -9.246 -16.288 1.00 0.00 H new ATOM 0 HD2 PRO A 582 -7.533 -7.473 -18.151 1.00 0.00 H new ATOM 0 HD3 PRO A 582 -6.299 -7.064 -16.976 1.00 0.00 H new ATOM 161 N LEU A 583 -4.060 -8.978 -21.399 1.00 0.00 N ATOM 162 CA LEU A 583 -4.148 -9.286 -22.825 1.00 0.00 C ATOM 163 C LEU A 583 -3.882 -10.749 -23.166 1.00 0.00 C ATOM 164 O LEU A 583 -3.310 -11.505 -22.382 1.00 0.00 O ATOM 165 CB LEU A 583 -3.224 -8.382 -23.642 1.00 0.00 C ATOM 166 CG LEU A 583 -1.819 -8.157 -23.081 1.00 0.00 C ATOM 167 CD1 LEU A 583 -1.821 -7.004 -22.090 1.00 0.00 C ATOM 168 CD2 LEU A 583 -1.275 -9.428 -22.442 1.00 0.00 C ATOM 0 H LEU A 583 -3.206 -8.488 -21.133 1.00 0.00 H new ATOM 0 HA LEU A 583 -5.186 -9.092 -23.095 1.00 0.00 H new ATOM 0 HB2 LEU A 583 -3.128 -8.806 -24.642 1.00 0.00 H new ATOM 0 HB3 LEU A 583 -3.707 -7.411 -23.752 1.00 0.00 H new ATOM 0 HG LEU A 583 -1.159 -7.895 -23.908 1.00 0.00 H new ATOM 0 HD11 LEU A 583 -0.814 -6.857 -21.700 1.00 0.00 H new ATOM 0 HD12 LEU A 583 -2.152 -6.094 -22.591 1.00 0.00 H new ATOM 0 HD13 LEU A 583 -2.499 -7.233 -21.267 1.00 0.00 H new ATOM 0 HD21 LEU A 583 -0.275 -9.240 -22.051 1.00 0.00 H new ATOM 0 HD22 LEU A 583 -1.931 -9.735 -21.627 1.00 0.00 H new ATOM 0 HD23 LEU A 583 -1.229 -10.220 -23.189 1.00 0.00 H new ATOM 180 N PRO A 584 -4.336 -11.147 -24.370 1.00 0.00 N ATOM 181 CA PRO A 584 -4.206 -12.514 -24.893 1.00 0.00 C ATOM 182 C PRO A 584 -2.797 -13.073 -24.761 1.00 0.00 C ATOM 183 O PRO A 584 -2.617 -14.288 -24.669 1.00 0.00 O ATOM 184 CB PRO A 584 -4.593 -12.359 -26.364 1.00 0.00 C ATOM 185 CG PRO A 584 -5.542 -11.212 -26.371 1.00 0.00 C ATOM 186 CD PRO A 584 -5.035 -10.264 -25.320 1.00 0.00 C ATOM 0 HA PRO A 584 -4.827 -13.220 -24.341 1.00 0.00 H new ATOM 0 HB2 PRO A 584 -3.721 -12.159 -26.987 1.00 0.00 H new ATOM 0 HB3 PRO A 584 -5.060 -13.265 -26.751 1.00 0.00 H new ATOM 0 HG2 PRO A 584 -5.572 -10.733 -27.350 1.00 0.00 H new ATOM 0 HG3 PRO A 584 -6.557 -11.541 -26.146 1.00 0.00 H new ATOM 0 HD2 PRO A 584 -4.363 -9.517 -25.743 1.00 0.00 H new ATOM 0 HD3 PRO A 584 -5.851 -9.723 -24.840 1.00 0.00 H new ATOM 194 N ASP A 585 -1.798 -12.198 -24.714 1.00 0.00 N ATOM 195 CA ASP A 585 -0.424 -12.653 -24.549 1.00 0.00 C ATOM 196 C ASP A 585 -0.298 -13.361 -23.204 1.00 0.00 C ATOM 197 O ASP A 585 0.615 -14.155 -22.979 1.00 0.00 O ATOM 198 CB ASP A 585 0.554 -11.476 -24.623 1.00 0.00 C ATOM 199 CG ASP A 585 1.572 -11.642 -25.734 1.00 0.00 C ATOM 200 OD1 ASP A 585 1.908 -12.799 -26.063 1.00 0.00 O ATOM 201 OD2 ASP A 585 2.035 -10.615 -26.274 1.00 0.00 O ATOM 0 H ASP A 585 -1.911 -11.187 -24.786 1.00 0.00 H new ATOM 0 HA ASP A 585 -0.175 -13.343 -25.355 1.00 0.00 H new ATOM 0 HB2 ASP A 585 -0.004 -10.553 -24.779 1.00 0.00 H new ATOM 0 HB3 ASP A 585 1.073 -11.377 -23.670 1.00 0.00 H new ATOM 206 N SER A 586 -1.255 -13.071 -22.323 1.00 0.00 N ATOM 207 CA SER A 586 -1.314 -13.667 -21.001 1.00 0.00 C ATOM 208 C SER A 586 -2.237 -14.871 -21.014 1.00 0.00 C ATOM 209 O SER A 586 -3.220 -14.898 -21.749 1.00 0.00 O ATOM 210 CB SER A 586 -1.831 -12.643 -19.997 1.00 0.00 C ATOM 211 OG SER A 586 -1.905 -13.195 -18.695 1.00 0.00 O ATOM 0 H SER A 586 -2.011 -12.413 -22.513 1.00 0.00 H new ATOM 0 HA SER A 586 -0.312 -13.986 -20.713 1.00 0.00 H new ATOM 0 HB2 SER A 586 -1.174 -11.773 -19.989 1.00 0.00 H new ATOM 0 HB3 SER A 586 -2.817 -12.295 -20.304 1.00 0.00 H new ATOM 0 HG SER A 586 -2.451 -12.615 -18.124 1.00 0.00 H new ATOM 217 N ILE A 587 -1.930 -15.859 -20.186 1.00 0.00 N ATOM 218 CA ILE A 587 -2.757 -17.052 -20.101 1.00 0.00 C ATOM 219 C ILE A 587 -4.219 -16.671 -19.853 1.00 0.00 C ATOM 220 O ILE A 587 -5.135 -17.428 -20.171 1.00 0.00 O ATOM 221 CB ILE A 587 -2.252 -17.998 -18.985 1.00 0.00 C ATOM 222 CG1 ILE A 587 -2.299 -19.448 -19.460 1.00 0.00 C ATOM 223 CG2 ILE A 587 -3.052 -17.825 -17.699 1.00 0.00 C ATOM 224 CD1 ILE A 587 -1.031 -19.887 -20.161 1.00 0.00 C ATOM 0 H ILE A 587 -1.119 -15.858 -19.567 1.00 0.00 H new ATOM 0 HA ILE A 587 -2.688 -17.580 -21.052 1.00 0.00 H new ATOM 0 HB ILE A 587 -1.218 -17.734 -18.764 1.00 0.00 H new ATOM 0 HG12 ILE A 587 -2.477 -20.099 -18.604 1.00 0.00 H new ATOM 0 HG13 ILE A 587 -3.144 -19.575 -20.137 1.00 0.00 H new ATOM 0 HG21 ILE A 587 -2.669 -18.505 -16.938 1.00 0.00 H new ATOM 0 HG22 ILE A 587 -2.958 -16.797 -17.348 1.00 0.00 H new ATOM 0 HG23 ILE A 587 -4.102 -18.048 -17.891 1.00 0.00 H new ATOM 0 HD11 ILE A 587 -1.129 -20.927 -20.473 1.00 0.00 H new ATOM 0 HD12 ILE A 587 -0.863 -19.259 -21.036 1.00 0.00 H new ATOM 0 HD13 ILE A 587 -0.186 -19.792 -19.479 1.00 0.00 H new ATOM 236 N ILE A 588 -4.419 -15.483 -19.281 1.00 0.00 N ATOM 237 CA ILE A 588 -5.759 -14.984 -18.984 1.00 0.00 C ATOM 238 C ILE A 588 -6.103 -13.763 -19.838 1.00 0.00 C ATOM 239 O ILE A 588 -5.241 -12.933 -20.122 1.00 0.00 O ATOM 240 CB ILE A 588 -5.890 -14.617 -17.491 1.00 0.00 C ATOM 241 CG1 ILE A 588 -7.329 -14.217 -17.158 1.00 0.00 C ATOM 242 CG2 ILE A 588 -4.925 -13.494 -17.130 1.00 0.00 C ATOM 243 CD1 ILE A 588 -7.575 -14.036 -15.675 1.00 0.00 C ATOM 0 H ILE A 588 -3.667 -14.848 -19.014 1.00 0.00 H new ATOM 0 HA ILE A 588 -6.460 -15.785 -19.221 1.00 0.00 H new ATOM 0 HB ILE A 588 -5.633 -15.495 -16.898 1.00 0.00 H new ATOM 0 HG12 ILE A 588 -7.569 -13.288 -17.675 1.00 0.00 H new ATOM 0 HG13 ILE A 588 -8.008 -14.979 -17.541 1.00 0.00 H new ATOM 0 HG21 ILE A 588 -5.031 -13.248 -16.073 1.00 0.00 H new ATOM 0 HG22 ILE A 588 -3.902 -13.816 -17.327 1.00 0.00 H new ATOM 0 HG23 ILE A 588 -5.150 -12.613 -17.732 1.00 0.00 H new ATOM 0 HD11 ILE A 588 -8.615 -13.753 -15.511 1.00 0.00 H new ATOM 0 HD12 ILE A 588 -7.367 -14.971 -15.155 1.00 0.00 H new ATOM 0 HD13 ILE A 588 -6.921 -13.253 -15.291 1.00 0.00 H new ATOM 255 N GLN A 589 -7.370 -13.654 -20.235 1.00 0.00 N ATOM 256 CA GLN A 589 -7.823 -12.523 -21.044 1.00 0.00 C ATOM 257 C GLN A 589 -9.012 -11.844 -20.391 1.00 0.00 C ATOM 258 O GLN A 589 -10.167 -12.063 -20.758 1.00 0.00 O ATOM 259 CB GLN A 589 -8.178 -12.974 -22.459 1.00 0.00 C ATOM 260 CG GLN A 589 -6.997 -13.545 -23.220 1.00 0.00 C ATOM 261 CD GLN A 589 -6.697 -14.978 -22.843 1.00 0.00 C ATOM 262 OE1 GLN A 589 -7.600 -15.753 -22.526 1.00 0.00 O ATOM 263 NE2 GLN A 589 -5.423 -15.338 -22.878 1.00 0.00 N ATOM 0 H GLN A 589 -8.098 -14.332 -20.011 1.00 0.00 H new ATOM 0 HA GLN A 589 -7.006 -11.805 -21.110 1.00 0.00 H new ATOM 0 HB2 GLN A 589 -8.965 -13.726 -22.407 1.00 0.00 H new ATOM 0 HB3 GLN A 589 -8.583 -12.127 -23.012 1.00 0.00 H new ATOM 0 HG2 GLN A 589 -7.198 -13.490 -24.290 1.00 0.00 H new ATOM 0 HG3 GLN A 589 -6.116 -12.932 -23.029 1.00 0.00 H new ATOM 0 HE21 GLN A 589 -4.709 -14.661 -23.147 1.00 0.00 H new ATOM 0 HE22 GLN A 589 -5.156 -16.292 -22.636 1.00 0.00 H new ATOM 272 N GLU A 590 -8.693 -11.021 -19.414 1.00 0.00 N ATOM 273 CA GLU A 590 -9.683 -10.272 -18.652 1.00 0.00 C ATOM 274 C GLU A 590 -9.339 -8.795 -18.681 1.00 0.00 C ATOM 275 O GLU A 590 -8.297 -8.424 -19.205 1.00 0.00 O ATOM 276 CB GLU A 590 -9.735 -10.770 -17.207 1.00 0.00 C ATOM 277 CG GLU A 590 -10.602 -12.003 -17.018 1.00 0.00 C ATOM 278 CD GLU A 590 -11.941 -11.683 -16.383 1.00 0.00 C ATOM 279 OE1 GLU A 590 -12.684 -10.854 -16.950 1.00 0.00 O ATOM 280 OE2 GLU A 590 -12.246 -12.260 -15.319 1.00 0.00 O ATOM 0 H GLU A 590 -7.732 -10.848 -19.120 1.00 0.00 H new ATOM 0 HA GLU A 590 -10.663 -10.422 -19.104 1.00 0.00 H new ATOM 0 HB2 GLU A 590 -8.722 -10.994 -16.872 1.00 0.00 H new ATOM 0 HB3 GLU A 590 -10.112 -9.970 -16.569 1.00 0.00 H new ATOM 0 HG2 GLU A 590 -10.767 -12.478 -17.985 1.00 0.00 H new ATOM 0 HG3 GLU A 590 -10.072 -12.723 -16.395 1.00 0.00 H new ATOM 287 N SER A 591 -10.199 -7.959 -18.116 1.00 0.00 N ATOM 288 CA SER A 591 -9.931 -6.527 -18.052 1.00 0.00 C ATOM 289 C SER A 591 -10.137 -6.021 -16.629 1.00 0.00 C ATOM 290 O SER A 591 -11.224 -6.139 -16.065 1.00 0.00 O ATOM 291 CB SER A 591 -10.800 -5.744 -19.026 1.00 0.00 C ATOM 292 OG SER A 591 -11.711 -6.591 -19.706 1.00 0.00 O ATOM 0 H SER A 591 -11.084 -8.244 -17.697 1.00 0.00 H new ATOM 0 HA SER A 591 -8.893 -6.369 -18.343 1.00 0.00 H new ATOM 0 HB2 SER A 591 -11.351 -4.974 -18.486 1.00 0.00 H new ATOM 0 HB3 SER A 591 -10.166 -5.233 -19.751 1.00 0.00 H new ATOM 0 HG SER A 591 -12.255 -6.058 -20.322 1.00 0.00 H new ATOM 298 N LEU A 592 -9.081 -5.458 -16.060 1.00 0.00 N ATOM 299 CA LEU A 592 -9.121 -4.929 -14.704 1.00 0.00 C ATOM 300 C LEU A 592 -8.992 -3.414 -14.751 1.00 0.00 C ATOM 301 O LEU A 592 -8.130 -2.892 -15.447 1.00 0.00 O ATOM 302 CB LEU A 592 -7.989 -5.536 -13.859 1.00 0.00 C ATOM 303 CG LEU A 592 -7.270 -6.745 -14.482 1.00 0.00 C ATOM 304 CD1 LEU A 592 -5.766 -6.512 -14.528 1.00 0.00 C ATOM 305 CD2 LEU A 592 -7.595 -8.021 -13.716 1.00 0.00 C ATOM 0 H LEU A 592 -8.177 -5.355 -16.522 1.00 0.00 H new ATOM 0 HA LEU A 592 -10.072 -5.195 -14.242 1.00 0.00 H new ATOM 0 HB2 LEU A 592 -7.251 -4.759 -13.661 1.00 0.00 H new ATOM 0 HB3 LEU A 592 -8.400 -5.837 -12.896 1.00 0.00 H new ATOM 0 HG LEU A 592 -7.628 -6.863 -15.505 1.00 0.00 H new ATOM 0 HD11 LEU A 592 -5.277 -7.379 -14.972 1.00 0.00 H new ATOM 0 HD12 LEU A 592 -5.553 -5.628 -15.129 1.00 0.00 H new ATOM 0 HD13 LEU A 592 -5.390 -6.362 -13.516 1.00 0.00 H new ATOM 0 HD21 LEU A 592 -7.076 -8.863 -14.174 1.00 0.00 H new ATOM 0 HD22 LEU A 592 -7.272 -7.916 -12.680 1.00 0.00 H new ATOM 0 HD23 LEU A 592 -8.670 -8.199 -13.745 1.00 0.00 H new ATOM 317 N GLU A 593 -9.859 -2.704 -14.041 1.00 0.00 N ATOM 318 CA GLU A 593 -9.815 -1.245 -14.062 1.00 0.00 C ATOM 319 C GLU A 593 -9.662 -0.647 -12.667 1.00 0.00 C ATOM 320 O GLU A 593 -10.544 -0.790 -11.820 1.00 0.00 O ATOM 321 CB GLU A 593 -11.076 -0.680 -14.728 1.00 0.00 C ATOM 322 CG GLU A 593 -11.824 -1.682 -15.597 1.00 0.00 C ATOM 323 CD GLU A 593 -12.700 -2.617 -14.787 1.00 0.00 C ATOM 324 OE1 GLU A 593 -12.477 -2.729 -13.563 1.00 0.00 O ATOM 325 OE2 GLU A 593 -13.610 -3.237 -15.376 1.00 0.00 O ATOM 0 H GLU A 593 -10.590 -3.104 -13.453 1.00 0.00 H new ATOM 0 HA GLU A 593 -8.935 -0.965 -14.641 1.00 0.00 H new ATOM 0 HB2 GLU A 593 -11.750 -0.314 -13.953 1.00 0.00 H new ATOM 0 HB3 GLU A 593 -10.797 0.178 -15.340 1.00 0.00 H new ATOM 0 HG2 GLU A 593 -12.441 -1.144 -16.316 1.00 0.00 H new ATOM 0 HG3 GLU A 593 -11.105 -2.268 -16.170 1.00 0.00 H new ATOM 332 N ILE A 594 -8.553 0.060 -12.449 1.00 0.00 N ATOM 333 CA ILE A 594 -8.310 0.716 -11.178 1.00 0.00 C ATOM 334 C ILE A 594 -9.118 2.000 -11.121 1.00 0.00 C ATOM 335 O ILE A 594 -9.165 2.750 -12.097 1.00 0.00 O ATOM 336 CB ILE A 594 -6.819 1.054 -10.986 1.00 0.00 C ATOM 337 CG1 ILE A 594 -5.948 -0.158 -11.321 1.00 0.00 C ATOM 338 CG2 ILE A 594 -6.561 1.527 -9.563 1.00 0.00 C ATOM 339 CD1 ILE A 594 -4.510 0.197 -11.633 1.00 0.00 C ATOM 0 H ILE A 594 -7.813 0.189 -13.139 1.00 0.00 H new ATOM 0 HA ILE A 594 -8.609 0.033 -10.383 1.00 0.00 H new ATOM 0 HB ILE A 594 -6.555 1.862 -11.668 1.00 0.00 H new ATOM 0 HG12 ILE A 594 -5.968 -0.853 -10.481 1.00 0.00 H new ATOM 0 HG13 ILE A 594 -6.379 -0.679 -12.176 1.00 0.00 H new ATOM 0 HG21 ILE A 594 -5.503 1.762 -9.444 1.00 0.00 H new ATOM 0 HG22 ILE A 594 -7.155 2.418 -9.362 1.00 0.00 H new ATOM 0 HG23 ILE A 594 -6.839 0.740 -8.862 1.00 0.00 H new ATOM 0 HD11 ILE A 594 -3.952 -0.711 -11.861 1.00 0.00 H new ATOM 0 HD12 ILE A 594 -4.479 0.867 -12.492 1.00 0.00 H new ATOM 0 HD13 ILE A 594 -4.062 0.691 -10.771 1.00 0.00 H new ATOM 351 N GLN A 595 -9.764 2.258 -9.995 1.00 0.00 N ATOM 352 CA GLN A 595 -10.568 3.459 -9.864 1.00 0.00 C ATOM 353 C GLN A 595 -9.710 4.629 -9.416 1.00 0.00 C ATOM 354 O GLN A 595 -8.861 4.483 -8.537 1.00 0.00 O ATOM 355 CB GLN A 595 -11.706 3.233 -8.862 1.00 0.00 C ATOM 356 CG GLN A 595 -12.876 2.425 -9.409 1.00 0.00 C ATOM 357 CD GLN A 595 -12.453 1.365 -10.406 1.00 0.00 C ATOM 358 OE1 GLN A 595 -12.797 1.574 -11.669 1.00 0.00 O flip ATOM 359 NE2 GLN A 595 -11.824 0.370 -10.044 1.00 0.00 N flip ATOM 0 H GLN A 595 -9.748 1.660 -9.169 1.00 0.00 H new ATOM 0 HA GLN A 595 -10.996 3.691 -10.839 1.00 0.00 H new ATOM 0 HB2 GLN A 595 -11.306 2.723 -7.986 1.00 0.00 H new ATOM 0 HB3 GLN A 595 -12.075 4.202 -8.526 1.00 0.00 H new ATOM 0 HG2 GLN A 595 -13.399 1.948 -8.580 1.00 0.00 H new ATOM 0 HG3 GLN A 595 -13.585 3.101 -9.886 1.00 0.00 H new ATOM 0 HE21 GLN A 595 -11.581 0.250 -9.061 1.00 0.00 H new ATOM 0 HE22 GLN A 595 -11.546 -0.334 -10.727 1.00 0.00 H new ATOM 368 N GLN A 596 -9.944 5.801 -10.005 1.00 0.00 N ATOM 369 CA GLN A 596 -9.196 7.000 -9.635 1.00 0.00 C ATOM 370 C GLN A 596 -9.148 7.122 -8.118 1.00 0.00 C ATOM 371 O GLN A 596 -8.213 7.687 -7.551 1.00 0.00 O ATOM 372 CB GLN A 596 -9.854 8.252 -10.225 1.00 0.00 C ATOM 373 CG GLN A 596 -11.292 8.444 -9.775 1.00 0.00 C ATOM 374 CD GLN A 596 -12.292 8.383 -10.914 1.00 0.00 C ATOM 375 OE1 GLN A 596 -12.032 7.524 -11.891 1.00 0.00 O flip ATOM 376 NE2 GLN A 596 -13.291 9.103 -10.914 1.00 0.00 N flip ATOM 0 H GLN A 596 -10.641 5.945 -10.736 1.00 0.00 H new ATOM 0 HA GLN A 596 -8.185 6.915 -10.033 1.00 0.00 H new ATOM 0 HB2 GLN A 596 -9.272 9.128 -9.941 1.00 0.00 H new ATOM 0 HB3 GLN A 596 -9.826 8.190 -11.313 1.00 0.00 H new ATOM 0 HG2 GLN A 596 -11.541 7.677 -9.041 1.00 0.00 H new ATOM 0 HG3 GLN A 596 -11.382 9.407 -9.273 1.00 0.00 H new ATOM 0 HE21 GLN A 596 -13.453 9.750 -10.142 1.00 0.00 H new ATOM 0 HE22 GLN A 596 -13.956 9.052 -11.685 1.00 0.00 H new ATOM 385 N GLY A 597 -10.182 6.588 -7.473 1.00 0.00 N ATOM 386 CA GLY A 597 -10.269 6.640 -6.031 1.00 0.00 C ATOM 387 C GLY A 597 -9.638 5.445 -5.331 1.00 0.00 C ATOM 388 O GLY A 597 -9.364 5.518 -4.132 1.00 0.00 O ATOM 0 H GLY A 597 -10.963 6.118 -7.930 1.00 0.00 H new ATOM 0 HA2 GLY A 597 -9.785 7.551 -5.680 1.00 0.00 H new ATOM 0 HA3 GLY A 597 -11.318 6.705 -5.742 1.00 0.00 H new ATOM 392 N VAL A 598 -9.405 4.337 -6.047 1.00 0.00 N ATOM 393 CA VAL A 598 -8.812 3.171 -5.408 1.00 0.00 C ATOM 394 C VAL A 598 -7.285 3.237 -5.431 1.00 0.00 C ATOM 395 O VAL A 598 -6.654 3.139 -6.483 1.00 0.00 O ATOM 396 CB VAL A 598 -9.281 1.863 -6.079 1.00 0.00 C ATOM 397 CG1 VAL A 598 -8.540 0.662 -5.511 1.00 0.00 C ATOM 398 CG2 VAL A 598 -10.782 1.690 -5.908 1.00 0.00 C ATOM 0 H VAL A 598 -9.613 4.230 -7.040 1.00 0.00 H new ATOM 0 HA VAL A 598 -9.148 3.175 -4.371 1.00 0.00 H new ATOM 0 HB VAL A 598 -9.054 1.927 -7.143 1.00 0.00 H new ATOM 0 HG11 VAL A 598 -8.890 -0.247 -6.001 1.00 0.00 H new ATOM 0 HG12 VAL A 598 -7.470 0.779 -5.684 1.00 0.00 H new ATOM 0 HG13 VAL A 598 -8.728 0.592 -4.440 1.00 0.00 H new ATOM 0 HG21 VAL A 598 -11.098 0.763 -6.386 1.00 0.00 H new ATOM 0 HG22 VAL A 598 -11.025 1.652 -4.846 1.00 0.00 H new ATOM 0 HG23 VAL A 598 -11.300 2.531 -6.369 1.00 0.00 H new ATOM 408 N ASN A 599 -6.715 3.367 -4.241 1.00 0.00 N ATOM 409 CA ASN A 599 -5.276 3.408 -4.051 1.00 0.00 C ATOM 410 C ASN A 599 -4.909 2.767 -2.707 1.00 0.00 C ATOM 411 O ASN A 599 -5.388 3.212 -1.664 1.00 0.00 O ATOM 412 CB ASN A 599 -4.775 4.855 -4.146 1.00 0.00 C ATOM 413 CG ASN A 599 -4.010 5.336 -2.930 1.00 0.00 C ATOM 414 OD1 ASN A 599 -4.543 5.384 -1.822 1.00 0.00 O ATOM 415 ND2 ASN A 599 -2.760 5.715 -3.135 1.00 0.00 N ATOM 0 H ASN A 599 -7.246 3.448 -3.374 1.00 0.00 H new ATOM 0 HA ASN A 599 -4.786 2.835 -4.839 1.00 0.00 H new ATOM 0 HB2 ASN A 599 -4.134 4.947 -5.023 1.00 0.00 H new ATOM 0 HB3 ASN A 599 -5.630 5.512 -4.305 1.00 0.00 H new ATOM 0 HD21 ASN A 599 -2.199 6.064 -2.358 1.00 0.00 H new ATOM 0 HD22 ASN A 599 -2.357 5.659 -4.070 1.00 0.00 H new ATOM 422 N PRO A 600 -4.054 1.736 -2.685 1.00 0.00 N ATOM 423 CA PRO A 600 -3.444 1.145 -3.863 1.00 0.00 C ATOM 424 C PRO A 600 -4.302 0.007 -4.393 1.00 0.00 C ATOM 425 O PRO A 600 -5.136 -0.535 -3.668 1.00 0.00 O ATOM 426 CB PRO A 600 -2.131 0.610 -3.310 1.00 0.00 C ATOM 427 CG PRO A 600 -2.473 0.165 -1.929 1.00 0.00 C ATOM 428 CD PRO A 600 -3.619 1.035 -1.463 1.00 0.00 C ATOM 0 HA PRO A 600 -3.322 1.841 -4.693 1.00 0.00 H new ATOM 0 HB2 PRO A 600 -1.752 -0.215 -3.912 1.00 0.00 H new ATOM 0 HB3 PRO A 600 -1.359 1.379 -3.301 1.00 0.00 H new ATOM 0 HG2 PRO A 600 -2.758 -0.887 -1.921 1.00 0.00 H new ATOM 0 HG3 PRO A 600 -1.614 0.268 -1.265 1.00 0.00 H new ATOM 0 HD2 PRO A 600 -4.425 0.438 -1.037 1.00 0.00 H new ATOM 0 HD3 PRO A 600 -3.300 1.737 -0.692 1.00 0.00 H new ATOM 436 N PHE A 601 -4.102 -0.360 -5.645 1.00 0.00 N ATOM 437 CA PHE A 601 -4.872 -1.442 -6.233 1.00 0.00 C ATOM 438 C PHE A 601 -4.135 -2.741 -5.979 1.00 0.00 C ATOM 439 O PHE A 601 -2.992 -2.912 -6.396 1.00 0.00 O ATOM 440 CB PHE A 601 -5.053 -1.221 -7.740 1.00 0.00 C ATOM 441 CG PHE A 601 -6.309 -1.827 -8.304 1.00 0.00 C ATOM 442 CD1 PHE A 601 -7.531 -1.203 -8.127 1.00 0.00 C ATOM 443 CD2 PHE A 601 -6.261 -3.006 -9.032 1.00 0.00 C ATOM 444 CE1 PHE A 601 -8.684 -1.743 -8.661 1.00 0.00 C ATOM 445 CE2 PHE A 601 -7.411 -3.548 -9.572 1.00 0.00 C ATOM 446 CZ PHE A 601 -8.624 -2.916 -9.386 1.00 0.00 C ATOM 0 H PHE A 601 -3.420 0.070 -6.270 1.00 0.00 H new ATOM 0 HA PHE A 601 -5.863 -1.477 -5.781 1.00 0.00 H new ATOM 0 HB2 PHE A 601 -5.057 -0.150 -7.941 1.00 0.00 H new ATOM 0 HB3 PHE A 601 -4.194 -1.640 -8.263 1.00 0.00 H new ATOM 0 HD1 PHE A 601 -7.584 -0.283 -7.564 1.00 0.00 H new ATOM 0 HD2 PHE A 601 -5.315 -3.506 -9.178 1.00 0.00 H new ATOM 0 HE1 PHE A 601 -9.632 -1.248 -8.512 1.00 0.00 H new ATOM 0 HE2 PHE A 601 -7.361 -4.466 -10.139 1.00 0.00 H new ATOM 0 HZ PHE A 601 -9.524 -3.339 -9.807 1.00 0.00 H new ATOM 456 N PHE A 602 -4.782 -3.638 -5.248 1.00 0.00 N ATOM 457 CA PHE A 602 -4.166 -4.900 -4.891 1.00 0.00 C ATOM 458 C PHE A 602 -4.454 -5.958 -5.935 1.00 0.00 C ATOM 459 O PHE A 602 -5.556 -6.047 -6.469 1.00 0.00 O ATOM 460 CB PHE A 602 -4.647 -5.351 -3.511 1.00 0.00 C ATOM 461 CG PHE A 602 -4.478 -4.298 -2.453 1.00 0.00 C ATOM 462 CD1 PHE A 602 -3.287 -4.187 -1.754 1.00 0.00 C ATOM 463 CD2 PHE A 602 -5.506 -3.418 -2.163 1.00 0.00 C ATOM 464 CE1 PHE A 602 -3.125 -3.217 -0.784 1.00 0.00 C ATOM 465 CE2 PHE A 602 -5.350 -2.444 -1.195 1.00 0.00 C ATOM 466 CZ PHE A 602 -4.158 -2.344 -0.504 1.00 0.00 C ATOM 0 H PHE A 602 -5.730 -3.512 -4.893 1.00 0.00 H new ATOM 0 HA PHE A 602 -3.086 -4.757 -4.852 1.00 0.00 H new ATOM 0 HB2 PHE A 602 -5.699 -5.629 -3.573 1.00 0.00 H new ATOM 0 HB3 PHE A 602 -4.098 -6.245 -3.216 1.00 0.00 H new ATOM 0 HD1 PHE A 602 -2.476 -4.867 -1.970 1.00 0.00 H new ATOM 0 HD2 PHE A 602 -6.441 -3.493 -2.699 1.00 0.00 H new ATOM 0 HE1 PHE A 602 -2.192 -3.141 -0.245 1.00 0.00 H new ATOM 0 HE2 PHE A 602 -6.159 -1.762 -0.979 1.00 0.00 H new ATOM 0 HZ PHE A 602 -4.034 -1.585 0.254 1.00 0.00 H new ATOM 476 N ILE A 603 -3.420 -6.721 -6.251 1.00 0.00 N ATOM 477 CA ILE A 603 -3.495 -7.752 -7.270 1.00 0.00 C ATOM 478 C ILE A 603 -2.905 -9.069 -6.784 1.00 0.00 C ATOM 479 O ILE A 603 -1.861 -9.102 -6.133 1.00 0.00 O ATOM 480 CB ILE A 603 -2.729 -7.303 -8.527 1.00 0.00 C ATOM 481 CG1 ILE A 603 -2.850 -5.786 -8.715 1.00 0.00 C ATOM 482 CG2 ILE A 603 -3.222 -8.038 -9.749 1.00 0.00 C ATOM 483 CD1 ILE A 603 -2.033 -5.246 -9.864 1.00 0.00 C ATOM 0 H ILE A 603 -2.505 -6.642 -5.807 1.00 0.00 H new ATOM 0 HA ILE A 603 -4.549 -7.906 -7.500 1.00 0.00 H new ATOM 0 HB ILE A 603 -1.676 -7.548 -8.392 1.00 0.00 H new ATOM 0 HG12 ILE A 603 -3.898 -5.532 -8.876 1.00 0.00 H new ATOM 0 HG13 ILE A 603 -2.539 -5.290 -7.796 1.00 0.00 H new ATOM 0 HG21 ILE A 603 -2.665 -7.703 -10.624 1.00 0.00 H new ATOM 0 HG22 ILE A 603 -3.075 -9.109 -9.613 1.00 0.00 H new ATOM 0 HG23 ILE A 603 -4.283 -7.833 -9.894 1.00 0.00 H new ATOM 0 HD11 ILE A 603 -2.171 -4.167 -9.933 1.00 0.00 H new ATOM 0 HD12 ILE A 603 -0.979 -5.467 -9.697 1.00 0.00 H new ATOM 0 HD13 ILE A 603 -2.359 -5.713 -10.793 1.00 0.00 H new ATOM 495 N GLY A 604 -3.593 -10.147 -7.115 1.00 0.00 N ATOM 496 CA GLY A 604 -3.158 -11.472 -6.726 1.00 0.00 C ATOM 497 C GLY A 604 -4.160 -12.540 -7.105 1.00 0.00 C ATOM 498 O GLY A 604 -5.137 -12.266 -7.801 1.00 0.00 O ATOM 0 H GLY A 604 -4.458 -10.128 -7.655 1.00 0.00 H new ATOM 0 HA2 GLY A 604 -2.201 -11.691 -7.199 1.00 0.00 H new ATOM 0 HA3 GLY A 604 -2.994 -11.496 -5.649 1.00 0.00 H new ATOM 502 N ARG A 605 -3.920 -13.764 -6.648 1.00 0.00 N ATOM 503 CA ARG A 605 -4.814 -14.874 -6.948 1.00 0.00 C ATOM 504 C ARG A 605 -6.133 -14.709 -6.210 1.00 0.00 C ATOM 505 O ARG A 605 -7.195 -15.055 -6.726 1.00 0.00 O ATOM 506 CB ARG A 605 -4.163 -16.205 -6.565 1.00 0.00 C ATOM 507 CG ARG A 605 -5.032 -17.416 -6.863 1.00 0.00 C ATOM 508 CD ARG A 605 -5.046 -17.739 -8.347 1.00 0.00 C ATOM 509 NE ARG A 605 -6.013 -18.784 -8.672 1.00 0.00 N ATOM 510 CZ ARG A 605 -7.322 -18.572 -8.792 1.00 0.00 C ATOM 511 NH1 ARG A 605 -7.824 -17.356 -8.617 1.00 0.00 N ATOM 512 NH2 ARG A 605 -8.131 -19.580 -9.090 1.00 0.00 N ATOM 0 H ARG A 605 -3.116 -14.011 -6.070 1.00 0.00 H new ATOM 0 HA ARG A 605 -5.009 -14.875 -8.020 1.00 0.00 H new ATOM 0 HB2 ARG A 605 -3.219 -16.305 -7.100 1.00 0.00 H new ATOM 0 HB3 ARG A 605 -3.926 -16.191 -5.501 1.00 0.00 H new ATOM 0 HG2 ARG A 605 -4.662 -18.277 -6.306 1.00 0.00 H new ATOM 0 HG3 ARG A 605 -6.050 -17.228 -6.521 1.00 0.00 H new ATOM 0 HD2 ARG A 605 -5.283 -16.837 -8.912 1.00 0.00 H new ATOM 0 HD3 ARG A 605 -4.051 -18.057 -8.658 1.00 0.00 H new ATOM 0 HE ARG A 605 -5.665 -19.732 -8.816 1.00 0.00 H new ATOM 0 HH11 ARG A 605 -7.206 -16.577 -8.389 1.00 0.00 H new ATOM 0 HH12 ARG A 605 -8.828 -17.200 -8.710 1.00 0.00 H new ATOM 0 HH21 ARG A 605 -7.750 -20.516 -9.227 1.00 0.00 H new ATOM 0 HH22 ARG A 605 -9.134 -19.419 -9.182 1.00 0.00 H new ATOM 526 N SER A 606 -6.056 -14.170 -5.000 1.00 0.00 N ATOM 527 CA SER A 606 -7.241 -13.948 -4.191 1.00 0.00 C ATOM 528 C SER A 606 -7.962 -12.684 -4.639 1.00 0.00 C ATOM 529 O SER A 606 -7.397 -11.591 -4.589 1.00 0.00 O ATOM 530 CB SER A 606 -6.863 -13.840 -2.720 1.00 0.00 C ATOM 531 OG SER A 606 -7.310 -14.972 -1.992 1.00 0.00 O ATOM 0 H SER A 606 -5.183 -13.879 -4.559 1.00 0.00 H new ATOM 0 HA SER A 606 -7.912 -14.797 -4.321 1.00 0.00 H new ATOM 0 HB2 SER A 606 -5.781 -13.747 -2.626 1.00 0.00 H new ATOM 0 HB3 SER A 606 -7.299 -12.936 -2.295 1.00 0.00 H new ATOM 0 HG SER A 606 -7.053 -14.878 -1.051 1.00 0.00 H new ATOM 537 N GLU A 607 -9.212 -12.831 -5.075 1.00 0.00 N ATOM 538 CA GLU A 607 -9.999 -11.691 -5.526 1.00 0.00 C ATOM 539 C GLU A 607 -9.915 -10.541 -4.530 1.00 0.00 C ATOM 540 O GLU A 607 -10.109 -9.384 -4.902 1.00 0.00 O ATOM 541 CB GLU A 607 -11.456 -12.101 -5.736 1.00 0.00 C ATOM 542 CG GLU A 607 -12.177 -12.467 -4.447 1.00 0.00 C ATOM 543 CD GLU A 607 -13.147 -11.392 -3.995 1.00 0.00 C ATOM 544 OE1 GLU A 607 -12.685 -10.284 -3.649 1.00 0.00 O ATOM 545 OE2 GLU A 607 -14.366 -11.660 -3.986 1.00 0.00 O ATOM 0 H GLU A 607 -9.698 -13.726 -5.124 1.00 0.00 H new ATOM 0 HA GLU A 607 -9.587 -11.350 -6.476 1.00 0.00 H new ATOM 0 HB2 GLU A 607 -11.989 -11.283 -6.221 1.00 0.00 H new ATOM 0 HB3 GLU A 607 -11.491 -12.952 -6.416 1.00 0.00 H new ATOM 0 HG2 GLU A 607 -12.718 -13.402 -4.591 1.00 0.00 H new ATOM 0 HG3 GLU A 607 -11.442 -12.642 -3.661 1.00 0.00 H new ATOM 552 N ASP A 608 -9.596 -10.856 -3.268 1.00 0.00 N ATOM 553 CA ASP A 608 -9.455 -9.825 -2.244 1.00 0.00 C ATOM 554 C ASP A 608 -8.682 -8.648 -2.826 1.00 0.00 C ATOM 555 O ASP A 608 -8.929 -7.490 -2.491 1.00 0.00 O ATOM 556 CB ASP A 608 -8.729 -10.381 -1.016 1.00 0.00 C ATOM 557 CG ASP A 608 -9.679 -10.697 0.122 1.00 0.00 C ATOM 558 OD1 ASP A 608 -10.518 -11.609 -0.041 1.00 0.00 O ATOM 559 OD2 ASP A 608 -9.585 -10.034 1.175 1.00 0.00 O ATOM 0 H ASP A 608 -9.433 -11.807 -2.938 1.00 0.00 H new ATOM 0 HA ASP A 608 -10.444 -9.493 -1.929 1.00 0.00 H new ATOM 0 HB2 ASP A 608 -8.188 -11.285 -1.296 1.00 0.00 H new ATOM 0 HB3 ASP A 608 -7.988 -9.657 -0.677 1.00 0.00 H new ATOM 564 N CYS A 609 -7.767 -8.971 -3.739 1.00 0.00 N ATOM 565 CA CYS A 609 -6.978 -7.977 -4.424 1.00 0.00 C ATOM 566 C CYS A 609 -7.854 -7.234 -5.415 1.00 0.00 C ATOM 567 O CYS A 609 -8.474 -7.850 -6.281 1.00 0.00 O ATOM 568 CB CYS A 609 -5.809 -8.650 -5.126 1.00 0.00 C ATOM 569 SG CYS A 609 -4.298 -8.649 -4.141 1.00 0.00 S ATOM 0 H CYS A 609 -7.560 -9.931 -4.016 1.00 0.00 H new ATOM 0 HA CYS A 609 -6.580 -7.258 -3.708 1.00 0.00 H new ATOM 0 HB2 CYS A 609 -6.079 -9.679 -5.365 1.00 0.00 H new ATOM 0 HB3 CYS A 609 -5.620 -8.142 -6.072 1.00 0.00 H new ATOM 0 HG CYS A 609 -3.995 -9.869 -3.810 1.00 0.00 H new ATOM 575 N ASN A 610 -7.915 -5.909 -5.277 1.00 0.00 N ATOM 576 CA ASN A 610 -8.733 -5.079 -6.165 1.00 0.00 C ATOM 577 C ASN A 610 -8.686 -5.603 -7.598 1.00 0.00 C ATOM 578 O ASN A 610 -9.666 -5.524 -8.340 1.00 0.00 O ATOM 579 CB ASN A 610 -8.264 -3.634 -6.112 1.00 0.00 C ATOM 580 CG ASN A 610 -9.370 -2.678 -5.764 1.00 0.00 C ATOM 581 OD1 ASN A 610 -9.317 -1.992 -4.744 1.00 0.00 O ATOM 582 ND2 ASN A 610 -10.381 -2.628 -6.601 1.00 0.00 N ATOM 0 H ASN A 610 -7.409 -5.388 -4.561 1.00 0.00 H new ATOM 0 HA ASN A 610 -9.767 -5.126 -5.822 1.00 0.00 H new ATOM 0 HB2 ASN A 610 -7.465 -3.542 -5.376 1.00 0.00 H new ATOM 0 HB3 ASN A 610 -7.841 -3.358 -7.078 1.00 0.00 H new ATOM 0 HD21 ASN A 610 -11.165 -2.002 -6.417 1.00 0.00 H new ATOM 0 HD22 ASN A 610 -10.382 -3.215 -7.435 1.00 0.00 H new ATOM 589 N CYS A 611 -7.542 -6.167 -7.957 1.00 0.00 N ATOM 590 CA CYS A 611 -7.336 -6.751 -9.272 1.00 0.00 C ATOM 591 C CYS A 611 -7.553 -8.256 -9.192 1.00 0.00 C ATOM 592 O CYS A 611 -7.230 -8.874 -8.177 1.00 0.00 O ATOM 593 CB CYS A 611 -5.929 -6.450 -9.766 1.00 0.00 C ATOM 594 SG CYS A 611 -5.628 -6.955 -11.473 1.00 0.00 S ATOM 0 H CYS A 611 -6.730 -6.232 -7.343 1.00 0.00 H new ATOM 0 HA CYS A 611 -8.048 -6.319 -9.975 1.00 0.00 H new ATOM 0 HB2 CYS A 611 -5.745 -5.379 -9.676 1.00 0.00 H new ATOM 0 HB3 CYS A 611 -5.212 -6.952 -9.117 1.00 0.00 H new ATOM 0 HG CYS A 611 -4.490 -6.472 -11.874 1.00 0.00 H new ATOM 600 N LYS A 612 -8.116 -8.849 -10.238 1.00 0.00 N ATOM 601 CA LYS A 612 -8.374 -10.291 -10.215 1.00 0.00 C ATOM 602 C LYS A 612 -7.650 -11.037 -11.329 1.00 0.00 C ATOM 603 O LYS A 612 -7.911 -10.827 -12.513 1.00 0.00 O ATOM 604 CB LYS A 612 -9.873 -10.577 -10.286 1.00 0.00 C ATOM 605 CG LYS A 612 -10.293 -11.762 -9.428 1.00 0.00 C ATOM 606 CD LYS A 612 -11.763 -11.695 -9.052 1.00 0.00 C ATOM 607 CE LYS A 612 -12.641 -12.344 -10.109 1.00 0.00 C ATOM 608 NZ LYS A 612 -13.653 -11.396 -10.652 1.00 0.00 N ATOM 0 H LYS A 612 -8.398 -8.372 -11.094 1.00 0.00 H new ATOM 0 HA LYS A 612 -7.980 -10.658 -9.267 1.00 0.00 H new ATOM 0 HB2 LYS A 612 -10.422 -9.691 -9.966 1.00 0.00 H new ATOM 0 HB3 LYS A 612 -10.152 -10.768 -11.322 1.00 0.00 H new ATOM 0 HG2 LYS A 612 -10.098 -12.689 -9.968 1.00 0.00 H new ATOM 0 HG3 LYS A 612 -9.687 -11.787 -8.522 1.00 0.00 H new ATOM 0 HD2 LYS A 612 -11.917 -12.193 -8.095 1.00 0.00 H new ATOM 0 HD3 LYS A 612 -12.059 -10.654 -8.922 1.00 0.00 H new ATOM 0 HE2 LYS A 612 -12.016 -12.713 -10.923 1.00 0.00 H new ATOM 0 HE3 LYS A 612 -13.148 -13.208 -9.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 612 -14.231 -11.878 -11.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 612 -14.266 -11.063 -9.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 612 -13.170 -10.583 -11.086 1.00 0.00 H new ATOM 622 N ILE A 613 -6.746 -11.926 -10.923 1.00 0.00 N ATOM 623 CA ILE A 613 -5.977 -12.739 -11.854 1.00 0.00 C ATOM 624 C ILE A 613 -5.872 -14.162 -11.338 1.00 0.00 C ATOM 625 O ILE A 613 -5.321 -14.394 -10.262 1.00 0.00 O ATOM 626 CB ILE A 613 -4.562 -12.163 -12.058 1.00 0.00 C ATOM 627 CG1 ILE A 613 -4.649 -10.696 -12.488 1.00 0.00 C ATOM 628 CG2 ILE A 613 -3.784 -12.988 -13.077 1.00 0.00 C ATOM 629 CD1 ILE A 613 -5.154 -10.499 -13.903 1.00 0.00 C ATOM 0 H ILE A 613 -6.529 -12.100 -9.942 1.00 0.00 H new ATOM 0 HA ILE A 613 -6.496 -12.733 -12.812 1.00 0.00 H new ATOM 0 HB ILE A 613 -4.024 -12.213 -11.112 1.00 0.00 H new ATOM 0 HG12 ILE A 613 -5.307 -10.165 -11.801 1.00 0.00 H new ATOM 0 HG13 ILE A 613 -3.662 -10.242 -12.399 1.00 0.00 H new ATOM 0 HG21 ILE A 613 -2.788 -12.563 -13.205 1.00 0.00 H new ATOM 0 HG22 ILE A 613 -3.697 -14.015 -12.723 1.00 0.00 H new ATOM 0 HG23 ILE A 613 -4.309 -12.976 -14.032 1.00 0.00 H new ATOM 0 HD11 ILE A 613 -5.187 -9.434 -14.133 1.00 0.00 H new ATOM 0 HD12 ILE A 613 -4.484 -11.000 -14.602 1.00 0.00 H new ATOM 0 HD13 ILE A 613 -6.155 -10.921 -13.994 1.00 0.00 H new ATOM 641 N GLU A 614 -6.391 -15.122 -12.100 1.00 0.00 N ATOM 642 CA GLU A 614 -6.318 -16.495 -11.673 1.00 0.00 C ATOM 643 C GLU A 614 -5.080 -17.140 -12.258 1.00 0.00 C ATOM 644 O GLU A 614 -5.054 -17.592 -13.403 1.00 0.00 O ATOM 645 CB GLU A 614 -7.569 -17.258 -12.111 1.00 0.00 C ATOM 646 CG GLU A 614 -8.865 -16.630 -11.625 1.00 0.00 C ATOM 647 CD GLU A 614 -9.288 -15.439 -12.464 1.00 0.00 C ATOM 648 OE1 GLU A 614 -8.857 -15.354 -13.633 1.00 0.00 O ATOM 649 OE2 GLU A 614 -10.051 -14.593 -11.952 1.00 0.00 O ATOM 0 H GLU A 614 -6.855 -14.969 -12.995 1.00 0.00 H new ATOM 0 HA GLU A 614 -6.261 -16.527 -10.585 1.00 0.00 H new ATOM 0 HB2 GLU A 614 -7.588 -17.314 -13.199 1.00 0.00 H new ATOM 0 HB3 GLU A 614 -7.509 -18.281 -11.740 1.00 0.00 H new ATOM 0 HG2 GLU A 614 -9.656 -17.380 -11.641 1.00 0.00 H new ATOM 0 HG3 GLU A 614 -8.745 -16.315 -10.588 1.00 0.00 H new ATOM 656 N ASP A 615 -4.074 -17.187 -11.422 1.00 0.00 N ATOM 657 CA ASP A 615 -2.796 -17.783 -11.746 1.00 0.00 C ATOM 658 C ASP A 615 -2.356 -18.696 -10.609 1.00 0.00 C ATOM 659 O ASP A 615 -1.989 -18.228 -9.534 1.00 0.00 O ATOM 660 CB ASP A 615 -1.750 -16.699 -12.006 1.00 0.00 C ATOM 661 CG ASP A 615 -1.498 -16.483 -13.484 1.00 0.00 C ATOM 662 OD1 ASP A 615 -2.290 -15.757 -14.121 1.00 0.00 O ATOM 663 OD2 ASP A 615 -0.509 -17.041 -14.005 1.00 0.00 O ATOM 0 H ASP A 615 -4.118 -16.805 -10.477 1.00 0.00 H new ATOM 0 HA ASP A 615 -2.898 -18.376 -12.655 1.00 0.00 H new ATOM 0 HB2 ASP A 615 -2.081 -15.763 -11.556 1.00 0.00 H new ATOM 0 HB3 ASP A 615 -0.816 -16.975 -11.517 1.00 0.00 H new ATOM 668 N ASN A 616 -2.404 -19.990 -10.845 1.00 0.00 N ATOM 669 CA ASN A 616 -2.015 -20.975 -9.832 1.00 0.00 C ATOM 670 C ASN A 616 -0.752 -20.541 -9.077 1.00 0.00 C ATOM 671 O ASN A 616 -0.647 -20.730 -7.865 1.00 0.00 O ATOM 672 CB ASN A 616 -1.787 -22.341 -10.482 1.00 0.00 C ATOM 673 CG ASN A 616 -3.075 -23.122 -10.653 1.00 0.00 C ATOM 674 OD1 ASN A 616 -3.362 -24.043 -9.887 1.00 0.00 O ATOM 675 ND2 ASN A 616 -3.859 -22.759 -11.661 1.00 0.00 N ATOM 0 H ASN A 616 -2.708 -20.395 -11.730 1.00 0.00 H new ATOM 0 HA ASN A 616 -2.830 -21.047 -9.112 1.00 0.00 H new ATOM 0 HB2 ASN A 616 -1.317 -22.203 -11.456 1.00 0.00 H new ATOM 0 HB3 ASN A 616 -1.093 -22.919 -9.872 1.00 0.00 H new ATOM 0 HD21 ASN A 616 -4.738 -23.249 -11.825 1.00 0.00 H new ATOM 0 HD22 ASN A 616 -3.582 -21.990 -12.271 1.00 0.00 H new ATOM 682 N ARG A 617 0.203 -19.965 -9.804 1.00 0.00 N ATOM 683 CA ARG A 617 1.461 -19.509 -9.211 1.00 0.00 C ATOM 684 C ARG A 617 1.293 -18.179 -8.469 1.00 0.00 C ATOM 685 O ARG A 617 2.070 -17.856 -7.571 1.00 0.00 O ATOM 686 CB ARG A 617 2.527 -19.367 -10.298 1.00 0.00 C ATOM 687 CG ARG A 617 2.990 -20.696 -10.873 1.00 0.00 C ATOM 688 CD ARG A 617 3.542 -21.610 -9.790 1.00 0.00 C ATOM 689 NE ARG A 617 2.491 -22.404 -9.156 1.00 0.00 N ATOM 690 CZ ARG A 617 2.689 -23.182 -8.094 1.00 0.00 C ATOM 691 NH1 ARG A 617 3.894 -23.275 -7.546 1.00 0.00 N ATOM 692 NH2 ARG A 617 1.679 -23.870 -7.579 1.00 0.00 N ATOM 0 H ARG A 617 0.130 -19.802 -10.808 1.00 0.00 H new ATOM 0 HA ARG A 617 1.774 -20.257 -8.483 1.00 0.00 H new ATOM 0 HB2 ARG A 617 2.132 -18.750 -11.105 1.00 0.00 H new ATOM 0 HB3 ARG A 617 3.387 -18.840 -9.885 1.00 0.00 H new ATOM 0 HG2 ARG A 617 2.156 -21.187 -11.375 1.00 0.00 H new ATOM 0 HG3 ARG A 617 3.757 -20.520 -11.627 1.00 0.00 H new ATOM 0 HD2 ARG A 617 4.288 -22.276 -10.223 1.00 0.00 H new ATOM 0 HD3 ARG A 617 4.050 -21.011 -9.034 1.00 0.00 H new ATOM 0 HE ARG A 617 1.551 -22.359 -9.550 1.00 0.00 H new ATOM 0 HH11 ARG A 617 4.675 -22.749 -7.938 1.00 0.00 H new ATOM 0 HH12 ARG A 617 4.039 -23.873 -6.732 1.00 0.00 H new ATOM 0 HH21 ARG A 617 0.751 -23.803 -7.997 1.00 0.00 H new ATOM 0 HH22 ARG A 617 1.830 -24.466 -6.765 1.00 0.00 H new ATOM 706 N LEU A 618 0.280 -17.411 -8.857 1.00 0.00 N ATOM 707 CA LEU A 618 0.004 -16.112 -8.243 1.00 0.00 C ATOM 708 C LEU A 618 -0.254 -16.248 -6.741 1.00 0.00 C ATOM 709 O LEU A 618 -0.610 -17.323 -6.256 1.00 0.00 O ATOM 710 CB LEU A 618 -1.220 -15.477 -8.911 1.00 0.00 C ATOM 711 CG LEU A 618 -0.966 -14.161 -9.635 1.00 0.00 C ATOM 712 CD1 LEU A 618 0.145 -14.317 -10.658 1.00 0.00 C ATOM 713 CD2 LEU A 618 -2.238 -13.664 -10.304 1.00 0.00 C ATOM 0 H LEU A 618 -0.370 -17.667 -9.600 1.00 0.00 H new ATOM 0 HA LEU A 618 0.880 -15.479 -8.385 1.00 0.00 H new ATOM 0 HB2 LEU A 618 -1.633 -16.190 -9.625 1.00 0.00 H new ATOM 0 HB3 LEU A 618 -1.982 -15.311 -8.149 1.00 0.00 H new ATOM 0 HG LEU A 618 -0.652 -13.422 -8.898 1.00 0.00 H new ATOM 0 HD11 LEU A 618 0.310 -13.366 -11.164 1.00 0.00 H new ATOM 0 HD12 LEU A 618 1.062 -14.625 -10.155 1.00 0.00 H new ATOM 0 HD13 LEU A 618 -0.138 -15.073 -11.391 1.00 0.00 H new ATOM 0 HD21 LEU A 618 -2.036 -12.723 -10.816 1.00 0.00 H new ATOM 0 HD22 LEU A 618 -2.582 -14.404 -11.027 1.00 0.00 H new ATOM 0 HD23 LEU A 618 -3.009 -13.508 -9.549 1.00 0.00 H new ATOM 725 N SER A 619 -0.083 -15.145 -6.014 1.00 0.00 N ATOM 726 CA SER A 619 -0.308 -15.128 -4.570 1.00 0.00 C ATOM 727 C SER A 619 -1.478 -14.208 -4.221 1.00 0.00 C ATOM 728 O SER A 619 -1.952 -13.451 -5.066 1.00 0.00 O ATOM 729 CB SER A 619 0.954 -14.670 -3.838 1.00 0.00 C ATOM 730 OG SER A 619 0.788 -14.750 -2.433 1.00 0.00 O ATOM 0 H SER A 619 0.211 -14.249 -6.403 1.00 0.00 H new ATOM 0 HA SER A 619 -0.552 -16.141 -4.250 1.00 0.00 H new ATOM 0 HB2 SER A 619 1.799 -15.287 -4.143 1.00 0.00 H new ATOM 0 HB3 SER A 619 1.190 -13.644 -4.121 1.00 0.00 H new ATOM 0 HG SER A 619 1.610 -14.453 -1.989 1.00 0.00 H new ATOM 736 N ARG A 620 -1.944 -14.277 -2.974 1.00 0.00 N ATOM 737 CA ARG A 620 -3.064 -13.446 -2.529 1.00 0.00 C ATOM 738 C ARG A 620 -2.814 -11.973 -2.842 1.00 0.00 C ATOM 739 O ARG A 620 -3.614 -11.332 -3.520 1.00 0.00 O ATOM 740 CB ARG A 620 -3.317 -13.625 -1.030 1.00 0.00 C ATOM 741 CG ARG A 620 -3.215 -15.068 -0.560 1.00 0.00 C ATOM 742 CD ARG A 620 -1.937 -15.310 0.229 1.00 0.00 C ATOM 743 NE ARG A 620 -1.929 -16.623 0.871 1.00 0.00 N ATOM 744 CZ ARG A 620 -2.583 -16.901 1.996 1.00 0.00 C ATOM 745 NH1 ARG A 620 -3.301 -15.964 2.603 1.00 0.00 N ATOM 746 NH2 ARG A 620 -2.519 -18.119 2.516 1.00 0.00 N ATOM 0 H ARG A 620 -1.566 -14.896 -2.257 1.00 0.00 H new ATOM 0 HA ARG A 620 -3.950 -13.771 -3.075 1.00 0.00 H new ATOM 0 HB2 ARG A 620 -2.600 -13.020 -0.475 1.00 0.00 H new ATOM 0 HB3 ARG A 620 -4.309 -13.243 -0.790 1.00 0.00 H new ATOM 0 HG2 ARG A 620 -4.078 -15.311 0.060 1.00 0.00 H new ATOM 0 HG3 ARG A 620 -3.243 -15.735 -1.422 1.00 0.00 H new ATOM 0 HD2 ARG A 620 -1.079 -15.227 -0.438 1.00 0.00 H new ATOM 0 HD3 ARG A 620 -1.827 -14.535 0.988 1.00 0.00 H new ATOM 0 HE ARG A 620 -1.391 -17.370 0.431 1.00 0.00 H new ATOM 0 HH11 ARG A 620 -3.353 -15.025 2.207 1.00 0.00 H new ATOM 0 HH12 ARG A 620 -3.800 -16.183 3.465 1.00 0.00 H new ATOM 0 HH21 ARG A 620 -1.969 -18.843 2.054 1.00 0.00 H new ATOM 0 HH22 ARG A 620 -3.020 -18.332 3.378 1.00 0.00 H new ATOM 760 N VAL A 621 -1.688 -11.451 -2.366 1.00 0.00 N ATOM 761 CA VAL A 621 -1.316 -10.064 -2.614 1.00 0.00 C ATOM 762 C VAL A 621 -0.130 -10.032 -3.560 1.00 0.00 C ATOM 763 O VAL A 621 0.831 -9.283 -3.384 1.00 0.00 O ATOM 764 CB VAL A 621 -0.978 -9.307 -1.320 1.00 0.00 C ATOM 765 CG1 VAL A 621 -0.860 -7.814 -1.599 1.00 0.00 C ATOM 766 CG2 VAL A 621 -2.040 -9.579 -0.262 1.00 0.00 C ATOM 0 H VAL A 621 -1.015 -11.971 -1.804 1.00 0.00 H new ATOM 0 HA VAL A 621 -2.173 -9.561 -3.061 1.00 0.00 H new ATOM 0 HB VAL A 621 -0.019 -9.660 -0.942 1.00 0.00 H new ATOM 0 HG11 VAL A 621 -0.620 -7.289 -0.674 1.00 0.00 H new ATOM 0 HG12 VAL A 621 -0.070 -7.642 -2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 621 -1.806 -7.442 -1.993 1.00 0.00 H new ATOM 0 HG21 VAL A 621 -1.791 -9.038 0.651 1.00 0.00 H new ATOM 0 HG22 VAL A 621 -3.011 -9.246 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 621 -2.078 -10.648 -0.051 1.00 0.00 H new ATOM 776 N HIS A 622 -0.240 -10.880 -4.568 1.00 0.00 N ATOM 777 CA HIS A 622 0.757 -11.052 -5.611 1.00 0.00 C ATOM 778 C HIS A 622 1.434 -9.750 -6.010 1.00 0.00 C ATOM 779 O HIS A 622 2.605 -9.735 -6.377 1.00 0.00 O ATOM 780 CB HIS A 622 0.048 -11.629 -6.816 1.00 0.00 C ATOM 781 CG HIS A 622 0.947 -12.085 -7.898 1.00 0.00 C ATOM 782 ND1 HIS A 622 1.016 -11.695 -9.181 1.00 0.00 N flip ATOM 783 CD2 HIS A 622 1.890 -13.073 -7.736 1.00 0.00 C flip ATOM 784 CE1 HIS A 622 1.998 -12.446 -9.781 1.00 0.00 C flip ATOM 785 NE2 HIS A 622 2.506 -13.275 -8.884 1.00 0.00 N flip ATOM 0 H HIS A 622 -1.051 -11.487 -4.687 1.00 0.00 H new ATOM 0 HA HIS A 622 1.542 -11.708 -5.234 1.00 0.00 H new ATOM 0 HB2 HIS A 622 -0.565 -12.470 -6.492 1.00 0.00 H new ATOM 0 HB3 HIS A 622 -0.630 -10.876 -7.218 1.00 0.00 H new ATOM 0 HD2 HIS A 622 2.093 -13.599 -6.815 1.00 0.00 H new ATOM 0 HE1 HIS A 622 2.304 -12.372 -10.814 1.00 0.00 H new ATOM 0 HE2 HIS A 622 3.248 -13.955 -9.052 1.00 0.00 H new ATOM 794 N CYS A 623 0.684 -8.669 -5.965 1.00 0.00 N ATOM 795 CA CYS A 623 1.212 -7.367 -6.347 1.00 0.00 C ATOM 796 C CYS A 623 0.110 -6.334 -6.336 1.00 0.00 C ATOM 797 O CYS A 623 -1.057 -6.665 -6.498 1.00 0.00 O ATOM 798 CB CYS A 623 1.847 -7.426 -7.739 1.00 0.00 C ATOM 799 SG CYS A 623 0.883 -8.354 -8.954 1.00 0.00 S ATOM 0 H CYS A 623 -0.292 -8.661 -5.669 1.00 0.00 H new ATOM 0 HA CYS A 623 1.978 -7.086 -5.624 1.00 0.00 H new ATOM 0 HB2 CYS A 623 1.989 -6.409 -8.105 1.00 0.00 H new ATOM 0 HB3 CYS A 623 2.836 -7.876 -7.656 1.00 0.00 H new ATOM 0 HG CYS A 623 1.126 -9.624 -8.822 1.00 0.00 H new ATOM 805 N PHE A 624 0.479 -5.085 -6.144 1.00 0.00 N ATOM 806 CA PHE A 624 -0.494 -4.013 -6.116 1.00 0.00 C ATOM 807 C PHE A 624 0.065 -2.756 -6.740 1.00 0.00 C ATOM 808 O PHE A 624 1.257 -2.477 -6.645 1.00 0.00 O ATOM 809 CB PHE A 624 -0.919 -3.712 -4.681 1.00 0.00 C ATOM 810 CG PHE A 624 0.232 -3.407 -3.782 1.00 0.00 C ATOM 811 CD1 PHE A 624 0.908 -4.438 -3.173 1.00 0.00 C ATOM 812 CD2 PHE A 624 0.644 -2.103 -3.554 1.00 0.00 C ATOM 813 CE1 PHE A 624 1.980 -4.195 -2.345 1.00 0.00 C ATOM 814 CE2 PHE A 624 1.717 -1.847 -2.725 1.00 0.00 C ATOM 815 CZ PHE A 624 2.388 -2.894 -2.118 1.00 0.00 C ATOM 0 H PHE A 624 1.445 -4.787 -6.005 1.00 0.00 H new ATOM 0 HA PHE A 624 -1.360 -4.341 -6.691 1.00 0.00 H new ATOM 0 HB2 PHE A 624 -1.606 -2.866 -4.682 1.00 0.00 H new ATOM 0 HB3 PHE A 624 -1.466 -4.567 -4.284 1.00 0.00 H new ATOM 0 HD1 PHE A 624 0.592 -5.456 -3.347 1.00 0.00 H new ATOM 0 HD2 PHE A 624 0.123 -1.284 -4.027 1.00 0.00 H new ATOM 0 HE1 PHE A 624 2.500 -5.017 -1.875 1.00 0.00 H new ATOM 0 HE2 PHE A 624 2.033 -0.829 -2.550 1.00 0.00 H new ATOM 0 HZ PHE A 624 3.228 -2.695 -1.469 1.00 0.00 H new ATOM 825 N ILE A 625 -0.815 -1.980 -7.332 1.00 0.00 N ATOM 826 CA ILE A 625 -0.429 -0.719 -7.926 1.00 0.00 C ATOM 827 C ILE A 625 -0.818 0.376 -6.959 1.00 0.00 C ATOM 828 O ILE A 625 -1.978 0.491 -6.570 1.00 0.00 O ATOM 829 CB ILE A 625 -1.110 -0.491 -9.288 1.00 0.00 C ATOM 830 CG1 ILE A 625 -0.617 -1.516 -10.311 1.00 0.00 C ATOM 831 CG2 ILE A 625 -0.860 0.925 -9.789 1.00 0.00 C ATOM 832 CD1 ILE A 625 -1.276 -1.380 -11.667 1.00 0.00 C ATOM 0 H ILE A 625 -1.807 -2.201 -7.415 1.00 0.00 H new ATOM 0 HA ILE A 625 0.645 -0.720 -8.110 1.00 0.00 H new ATOM 0 HB ILE A 625 -2.184 -0.620 -9.157 1.00 0.00 H new ATOM 0 HG12 ILE A 625 0.462 -1.411 -10.428 1.00 0.00 H new ATOM 0 HG13 ILE A 625 -0.800 -2.519 -9.926 1.00 0.00 H new ATOM 0 HG21 ILE A 625 -1.351 1.062 -10.753 1.00 0.00 H new ATOM 0 HG22 ILE A 625 -1.262 1.641 -9.072 1.00 0.00 H new ATOM 0 HG23 ILE A 625 0.212 1.087 -9.902 1.00 0.00 H new ATOM 0 HD11 ILE A 625 -0.879 -2.138 -12.342 1.00 0.00 H new ATOM 0 HD12 ILE A 625 -2.353 -1.514 -11.563 1.00 0.00 H new ATOM 0 HD13 ILE A 625 -1.071 -0.389 -12.073 1.00 0.00 H new ATOM 844 N PHE A 626 0.154 1.159 -6.548 1.00 0.00 N ATOM 845 CA PHE A 626 -0.090 2.217 -5.599 1.00 0.00 C ATOM 846 C PHE A 626 0.031 3.559 -6.292 1.00 0.00 C ATOM 847 O PHE A 626 0.744 3.696 -7.282 1.00 0.00 O ATOM 848 CB PHE A 626 0.896 2.133 -4.439 1.00 0.00 C ATOM 849 CG PHE A 626 1.161 3.442 -3.753 1.00 0.00 C ATOM 850 CD1 PHE A 626 0.230 3.994 -2.889 1.00 0.00 C ATOM 851 CD2 PHE A 626 2.345 4.120 -3.982 1.00 0.00 C ATOM 852 CE1 PHE A 626 0.478 5.200 -2.264 1.00 0.00 C ATOM 853 CE2 PHE A 626 2.599 5.326 -3.361 1.00 0.00 C ATOM 854 CZ PHE A 626 1.664 5.867 -2.501 1.00 0.00 C ATOM 0 H PHE A 626 1.123 1.081 -6.858 1.00 0.00 H new ATOM 0 HA PHE A 626 -1.098 2.108 -5.200 1.00 0.00 H new ATOM 0 HB2 PHE A 626 0.515 1.423 -3.705 1.00 0.00 H new ATOM 0 HB3 PHE A 626 1.840 1.733 -4.809 1.00 0.00 H new ATOM 0 HD1 PHE A 626 -0.699 3.476 -2.702 1.00 0.00 H new ATOM 0 HD2 PHE A 626 3.079 3.701 -4.654 1.00 0.00 H new ATOM 0 HE1 PHE A 626 -0.254 5.621 -1.591 1.00 0.00 H new ATOM 0 HE2 PHE A 626 3.527 5.846 -3.547 1.00 0.00 H new ATOM 0 HZ PHE A 626 1.860 6.811 -2.014 1.00 0.00 H new ATOM 864 N LYS A 627 -0.672 4.538 -5.773 1.00 0.00 N ATOM 865 CA LYS A 627 -0.647 5.874 -6.350 1.00 0.00 C ATOM 866 C LYS A 627 -0.095 6.883 -5.347 1.00 0.00 C ATOM 867 O LYS A 627 -0.474 6.887 -4.176 1.00 0.00 O ATOM 868 CB LYS A 627 -2.042 6.261 -6.841 1.00 0.00 C ATOM 869 CG LYS A 627 -2.363 7.747 -6.752 1.00 0.00 C ATOM 870 CD LYS A 627 -3.828 8.019 -7.056 1.00 0.00 C ATOM 871 CE LYS A 627 -4.186 7.613 -8.477 1.00 0.00 C ATOM 872 NZ LYS A 627 -5.650 7.709 -8.730 1.00 0.00 N ATOM 0 H LYS A 627 -1.270 4.441 -4.953 1.00 0.00 H new ATOM 0 HA LYS A 627 0.021 5.878 -7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 627 -2.148 5.943 -7.878 1.00 0.00 H new ATOM 0 HB3 LYS A 627 -2.782 5.709 -6.261 1.00 0.00 H new ATOM 0 HG2 LYS A 627 -2.123 8.113 -5.754 1.00 0.00 H new ATOM 0 HG3 LYS A 627 -1.736 8.298 -7.453 1.00 0.00 H new ATOM 0 HD2 LYS A 627 -4.455 7.472 -6.351 1.00 0.00 H new ATOM 0 HD3 LYS A 627 -4.039 9.079 -6.915 1.00 0.00 H new ATOM 0 HE2 LYS A 627 -3.653 8.251 -9.182 1.00 0.00 H new ATOM 0 HE3 LYS A 627 -3.853 6.591 -8.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 627 -5.815 7.929 -9.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 627 -6.103 6.803 -8.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 627 -6.056 8.462 -8.139 1.00 0.00 H new ATOM 886 N LYS A 628 0.814 7.722 -5.822 1.00 0.00 N ATOM 887 CA LYS A 628 1.449 8.730 -4.980 1.00 0.00 C ATOM 888 C LYS A 628 1.457 10.091 -5.661 1.00 0.00 C ATOM 889 O LYS A 628 1.331 10.185 -6.875 1.00 0.00 O ATOM 890 CB LYS A 628 2.868 8.317 -4.625 1.00 0.00 C ATOM 891 CG LYS A 628 3.191 8.491 -3.150 1.00 0.00 C ATOM 892 CD LYS A 628 4.134 9.662 -2.915 1.00 0.00 C ATOM 893 CE LYS A 628 5.550 9.191 -2.629 1.00 0.00 C ATOM 894 NZ LYS A 628 6.343 10.222 -1.905 1.00 0.00 N ATOM 0 H LYS A 628 1.131 7.726 -6.792 1.00 0.00 H new ATOM 0 HA LYS A 628 0.865 8.809 -4.063 1.00 0.00 H new ATOM 0 HB2 LYS A 628 3.016 7.273 -4.902 1.00 0.00 H new ATOM 0 HB3 LYS A 628 3.570 8.906 -5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 628 2.268 8.649 -2.592 1.00 0.00 H new ATOM 0 HG3 LYS A 628 3.643 7.577 -2.766 1.00 0.00 H new ATOM 0 HD2 LYS A 628 4.136 10.310 -3.791 1.00 0.00 H new ATOM 0 HD3 LYS A 628 3.772 10.259 -2.078 1.00 0.00 H new ATOM 0 HE2 LYS A 628 5.516 8.277 -2.036 1.00 0.00 H new ATOM 0 HE3 LYS A 628 6.047 8.944 -3.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 7.303 9.862 -1.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 6.398 11.086 -2.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 5.883 10.440 -0.998 1.00 0.00 H new ATOM 908 N ARG A 629 1.601 11.143 -4.868 1.00 0.00 N ATOM 909 CA ARG A 629 1.620 12.498 -5.401 1.00 0.00 C ATOM 910 C ARG A 629 2.968 12.790 -6.055 1.00 0.00 C ATOM 911 O ARG A 629 3.999 12.834 -5.384 1.00 0.00 O ATOM 912 CB ARG A 629 1.356 13.502 -4.277 1.00 0.00 C ATOM 913 CG ARG A 629 1.152 14.927 -4.764 1.00 0.00 C ATOM 914 CD ARG A 629 -0.322 15.237 -4.955 1.00 0.00 C ATOM 915 NE ARG A 629 -0.622 16.648 -4.718 1.00 0.00 N ATOM 916 CZ ARG A 629 -0.499 17.243 -3.534 1.00 0.00 C ATOM 917 NH1 ARG A 629 -0.085 16.555 -2.477 1.00 0.00 N ATOM 918 NH2 ARG A 629 -0.794 18.530 -3.406 1.00 0.00 N ATOM 0 H ARG A 629 1.706 11.085 -3.855 1.00 0.00 H new ATOM 0 HA ARG A 629 0.838 12.591 -6.155 1.00 0.00 H new ATOM 0 HB2 ARG A 629 0.472 13.188 -3.722 1.00 0.00 H new ATOM 0 HB3 ARG A 629 2.194 13.482 -3.580 1.00 0.00 H new ATOM 0 HG2 ARG A 629 1.583 15.625 -4.046 1.00 0.00 H new ATOM 0 HG3 ARG A 629 1.682 15.071 -5.706 1.00 0.00 H new ATOM 0 HD2 ARG A 629 -0.620 14.969 -5.969 1.00 0.00 H new ATOM 0 HD3 ARG A 629 -0.912 14.622 -4.276 1.00 0.00 H new ATOM 0 HE ARG A 629 -0.944 17.209 -5.506 1.00 0.00 H new ATOM 0 HH11 ARG A 629 0.141 15.565 -2.570 1.00 0.00 H new ATOM 0 HH12 ARG A 629 0.007 17.017 -1.572 1.00 0.00 H new ATOM 0 HH21 ARG A 629 -1.115 19.063 -4.215 1.00 0.00 H new ATOM 0 HH22 ARG A 629 -0.700 18.987 -2.499 1.00 0.00 H new ATOM 932 N HIS A 630 2.951 12.979 -7.375 1.00 0.00 N ATOM 933 CA HIS A 630 4.171 13.253 -8.121 1.00 0.00 C ATOM 934 C HIS A 630 4.825 14.543 -7.653 1.00 0.00 C ATOM 935 O HIS A 630 4.213 15.612 -7.674 1.00 0.00 O ATOM 936 CB HIS A 630 3.873 13.332 -9.609 1.00 0.00 C ATOM 937 CG HIS A 630 5.098 13.464 -10.458 1.00 0.00 C ATOM 938 ND1 HIS A 630 5.430 12.563 -11.448 1.00 0.00 N ATOM 939 CD2 HIS A 630 6.076 14.401 -10.461 1.00 0.00 C ATOM 940 CE1 HIS A 630 6.560 12.939 -12.021 1.00 0.00 C ATOM 941 NE2 HIS A 630 6.971 14.051 -11.441 1.00 0.00 N ATOM 0 H HIS A 630 2.106 12.947 -7.945 1.00 0.00 H new ATOM 0 HA HIS A 630 4.866 12.433 -7.938 1.00 0.00 H new ATOM 0 HB2 HIS A 630 3.327 12.438 -9.910 1.00 0.00 H new ATOM 0 HB3 HIS A 630 3.218 14.183 -9.795 1.00 0.00 H new ATOM 0 HD1 HIS A 630 4.888 11.736 -11.699 1.00 0.00 H new ATOM 0 HD2 HIS A 630 6.140 15.263 -9.813 1.00 0.00 H new ATOM 0 HE1 HIS A 630 7.062 12.424 -12.827 1.00 0.00 H new ATOM 950 N ALA A 631 6.077 14.433 -7.228 1.00 0.00 N ATOM 951 CA ALA A 631 6.829 15.586 -6.751 1.00 0.00 C ATOM 952 C ALA A 631 8.118 15.772 -7.544 1.00 0.00 C ATOM 953 O ALA A 631 8.940 14.861 -7.637 1.00 0.00 O ATOM 954 CB ALA A 631 7.138 15.436 -5.270 1.00 0.00 C ATOM 0 H ALA A 631 6.594 13.554 -7.204 1.00 0.00 H new ATOM 0 HA ALA A 631 6.214 16.474 -6.897 1.00 0.00 H new ATOM 0 HB1 ALA A 631 7.700 16.304 -4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 631 6.206 15.362 -4.710 1.00 0.00 H new ATOM 0 HB3 ALA A 631 7.730 14.534 -5.111 1.00 0.00 H new ATOM 1128 N LEU A 644 0.885 16.696 -8.500 1.00 0.00 N ATOM 1129 CA LEU A 644 0.018 15.758 -9.192 1.00 0.00 C ATOM 1130 C LEU A 644 0.169 14.362 -8.595 1.00 0.00 C ATOM 1131 O LEU A 644 0.785 14.206 -7.545 1.00 0.00 O ATOM 1132 CB LEU A 644 0.356 15.748 -10.680 1.00 0.00 C ATOM 1133 CG LEU A 644 0.104 17.066 -11.436 1.00 0.00 C ATOM 1134 CD1 LEU A 644 -1.293 17.078 -12.037 1.00 0.00 C ATOM 1135 CD2 LEU A 644 0.299 18.280 -10.535 1.00 0.00 C ATOM 0 HA LEU A 644 -1.019 16.070 -9.070 1.00 0.00 H new ATOM 0 HB2 LEU A 644 1.407 15.483 -10.792 1.00 0.00 H new ATOM 0 HB3 LEU A 644 -0.225 14.960 -11.159 1.00 0.00 H new ATOM 0 HG LEU A 644 0.838 17.126 -12.240 1.00 0.00 H new ATOM 0 HD11 LEU A 644 -1.453 18.017 -12.567 1.00 0.00 H new ATOM 0 HD12 LEU A 644 -1.397 16.246 -12.733 1.00 0.00 H new ATOM 0 HD13 LEU A 644 -2.032 16.980 -11.242 1.00 0.00 H new ATOM 0 HD21 LEU A 644 0.112 19.190 -11.105 1.00 0.00 H new ATOM 0 HD22 LEU A 644 -0.397 18.227 -9.698 1.00 0.00 H new ATOM 0 HD23 LEU A 644 1.321 18.292 -10.157 1.00 0.00 H new ATOM 1147 N ASP A 645 -0.402 13.351 -9.248 1.00 0.00 N ATOM 1148 CA ASP A 645 -0.317 11.982 -8.731 1.00 0.00 C ATOM 1149 C ASP A 645 0.275 10.999 -9.745 1.00 0.00 C ATOM 1150 O ASP A 645 -0.141 10.953 -10.902 1.00 0.00 O ATOM 1151 CB ASP A 645 -1.699 11.493 -8.288 1.00 0.00 C ATOM 1152 CG ASP A 645 -2.501 12.569 -7.581 1.00 0.00 C ATOM 1153 OD1 ASP A 645 -1.920 13.289 -6.742 1.00 0.00 O ATOM 1154 OD2 ASP A 645 -3.711 12.692 -7.868 1.00 0.00 O ATOM 0 H ASP A 645 -0.920 13.448 -10.121 1.00 0.00 H new ATOM 0 HA ASP A 645 0.359 12.014 -7.876 1.00 0.00 H new ATOM 0 HB2 ASP A 645 -2.254 11.146 -9.160 1.00 0.00 H new ATOM 0 HB3 ASP A 645 -1.581 10.637 -7.623 1.00 0.00 H new ATOM 1159 N ASP A 646 1.230 10.193 -9.282 1.00 0.00 N ATOM 1160 CA ASP A 646 1.866 9.178 -10.118 1.00 0.00 C ATOM 1161 C ASP A 646 1.470 7.780 -9.640 1.00 0.00 C ATOM 1162 O ASP A 646 1.368 7.537 -8.438 1.00 0.00 O ATOM 1163 CB ASP A 646 3.388 9.332 -10.078 1.00 0.00 C ATOM 1164 CG ASP A 646 4.026 9.115 -11.435 1.00 0.00 C ATOM 1165 OD1 ASP A 646 3.445 8.369 -12.250 1.00 0.00 O ATOM 1166 OD2 ASP A 646 5.105 9.692 -11.684 1.00 0.00 O ATOM 0 H ASP A 646 1.582 10.225 -8.325 1.00 0.00 H new ATOM 0 HA ASP A 646 1.527 9.312 -11.145 1.00 0.00 H new ATOM 0 HB2 ASP A 646 3.640 10.329 -9.716 1.00 0.00 H new ATOM 0 HB3 ASP A 646 3.804 8.619 -9.366 1.00 0.00 H new ATOM 1171 N ILE A 647 1.240 6.865 -10.580 1.00 0.00 N ATOM 1172 CA ILE A 647 0.845 5.501 -10.231 1.00 0.00 C ATOM 1173 C ILE A 647 2.024 4.537 -10.286 1.00 0.00 C ATOM 1174 O ILE A 647 2.621 4.311 -11.338 1.00 0.00 O ATOM 1175 CB ILE A 647 -0.284 4.985 -11.144 1.00 0.00 C ATOM 1176 CG1 ILE A 647 0.063 5.203 -12.621 1.00 0.00 C ATOM 1177 CG2 ILE A 647 -1.590 5.682 -10.790 1.00 0.00 C ATOM 1178 CD1 ILE A 647 -0.559 4.176 -13.548 1.00 0.00 C ATOM 0 H ILE A 647 1.319 7.041 -11.582 1.00 0.00 H new ATOM 0 HA ILE A 647 0.477 5.542 -9.206 1.00 0.00 H new ATOM 0 HB ILE A 647 -0.400 3.913 -10.985 1.00 0.00 H new ATOM 0 HG12 ILE A 647 -0.267 6.198 -12.920 1.00 0.00 H new ATOM 0 HG13 ILE A 647 1.146 5.178 -12.739 1.00 0.00 H new ATOM 0 HG21 ILE A 647 -2.386 5.314 -11.438 1.00 0.00 H new ATOM 0 HG22 ILE A 647 -1.843 5.474 -9.750 1.00 0.00 H new ATOM 0 HG23 ILE A 647 -1.478 6.757 -10.928 1.00 0.00 H new ATOM 0 HD11 ILE A 647 -0.271 4.392 -14.577 1.00 0.00 H new ATOM 0 HD12 ILE A 647 -0.209 3.180 -13.275 1.00 0.00 H new ATOM 0 HD13 ILE A 647 -1.645 4.216 -13.459 1.00 0.00 H new ATOM 1190 N TRP A 648 2.349 3.982 -9.126 1.00 0.00 N ATOM 1191 CA TRP A 648 3.452 3.044 -8.985 1.00 0.00 C ATOM 1192 C TRP A 648 2.960 1.605 -8.865 1.00 0.00 C ATOM 1193 O TRP A 648 2.073 1.305 -8.071 1.00 0.00 O ATOM 1194 CB TRP A 648 4.270 3.400 -7.742 1.00 0.00 C ATOM 1195 CG TRP A 648 4.892 4.754 -7.820 1.00 0.00 C ATOM 1196 CD1 TRP A 648 4.403 5.925 -7.308 1.00 0.00 C ATOM 1197 CD2 TRP A 648 6.123 5.078 -8.464 1.00 0.00 C ATOM 1198 NE1 TRP A 648 5.255 6.959 -7.612 1.00 0.00 N ATOM 1199 CE2 TRP A 648 6.319 6.463 -8.320 1.00 0.00 C ATOM 1200 CE3 TRP A 648 7.077 4.326 -9.153 1.00 0.00 C ATOM 1201 CZ2 TRP A 648 7.432 7.111 -8.843 1.00 0.00 C ATOM 1202 CZ3 TRP A 648 8.181 4.972 -9.672 1.00 0.00 C ATOM 1203 CH2 TRP A 648 8.349 6.352 -9.515 1.00 0.00 C ATOM 0 H TRP A 648 1.853 4.171 -8.255 1.00 0.00 H new ATOM 0 HA TRP A 648 4.068 3.118 -9.881 1.00 0.00 H new ATOM 0 HB2 TRP A 648 3.626 3.353 -6.864 1.00 0.00 H new ATOM 0 HB3 TRP A 648 5.053 2.654 -7.603 1.00 0.00 H new ATOM 0 HD1 TRP A 648 3.484 6.022 -6.748 1.00 0.00 H new ATOM 0 HE1 TRP A 648 5.118 7.936 -7.353 1.00 0.00 H new ATOM 0 HE3 TRP A 648 6.953 3.260 -9.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 648 7.567 8.176 -8.723 1.00 0.00 H new ATOM 0 HZ3 TRP A 648 8.927 4.403 -10.208 1.00 0.00 H new ATOM 0 HH2 TRP A 648 9.223 6.828 -9.934 1.00 0.00 H new ATOM 1214 N TYR A 649 3.575 0.714 -9.632 1.00 0.00 N ATOM 1215 CA TYR A 649 3.242 -0.701 -9.589 1.00 0.00 C ATOM 1216 C TYR A 649 4.119 -1.372 -8.541 1.00 0.00 C ATOM 1217 O TYR A 649 5.343 -1.370 -8.658 1.00 0.00 O ATOM 1218 CB TYR A 649 3.459 -1.344 -10.955 1.00 0.00 C ATOM 1219 CG TYR A 649 3.407 -2.857 -10.941 1.00 0.00 C ATOM 1220 CD1 TYR A 649 2.391 -3.531 -10.275 1.00 0.00 C ATOM 1221 CD2 TYR A 649 4.376 -3.609 -11.594 1.00 0.00 C ATOM 1222 CE1 TYR A 649 2.342 -4.912 -10.261 1.00 0.00 C ATOM 1223 CE2 TYR A 649 4.333 -4.990 -11.584 1.00 0.00 C ATOM 1224 CZ TYR A 649 3.314 -5.637 -10.917 1.00 0.00 C ATOM 1225 OH TYR A 649 3.269 -7.012 -10.905 1.00 0.00 O ATOM 0 H TYR A 649 4.313 0.950 -10.296 1.00 0.00 H new ATOM 0 HA TYR A 649 2.191 -0.824 -9.326 1.00 0.00 H new ATOM 0 HB2 TYR A 649 2.701 -0.971 -11.645 1.00 0.00 H new ATOM 0 HB3 TYR A 649 4.427 -1.028 -11.344 1.00 0.00 H new ATOM 0 HD1 TYR A 649 1.627 -2.967 -9.760 1.00 0.00 H new ATOM 0 HD2 TYR A 649 5.175 -3.106 -12.118 1.00 0.00 H new ATOM 0 HE1 TYR A 649 1.546 -5.421 -9.738 1.00 0.00 H new ATOM 0 HE2 TYR A 649 5.094 -5.560 -12.096 1.00 0.00 H new ATOM 0 HH TYR A 649 2.538 -7.310 -10.325 1.00 0.00 H new ATOM 1235 N CYS A 650 3.500 -1.915 -7.503 1.00 0.00 N ATOM 1236 CA CYS A 650 4.259 -2.547 -6.426 1.00 0.00 C ATOM 1237 C CYS A 650 4.092 -4.060 -6.413 1.00 0.00 C ATOM 1238 O CYS A 650 3.047 -4.575 -6.013 1.00 0.00 O ATOM 1239 CB CYS A 650 3.834 -1.967 -5.076 1.00 0.00 C ATOM 1240 SG CYS A 650 5.210 -1.628 -3.953 1.00 0.00 S ATOM 0 H CYS A 650 2.488 -1.933 -7.381 1.00 0.00 H new ATOM 0 HA CYS A 650 5.313 -2.335 -6.605 1.00 0.00 H new ATOM 0 HB2 CYS A 650 3.282 -1.043 -5.247 1.00 0.00 H new ATOM 0 HB3 CYS A 650 3.148 -2.663 -4.593 1.00 0.00 H new ATOM 0 HG CYS A 650 6.307 -2.115 -4.452 1.00 0.00 H new ATOM 1246 N HIS A 651 5.133 -4.772 -6.836 1.00 0.00 N ATOM 1247 CA HIS A 651 5.091 -6.230 -6.850 1.00 0.00 C ATOM 1248 C HIS A 651 5.320 -6.803 -5.451 1.00 0.00 C ATOM 1249 O HIS A 651 6.262 -6.416 -4.753 1.00 0.00 O ATOM 1250 CB HIS A 651 6.130 -6.798 -7.814 1.00 0.00 C ATOM 1251 CG HIS A 651 6.025 -8.282 -7.977 1.00 0.00 C ATOM 1252 ND1 HIS A 651 5.280 -8.877 -8.974 1.00 0.00 N ATOM 1253 CD2 HIS A 651 6.571 -9.295 -7.263 1.00 0.00 C ATOM 1254 CE1 HIS A 651 5.375 -10.191 -8.869 1.00 0.00 C ATOM 1255 NE2 HIS A 651 6.153 -10.469 -7.840 1.00 0.00 N ATOM 0 H HIS A 651 6.008 -4.368 -7.170 1.00 0.00 H new ATOM 0 HA HIS A 651 4.097 -6.522 -7.189 1.00 0.00 H new ATOM 0 HB2 HIS A 651 6.013 -6.322 -8.787 1.00 0.00 H new ATOM 0 HB3 HIS A 651 7.128 -6.547 -7.454 1.00 0.00 H new ATOM 0 HD2 HIS A 651 7.215 -9.198 -6.401 1.00 0.00 H new ATOM 0 HE1 HIS A 651 4.898 -10.913 -9.515 1.00 0.00 H new ATOM 0 HE2 HIS A 651 6.404 -11.406 -7.524 1.00 0.00 H new ATOM 1264 N THR A 652 4.447 -7.730 -5.059 1.00 0.00 N ATOM 1265 CA THR A 652 4.522 -8.381 -3.750 1.00 0.00 C ATOM 1266 C THR A 652 4.475 -9.898 -3.877 1.00 0.00 C ATOM 1267 O THR A 652 4.378 -10.611 -2.882 1.00 0.00 O ATOM 1268 CB THR A 652 3.365 -7.945 -2.848 1.00 0.00 C ATOM 1269 OG1 THR A 652 2.382 -7.234 -3.607 1.00 0.00 O ATOM 1270 CG2 THR A 652 3.860 -7.068 -1.714 1.00 0.00 C ATOM 0 H THR A 652 3.670 -8.051 -5.637 1.00 0.00 H new ATOM 0 HA THR A 652 5.472 -8.079 -3.310 1.00 0.00 H new ATOM 0 HB THR A 652 2.915 -8.843 -2.425 1.00 0.00 H new ATOM 0 HG1 THR A 652 1.579 -7.787 -3.702 1.00 0.00 H new ATOM 0 HG21 THR A 652 3.018 -6.772 -1.088 1.00 0.00 H new ATOM 0 HG22 THR A 652 4.581 -7.622 -1.113 1.00 0.00 H new ATOM 0 HG23 THR A 652 4.337 -6.178 -2.124 1.00 0.00 H new ATOM 1278 N GLY A 653 4.525 -10.375 -5.105 1.00 0.00 N ATOM 1279 CA GLY A 653 4.476 -11.801 -5.361 1.00 0.00 C ATOM 1280 C GLY A 653 5.852 -12.438 -5.361 1.00 0.00 C ATOM 1281 O GLY A 653 6.815 -11.859 -5.862 1.00 0.00 O ATOM 0 H GLY A 653 4.600 -9.796 -5.941 1.00 0.00 H new ATOM 0 HA2 GLY A 653 3.856 -12.282 -4.604 1.00 0.00 H new ATOM 0 HA3 GLY A 653 3.997 -11.978 -6.324 1.00 0.00 H new ATOM 1285 N THR A 654 5.943 -13.633 -4.796 1.00 0.00 N ATOM 1286 CA THR A 654 7.210 -14.351 -4.729 1.00 0.00 C ATOM 1287 C THR A 654 7.667 -14.799 -6.115 1.00 0.00 C ATOM 1288 O THR A 654 8.857 -15.012 -6.348 1.00 0.00 O ATOM 1289 CB THR A 654 7.094 -15.589 -3.826 1.00 0.00 C ATOM 1290 OG1 THR A 654 6.520 -15.226 -2.565 1.00 0.00 O ATOM 1291 CG2 THR A 654 8.456 -16.230 -3.604 1.00 0.00 C ATOM 0 H THR A 654 5.155 -14.127 -4.377 1.00 0.00 H new ATOM 0 HA THR A 654 7.944 -13.661 -4.312 1.00 0.00 H new ATOM 0 HB THR A 654 6.448 -16.312 -4.323 1.00 0.00 H new ATOM 0 HG1 THR A 654 6.497 -14.250 -2.485 1.00 0.00 H new ATOM 0 HG21 THR A 654 8.347 -17.104 -2.962 1.00 0.00 H new ATOM 0 HG22 THR A 654 8.875 -16.535 -4.563 1.00 0.00 H new ATOM 0 HG23 THR A 654 9.123 -15.511 -3.128 1.00 0.00 H new ATOM 1299 N ASN A 655 6.709 -14.955 -7.024 1.00 0.00 N ATOM 1300 CA ASN A 655 7.001 -15.397 -8.387 1.00 0.00 C ATOM 1301 C ASN A 655 7.574 -14.280 -9.259 1.00 0.00 C ATOM 1302 O ASN A 655 7.799 -14.478 -10.451 1.00 0.00 O ATOM 1303 CB ASN A 655 5.747 -15.989 -9.037 1.00 0.00 C ATOM 1304 CG ASN A 655 5.889 -17.471 -9.320 1.00 0.00 C ATOM 1305 OD1 ASN A 655 5.170 -18.293 -8.561 1.00 0.00 O flip ATOM 1306 ND2 ASN A 655 6.635 -17.876 -10.212 1.00 0.00 N flip ATOM 0 H ASN A 655 5.720 -14.782 -6.842 1.00 0.00 H new ATOM 0 HA ASN A 655 7.768 -16.168 -8.312 1.00 0.00 H new ATOM 0 HB2 ASN A 655 4.891 -15.827 -8.382 1.00 0.00 H new ATOM 0 HB3 ASN A 655 5.540 -15.462 -9.968 1.00 0.00 H new ATOM 0 HD21 ASN A 655 7.169 -17.211 -10.771 1.00 0.00 H new ATOM 0 HD22 ASN A 655 6.719 -18.877 -10.392 1.00 0.00 H new ATOM 1313 N VAL A 656 7.806 -13.124 -8.652 1.00 0.00 N ATOM 1314 CA VAL A 656 8.359 -11.950 -9.343 1.00 0.00 C ATOM 1315 C VAL A 656 7.629 -11.650 -10.654 1.00 0.00 C ATOM 1316 O VAL A 656 7.194 -12.550 -11.369 1.00 0.00 O ATOM 1317 CB VAL A 656 9.886 -12.082 -9.608 1.00 0.00 C ATOM 1318 CG1 VAL A 656 10.262 -13.484 -10.064 1.00 0.00 C ATOM 1319 CG2 VAL A 656 10.358 -11.050 -10.626 1.00 0.00 C ATOM 0 H VAL A 656 7.618 -12.966 -7.662 1.00 0.00 H new ATOM 0 HA VAL A 656 8.202 -11.112 -8.664 1.00 0.00 H new ATOM 0 HB VAL A 656 10.391 -11.892 -8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 656 11.337 -13.534 -10.238 1.00 0.00 H new ATOM 0 HG12 VAL A 656 9.986 -14.204 -9.293 1.00 0.00 H new ATOM 0 HG13 VAL A 656 9.733 -13.720 -10.987 1.00 0.00 H new ATOM 0 HG21 VAL A 656 11.429 -11.166 -10.792 1.00 0.00 H new ATOM 0 HG22 VAL A 656 9.827 -11.198 -11.567 1.00 0.00 H new ATOM 0 HG23 VAL A 656 10.155 -10.048 -10.249 1.00 0.00 H new ATOM 1329 N SER A 657 7.510 -10.363 -10.959 1.00 0.00 N ATOM 1330 CA SER A 657 6.848 -9.916 -12.179 1.00 0.00 C ATOM 1331 C SER A 657 7.842 -9.209 -13.094 1.00 0.00 C ATOM 1332 O SER A 657 8.940 -8.851 -12.668 1.00 0.00 O ATOM 1333 CB SER A 657 5.686 -8.979 -11.846 1.00 0.00 C ATOM 1334 OG SER A 657 6.137 -7.832 -11.150 1.00 0.00 O ATOM 0 H SER A 657 7.866 -9.607 -10.374 1.00 0.00 H new ATOM 0 HA SER A 657 6.454 -10.791 -12.696 1.00 0.00 H new ATOM 0 HB2 SER A 657 5.185 -8.676 -12.765 1.00 0.00 H new ATOM 0 HB3 SER A 657 4.950 -9.509 -11.241 1.00 0.00 H new ATOM 0 HG SER A 657 5.652 -7.752 -10.302 1.00 0.00 H new ATOM 1340 N TYR A 658 7.458 -9.009 -14.351 1.00 0.00 N ATOM 1341 CA TYR A 658 8.335 -8.344 -15.311 1.00 0.00 C ATOM 1342 C TYR A 658 7.598 -7.231 -16.045 1.00 0.00 C ATOM 1343 O TYR A 658 6.593 -7.472 -16.710 1.00 0.00 O ATOM 1344 CB TYR A 658 8.888 -9.355 -16.315 1.00 0.00 C ATOM 1345 CG TYR A 658 9.547 -10.551 -15.667 1.00 0.00 C ATOM 1346 CD1 TYR A 658 8.792 -11.506 -14.997 1.00 0.00 C ATOM 1347 CD2 TYR A 658 10.923 -10.727 -15.727 1.00 0.00 C ATOM 1348 CE1 TYR A 658 9.390 -12.602 -14.404 1.00 0.00 C ATOM 1349 CE2 TYR A 658 11.529 -11.820 -15.137 1.00 0.00 C ATOM 1350 CZ TYR A 658 10.759 -12.754 -14.477 1.00 0.00 C ATOM 1351 OH TYR A 658 11.358 -13.844 -13.889 1.00 0.00 O ATOM 0 H TYR A 658 6.554 -9.295 -14.727 1.00 0.00 H new ATOM 0 HA TYR A 658 9.164 -7.901 -14.759 1.00 0.00 H new ATOM 0 HB2 TYR A 658 8.076 -9.700 -16.955 1.00 0.00 H new ATOM 0 HB3 TYR A 658 9.612 -8.856 -16.959 1.00 0.00 H new ATOM 0 HD1 TYR A 658 7.720 -11.390 -14.939 1.00 0.00 H new ATOM 0 HD2 TYR A 658 11.530 -9.998 -16.243 1.00 0.00 H new ATOM 0 HE1 TYR A 658 8.789 -13.335 -13.887 1.00 0.00 H new ATOM 0 HE2 TYR A 658 12.601 -11.942 -15.193 1.00 0.00 H new ATOM 0 HH TYR A 658 12.327 -13.802 -14.033 1.00 0.00 H new ATOM 1361 N LEU A 659 8.108 -6.010 -15.922 1.00 0.00 N ATOM 1362 CA LEU A 659 7.496 -4.860 -16.576 1.00 0.00 C ATOM 1363 C LEU A 659 8.362 -4.358 -17.726 1.00 0.00 C ATOM 1364 O LEU A 659 9.453 -3.832 -17.509 1.00 0.00 O ATOM 1365 CB LEU A 659 7.267 -3.735 -15.565 1.00 0.00 C ATOM 1366 CG LEU A 659 5.872 -3.107 -15.605 1.00 0.00 C ATOM 1367 CD1 LEU A 659 5.816 -1.871 -14.725 1.00 0.00 C ATOM 1368 CD2 LEU A 659 5.482 -2.759 -17.034 1.00 0.00 C ATOM 0 H LEU A 659 8.942 -5.792 -15.377 1.00 0.00 H new ATOM 0 HA LEU A 659 6.536 -5.176 -16.983 1.00 0.00 H new ATOM 0 HB2 LEU A 659 7.445 -4.125 -14.563 1.00 0.00 H new ATOM 0 HB3 LEU A 659 8.007 -2.953 -15.739 1.00 0.00 H new ATOM 0 HG LEU A 659 5.159 -3.836 -15.221 1.00 0.00 H new ATOM 0 HD11 LEU A 659 4.816 -1.439 -14.767 1.00 0.00 H new ATOM 0 HD12 LEU A 659 6.050 -2.146 -13.696 1.00 0.00 H new ATOM 0 HD13 LEU A 659 6.542 -1.139 -15.079 1.00 0.00 H new ATOM 0 HD21 LEU A 659 4.487 -2.314 -17.041 1.00 0.00 H new ATOM 0 HD22 LEU A 659 6.200 -2.049 -17.445 1.00 0.00 H new ATOM 0 HD23 LEU A 659 5.479 -3.664 -17.641 1.00 0.00 H new ATOM 1380 N ASN A 660 7.866 -4.520 -18.949 1.00 0.00 N ATOM 1381 CA ASN A 660 8.594 -4.082 -20.133 1.00 0.00 C ATOM 1382 C ASN A 660 9.932 -4.808 -20.250 1.00 0.00 C ATOM 1383 O ASN A 660 10.050 -5.793 -20.978 1.00 0.00 O ATOM 1384 CB ASN A 660 8.815 -2.567 -20.091 1.00 0.00 C ATOM 1385 CG ASN A 660 7.760 -1.807 -20.869 1.00 0.00 C ATOM 1386 OD1 ASN A 660 8.068 -0.862 -21.596 1.00 0.00 O ATOM 1387 ND2 ASN A 660 6.505 -2.215 -20.719 1.00 0.00 N ATOM 0 H ASN A 660 6.963 -4.952 -19.145 1.00 0.00 H new ATOM 0 HA ASN A 660 7.995 -4.327 -21.010 1.00 0.00 H new ATOM 0 HB2 ASN A 660 8.810 -2.231 -19.054 1.00 0.00 H new ATOM 0 HB3 ASN A 660 9.800 -2.335 -20.497 1.00 0.00 H new ATOM 0 HD21 ASN A 660 5.752 -1.741 -21.217 1.00 0.00 H new ATOM 0 HD22 ASN A 660 6.295 -3.003 -20.106 1.00 0.00 H new ATOM 1394 N ASN A 661 10.937 -4.318 -19.529 1.00 0.00 N ATOM 1395 CA ASN A 661 12.262 -4.927 -19.559 1.00 0.00 C ATOM 1396 C ASN A 661 12.942 -4.862 -18.190 1.00 0.00 C ATOM 1397 O ASN A 661 14.140 -5.119 -18.077 1.00 0.00 O ATOM 1398 CB ASN A 661 13.136 -4.236 -20.605 1.00 0.00 C ATOM 1399 CG ASN A 661 12.584 -4.384 -22.009 1.00 0.00 C ATOM 1400 OD1 ASN A 661 11.531 -3.835 -22.337 1.00 0.00 O ATOM 1401 ND2 ASN A 661 13.293 -5.130 -22.848 1.00 0.00 N ATOM 0 H ASN A 661 10.859 -3.504 -18.919 1.00 0.00 H new ATOM 0 HA ASN A 661 12.138 -5.977 -19.825 1.00 0.00 H new ATOM 0 HB2 ASN A 661 13.221 -3.177 -20.361 1.00 0.00 H new ATOM 0 HB3 ASN A 661 14.142 -4.654 -20.567 1.00 0.00 H new ATOM 0 HD21 ASN A 661 12.971 -5.267 -23.806 1.00 0.00 H new ATOM 0 HD22 ASN A 661 14.160 -5.566 -22.534 1.00 0.00 H new ATOM 1408 N ASN A 662 12.180 -4.521 -17.153 1.00 0.00 N ATOM 1409 CA ASN A 662 12.730 -4.430 -15.804 1.00 0.00 C ATOM 1410 C ASN A 662 12.134 -5.501 -14.894 1.00 0.00 C ATOM 1411 O ASN A 662 10.924 -5.730 -14.898 1.00 0.00 O ATOM 1412 CB ASN A 662 12.468 -3.040 -15.218 1.00 0.00 C ATOM 1413 CG ASN A 662 13.748 -2.275 -14.945 1.00 0.00 C ATOM 1414 OD1 ASN A 662 14.408 -2.488 -13.927 1.00 0.00 O ATOM 1415 ND2 ASN A 662 14.106 -1.377 -15.855 1.00 0.00 N ATOM 0 H ASN A 662 11.186 -4.304 -17.221 1.00 0.00 H new ATOM 0 HA ASN A 662 13.806 -4.595 -15.867 1.00 0.00 H new ATOM 0 HB2 ASN A 662 11.847 -2.469 -15.909 1.00 0.00 H new ATOM 0 HB3 ASN A 662 11.904 -3.140 -14.291 1.00 0.00 H new ATOM 0 HD21 ASN A 662 14.958 -0.831 -15.725 1.00 0.00 H new ATOM 0 HD22 ASN A 662 13.529 -1.233 -16.684 1.00 0.00 H new ATOM 1422 N ARG A 663 12.991 -6.148 -14.112 1.00 0.00 N ATOM 1423 CA ARG A 663 12.552 -7.189 -13.189 1.00 0.00 C ATOM 1424 C ARG A 663 12.237 -6.592 -11.822 1.00 0.00 C ATOM 1425 O ARG A 663 12.937 -5.694 -11.354 1.00 0.00 O ATOM 1426 CB ARG A 663 13.626 -8.270 -13.052 1.00 0.00 C ATOM 1427 CG ARG A 663 13.213 -9.432 -12.165 1.00 0.00 C ATOM 1428 CD ARG A 663 13.843 -10.738 -12.626 1.00 0.00 C ATOM 1429 NE ARG A 663 15.265 -10.582 -12.927 1.00 0.00 N ATOM 1430 CZ ARG A 663 16.013 -11.534 -13.480 1.00 0.00 C ATOM 1431 NH1 ARG A 663 15.483 -12.712 -13.786 1.00 0.00 N ATOM 1432 NH2 ARG A 663 17.296 -11.308 -13.726 1.00 0.00 N ATOM 0 H ARG A 663 13.995 -5.970 -14.099 1.00 0.00 H new ATOM 0 HA ARG A 663 11.646 -7.642 -13.591 1.00 0.00 H new ATOM 0 HB2 ARG A 663 13.874 -8.651 -14.043 1.00 0.00 H new ATOM 0 HB3 ARG A 663 14.533 -7.820 -12.647 1.00 0.00 H new ATOM 0 HG2 ARG A 663 13.508 -9.228 -11.136 1.00 0.00 H new ATOM 0 HG3 ARG A 663 12.127 -9.528 -12.172 1.00 0.00 H new ATOM 0 HD2 ARG A 663 13.717 -11.495 -11.852 1.00 0.00 H new ATOM 0 HD3 ARG A 663 13.322 -11.099 -13.513 1.00 0.00 H new ATOM 0 HE ARG A 663 15.710 -9.692 -12.700 1.00 0.00 H new ATOM 0 HH11 ARG A 663 14.497 -12.892 -13.598 1.00 0.00 H new ATOM 0 HH12 ARG A 663 16.062 -13.437 -14.210 1.00 0.00 H new ATOM 0 HH21 ARG A 663 17.709 -10.405 -13.491 1.00 0.00 H new ATOM 0 HH22 ARG A 663 17.870 -12.037 -14.150 1.00 0.00 H new ATOM 1446 N MET A 664 11.182 -7.088 -11.184 1.00 0.00 N ATOM 1447 CA MET A 664 10.785 -6.587 -9.875 1.00 0.00 C ATOM 1448 C MET A 664 10.363 -7.729 -8.959 1.00 0.00 C ATOM 1449 O MET A 664 9.379 -8.419 -9.221 1.00 0.00 O ATOM 1450 CB MET A 664 9.645 -5.576 -10.013 1.00 0.00 C ATOM 1451 CG MET A 664 8.581 -5.989 -11.018 1.00 0.00 C ATOM 1452 SD MET A 664 7.537 -4.611 -11.527 1.00 0.00 S ATOM 1453 CE MET A 664 7.182 -3.851 -9.945 1.00 0.00 C ATOM 0 H MET A 664 10.590 -7.833 -11.551 1.00 0.00 H new ATOM 0 HA MET A 664 11.647 -6.090 -9.430 1.00 0.00 H new ATOM 0 HB2 MET A 664 9.177 -5.434 -9.039 1.00 0.00 H new ATOM 0 HB3 MET A 664 10.059 -4.613 -10.311 1.00 0.00 H new ATOM 0 HG2 MET A 664 9.063 -6.419 -11.896 1.00 0.00 H new ATOM 0 HG3 MET A 664 7.958 -6.770 -10.582 1.00 0.00 H new ATOM 0 HE1 MET A 664 6.500 -3.013 -10.089 1.00 0.00 H new ATOM 0 HE2 MET A 664 6.721 -4.585 -9.284 1.00 0.00 H new ATOM 0 HE3 MET A 664 8.109 -3.492 -9.498 1.00 0.00 H new ATOM 1463 N ILE A 665 11.116 -7.919 -7.883 1.00 0.00 N ATOM 1464 CA ILE A 665 10.828 -8.977 -6.924 1.00 0.00 C ATOM 1465 C ILE A 665 9.843 -8.498 -5.865 1.00 0.00 C ATOM 1466 O ILE A 665 9.609 -7.299 -5.718 1.00 0.00 O ATOM 1467 CB ILE A 665 12.114 -9.463 -6.228 1.00 0.00 C ATOM 1468 CG1 ILE A 665 12.721 -8.337 -5.385 1.00 0.00 C ATOM 1469 CG2 ILE A 665 13.116 -9.965 -7.257 1.00 0.00 C ATOM 1470 CD1 ILE A 665 13.995 -8.734 -4.670 1.00 0.00 C ATOM 0 H ILE A 665 11.932 -7.353 -7.653 1.00 0.00 H new ATOM 0 HA ILE A 665 10.388 -9.804 -7.481 1.00 0.00 H new ATOM 0 HB ILE A 665 11.861 -10.290 -5.565 1.00 0.00 H new ATOM 0 HG12 ILE A 665 12.927 -7.483 -6.030 1.00 0.00 H new ATOM 0 HG13 ILE A 665 11.987 -8.010 -4.648 1.00 0.00 H new ATOM 0 HG21 ILE A 665 14.019 -10.305 -6.750 1.00 0.00 H new ATOM 0 HG22 ILE A 665 12.680 -10.793 -7.815 1.00 0.00 H new ATOM 0 HG23 ILE A 665 13.368 -9.157 -7.944 1.00 0.00 H new ATOM 0 HD11 ILE A 665 14.368 -7.887 -4.093 1.00 0.00 H new ATOM 0 HD12 ILE A 665 13.791 -9.568 -3.999 1.00 0.00 H new ATOM 0 HD13 ILE A 665 14.745 -9.032 -5.402 1.00 0.00 H new ATOM 1482 N GLN A 666 9.272 -9.440 -5.125 1.00 0.00 N ATOM 1483 CA GLN A 666 8.318 -9.105 -4.076 1.00 0.00 C ATOM 1484 C GLN A 666 8.926 -8.111 -3.091 1.00 0.00 C ATOM 1485 O GLN A 666 9.755 -8.475 -2.257 1.00 0.00 O ATOM 1486 CB GLN A 666 7.871 -10.369 -3.338 1.00 0.00 C ATOM 1487 CG GLN A 666 7.226 -10.087 -1.995 1.00 0.00 C ATOM 1488 CD GLN A 666 6.747 -11.339 -1.298 1.00 0.00 C ATOM 1489 OE1 GLN A 666 5.980 -12.148 -2.012 1.00 0.00 O flip ATOM 1490 NE2 GLN A 666 7.062 -11.576 -0.131 1.00 0.00 N flip ATOM 0 H GLN A 666 9.452 -10.438 -5.231 1.00 0.00 H new ATOM 0 HA GLN A 666 7.448 -8.643 -4.542 1.00 0.00 H new ATOM 0 HB2 GLN A 666 7.165 -10.916 -3.964 1.00 0.00 H new ATOM 0 HB3 GLN A 666 8.734 -11.018 -3.189 1.00 0.00 H new ATOM 0 HG2 GLN A 666 7.942 -9.572 -1.355 1.00 0.00 H new ATOM 0 HG3 GLN A 666 6.383 -9.411 -2.137 1.00 0.00 H new ATOM 0 HE21 GLN A 666 7.656 -10.923 0.380 1.00 0.00 H new ATOM 0 HE22 GLN A 666 6.729 -12.426 0.325 1.00 0.00 H new ATOM 1499 N GLY A 667 8.512 -6.856 -3.199 1.00 0.00 N ATOM 1500 CA GLY A 667 9.029 -5.828 -2.322 1.00 0.00 C ATOM 1501 C GLY A 667 9.613 -4.676 -3.103 1.00 0.00 C ATOM 1502 O GLY A 667 10.429 -3.912 -2.586 1.00 0.00 O ATOM 0 H GLY A 667 7.826 -6.532 -3.880 1.00 0.00 H new ATOM 0 HA2 GLY A 667 8.230 -5.463 -1.677 1.00 0.00 H new ATOM 0 HA3 GLY A 667 9.794 -6.253 -1.673 1.00 0.00 H new ATOM 1506 N THR A 668 9.197 -4.555 -4.360 1.00 0.00 N ATOM 1507 CA THR A 668 9.684 -3.497 -5.221 1.00 0.00 C ATOM 1508 C THR A 668 8.542 -2.628 -5.729 1.00 0.00 C ATOM 1509 O THR A 668 7.392 -3.061 -5.807 1.00 0.00 O ATOM 1510 CB THR A 668 10.456 -4.062 -6.427 1.00 0.00 C ATOM 1511 OG1 THR A 668 9.767 -5.198 -6.961 1.00 0.00 O ATOM 1512 CG2 THR A 668 11.868 -4.461 -6.026 1.00 0.00 C ATOM 0 H THR A 668 8.522 -5.181 -4.800 1.00 0.00 H new ATOM 0 HA THR A 668 10.359 -2.889 -4.618 1.00 0.00 H new ATOM 0 HB THR A 668 10.517 -3.284 -7.188 1.00 0.00 H new ATOM 0 HG1 THR A 668 9.907 -5.971 -6.375 1.00 0.00 H new ATOM 0 HG21 THR A 668 12.394 -4.857 -6.894 1.00 0.00 H new ATOM 0 HG22 THR A 668 12.399 -3.588 -5.647 1.00 0.00 H new ATOM 0 HG23 THR A 668 11.824 -5.224 -5.249 1.00 0.00 H new ATOM 1520 N LYS A 669 8.887 -1.406 -6.083 1.00 0.00 N ATOM 1521 CA LYS A 669 7.929 -0.441 -6.604 1.00 0.00 C ATOM 1522 C LYS A 669 8.385 0.037 -7.977 1.00 0.00 C ATOM 1523 O LYS A 669 9.544 0.411 -8.156 1.00 0.00 O ATOM 1524 CB LYS A 669 7.793 0.747 -5.649 1.00 0.00 C ATOM 1525 CG LYS A 669 6.701 1.727 -6.042 1.00 0.00 C ATOM 1526 CD LYS A 669 6.649 2.914 -5.094 1.00 0.00 C ATOM 1527 CE LYS A 669 7.685 3.965 -5.458 1.00 0.00 C ATOM 1528 NZ LYS A 669 8.900 3.867 -4.603 1.00 0.00 N ATOM 0 H LYS A 669 9.841 -1.050 -6.019 1.00 0.00 H new ATOM 0 HA LYS A 669 6.954 -0.921 -6.695 1.00 0.00 H new ATOM 0 HB2 LYS A 669 7.589 0.373 -4.646 1.00 0.00 H new ATOM 0 HB3 LYS A 669 8.745 1.276 -5.605 1.00 0.00 H new ATOM 0 HG2 LYS A 669 6.876 2.079 -7.059 1.00 0.00 H new ATOM 0 HG3 LYS A 669 5.737 1.218 -6.042 1.00 0.00 H new ATOM 0 HD2 LYS A 669 5.654 3.358 -5.120 1.00 0.00 H new ATOM 0 HD3 LYS A 669 6.819 2.573 -4.073 1.00 0.00 H new ATOM 0 HE2 LYS A 669 7.967 3.849 -6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 669 7.247 4.958 -5.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 669 9.355 4.800 -4.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 669 8.630 3.547 -3.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 669 9.565 3.185 -5.021 1.00 0.00 H new ATOM 1542 N PHE A 670 7.484 -0.006 -8.950 1.00 0.00 N ATOM 1543 CA PHE A 670 7.824 0.396 -10.310 1.00 0.00 C ATOM 1544 C PHE A 670 6.785 1.348 -10.902 1.00 0.00 C ATOM 1545 O PHE A 670 5.593 1.088 -10.839 1.00 0.00 O ATOM 1546 CB PHE A 670 7.949 -0.850 -11.191 1.00 0.00 C ATOM 1547 CG PHE A 670 8.850 -0.676 -12.380 1.00 0.00 C ATOM 1548 CD1 PHE A 670 9.463 0.539 -12.633 1.00 0.00 C ATOM 1549 CD2 PHE A 670 9.077 -1.730 -13.248 1.00 0.00 C ATOM 1550 CE1 PHE A 670 10.285 0.703 -13.725 1.00 0.00 C ATOM 1551 CE2 PHE A 670 9.902 -1.572 -14.346 1.00 0.00 C ATOM 1552 CZ PHE A 670 10.507 -0.352 -14.584 1.00 0.00 C ATOM 0 H PHE A 670 6.519 -0.313 -8.825 1.00 0.00 H new ATOM 0 HA PHE A 670 8.774 0.929 -10.276 1.00 0.00 H new ATOM 0 HB2 PHE A 670 8.323 -1.674 -10.584 1.00 0.00 H new ATOM 0 HB3 PHE A 670 6.957 -1.135 -11.540 1.00 0.00 H new ATOM 0 HD1 PHE A 670 9.294 1.370 -11.964 1.00 0.00 H new ATOM 0 HD2 PHE A 670 8.605 -2.684 -13.066 1.00 0.00 H new ATOM 0 HE1 PHE A 670 10.756 1.658 -13.909 1.00 0.00 H new ATOM 0 HE2 PHE A 670 10.074 -2.401 -15.017 1.00 0.00 H new ATOM 0 HZ PHE A 670 11.152 -0.226 -15.441 1.00 0.00 H new ATOM 1562 N LEU A 671 7.251 2.448 -11.489 1.00 0.00 N ATOM 1563 CA LEU A 671 6.356 3.431 -12.096 1.00 0.00 C ATOM 1564 C LEU A 671 5.678 2.871 -13.341 1.00 0.00 C ATOM 1565 O LEU A 671 6.291 2.144 -14.122 1.00 0.00 O ATOM 1566 CB LEU A 671 7.125 4.701 -12.459 1.00 0.00 C ATOM 1567 CG LEU A 671 6.540 5.990 -11.884 1.00 0.00 C ATOM 1568 CD1 LEU A 671 7.479 7.153 -12.107 1.00 0.00 C ATOM 1569 CD2 LEU A 671 5.193 6.283 -12.500 1.00 0.00 C ATOM 0 H LEU A 671 8.242 2.681 -11.557 1.00 0.00 H new ATOM 0 HA LEU A 671 5.586 3.671 -11.363 1.00 0.00 H new ATOM 0 HB2 LEU A 671 8.153 4.598 -12.112 1.00 0.00 H new ATOM 0 HB3 LEU A 671 7.163 4.788 -13.545 1.00 0.00 H new ATOM 0 HG LEU A 671 6.411 5.852 -10.811 1.00 0.00 H new ATOM 0 HD11 LEU A 671 7.041 8.060 -11.689 1.00 0.00 H new ATOM 0 HD12 LEU A 671 8.431 6.951 -11.617 1.00 0.00 H new ATOM 0 HD13 LEU A 671 7.643 7.289 -13.176 1.00 0.00 H new ATOM 0 HD21 LEU A 671 4.793 7.205 -12.078 1.00 0.00 H new ATOM 0 HD22 LEU A 671 5.303 6.396 -13.579 1.00 0.00 H new ATOM 0 HD23 LEU A 671 4.510 5.460 -12.289 1.00 0.00 H new ATOM 1581 N LEU A 672 4.406 3.215 -13.517 1.00 0.00 N ATOM 1582 CA LEU A 672 3.638 2.749 -14.666 1.00 0.00 C ATOM 1583 C LEU A 672 3.330 3.889 -15.632 1.00 0.00 C ATOM 1584 O LEU A 672 2.813 4.934 -15.238 1.00 0.00 O ATOM 1585 CB LEU A 672 2.333 2.092 -14.205 1.00 0.00 C ATOM 1586 CG LEU A 672 2.496 0.839 -13.337 1.00 0.00 C ATOM 1587 CD1 LEU A 672 1.213 0.023 -13.338 1.00 0.00 C ATOM 1588 CD2 LEU A 672 3.662 -0.008 -13.823 1.00 0.00 C ATOM 0 H LEU A 672 3.885 3.815 -12.878 1.00 0.00 H new ATOM 0 HA LEU A 672 4.246 2.013 -15.192 1.00 0.00 H new ATOM 0 HB2 LEU A 672 1.754 2.827 -13.646 1.00 0.00 H new ATOM 0 HB3 LEU A 672 1.748 1.829 -15.086 1.00 0.00 H new ATOM 0 HG LEU A 672 2.707 1.157 -12.316 1.00 0.00 H new ATOM 0 HD11 LEU A 672 1.345 -0.863 -12.717 1.00 0.00 H new ATOM 0 HD12 LEU A 672 0.398 0.627 -12.940 1.00 0.00 H new ATOM 0 HD13 LEU A 672 0.975 -0.280 -14.358 1.00 0.00 H new ATOM 0 HD21 LEU A 672 3.758 -0.891 -13.192 1.00 0.00 H new ATOM 0 HD22 LEU A 672 3.484 -0.316 -14.853 1.00 0.00 H new ATOM 0 HD23 LEU A 672 4.581 0.575 -13.773 1.00 0.00 H new ATOM 1600 N GLN A 673 3.648 3.669 -16.903 1.00 0.00 N ATOM 1601 CA GLN A 673 3.409 4.658 -17.950 1.00 0.00 C ATOM 1602 C GLN A 673 2.231 4.229 -18.821 1.00 0.00 C ATOM 1603 O GLN A 673 2.009 3.037 -19.028 1.00 0.00 O ATOM 1604 CB GLN A 673 4.667 4.814 -18.805 1.00 0.00 C ATOM 1605 CG GLN A 673 5.907 5.152 -17.994 1.00 0.00 C ATOM 1606 CD GLN A 673 6.897 5.998 -18.760 1.00 0.00 C ATOM 1607 OE1 GLN A 673 7.108 5.802 -19.957 1.00 0.00 O ATOM 1608 NE2 GLN A 673 7.518 6.942 -18.069 1.00 0.00 N ATOM 0 H GLN A 673 4.076 2.805 -17.236 1.00 0.00 H new ATOM 0 HA GLN A 673 3.169 5.616 -17.489 1.00 0.00 H new ATOM 0 HB2 GLN A 673 4.842 3.889 -19.354 1.00 0.00 H new ATOM 0 HB3 GLN A 673 4.500 5.597 -19.545 1.00 0.00 H new ATOM 0 HG2 GLN A 673 5.610 5.680 -17.088 1.00 0.00 H new ATOM 0 HG3 GLN A 673 6.393 4.228 -17.680 1.00 0.00 H new ATOM 0 HE21 GLN A 673 7.311 7.068 -17.078 1.00 0.00 H new ATOM 0 HE22 GLN A 673 8.203 7.543 -18.528 1.00 0.00 H new ATOM 1617 N ASP A 674 1.473 5.199 -19.326 1.00 0.00 N ATOM 1618 CA ASP A 674 0.314 4.902 -20.167 1.00 0.00 C ATOM 1619 C ASP A 674 0.653 3.849 -21.218 1.00 0.00 C ATOM 1620 O ASP A 674 1.564 4.031 -22.026 1.00 0.00 O ATOM 1621 CB ASP A 674 -0.209 6.180 -20.832 1.00 0.00 C ATOM 1622 CG ASP A 674 0.648 6.635 -22.000 1.00 0.00 C ATOM 1623 OD1 ASP A 674 0.548 6.022 -23.084 1.00 0.00 O ATOM 1624 OD2 ASP A 674 1.413 7.607 -21.832 1.00 0.00 O ATOM 0 H ASP A 674 1.638 6.193 -19.169 1.00 0.00 H new ATOM 0 HA ASP A 674 -0.471 4.498 -19.528 1.00 0.00 H new ATOM 0 HB2 ASP A 674 -1.228 6.011 -21.180 1.00 0.00 H new ATOM 0 HB3 ASP A 674 -0.254 6.977 -20.090 1.00 0.00 H new ATOM 1629 N GLY A 675 -0.074 2.738 -21.184 1.00 0.00 N ATOM 1630 CA GLY A 675 0.176 1.663 -22.121 1.00 0.00 C ATOM 1631 C GLY A 675 1.304 0.771 -21.651 1.00 0.00 C ATOM 1632 O GLY A 675 2.131 0.325 -22.447 1.00 0.00 O ATOM 0 H GLY A 675 -0.832 2.564 -20.524 1.00 0.00 H new ATOM 0 HA2 GLY A 675 -0.730 1.070 -22.247 1.00 0.00 H new ATOM 0 HA3 GLY A 675 0.423 2.080 -23.098 1.00 0.00 H new ATOM 1636 N ASP A 676 1.342 0.520 -20.345 1.00 0.00 N ATOM 1637 CA ASP A 676 2.378 -0.314 -19.753 1.00 0.00 C ATOM 1638 C ASP A 676 1.909 -1.752 -19.611 1.00 0.00 C ATOM 1639 O ASP A 676 0.943 -2.035 -18.900 1.00 0.00 O ATOM 1640 CB ASP A 676 2.782 0.232 -18.379 1.00 0.00 C ATOM 1641 CG ASP A 676 4.247 0.622 -18.317 1.00 0.00 C ATOM 1642 OD1 ASP A 676 5.008 0.227 -19.225 1.00 0.00 O ATOM 1643 OD2 ASP A 676 4.634 1.321 -17.357 1.00 0.00 O ATOM 0 H ASP A 676 0.664 0.885 -19.676 1.00 0.00 H new ATOM 0 HA ASP A 676 3.241 -0.294 -20.418 1.00 0.00 H new ATOM 0 HB2 ASP A 676 2.168 1.101 -18.142 1.00 0.00 H new ATOM 0 HB3 ASP A 676 2.577 -0.521 -17.618 1.00 0.00 H new ATOM 1648 N GLU A 677 2.611 -2.661 -20.270 1.00 0.00 N ATOM 1649 CA GLU A 677 2.276 -4.072 -20.191 1.00 0.00 C ATOM 1650 C GLU A 677 3.154 -4.732 -19.137 1.00 0.00 C ATOM 1651 O GLU A 677 4.362 -4.875 -19.325 1.00 0.00 O ATOM 1652 CB GLU A 677 2.463 -4.760 -21.549 1.00 0.00 C ATOM 1653 CG GLU A 677 2.256 -3.837 -22.741 1.00 0.00 C ATOM 1654 CD GLU A 677 3.543 -3.177 -23.199 1.00 0.00 C ATOM 1655 OE1 GLU A 677 4.615 -3.800 -23.048 1.00 0.00 O ATOM 1656 OE2 GLU A 677 3.478 -2.040 -23.711 1.00 0.00 O ATOM 0 H GLU A 677 3.413 -2.447 -20.863 1.00 0.00 H new ATOM 0 HA GLU A 677 1.227 -4.173 -19.912 1.00 0.00 H new ATOM 0 HB2 GLU A 677 3.468 -5.180 -21.597 1.00 0.00 H new ATOM 0 HB3 GLU A 677 1.765 -5.594 -21.622 1.00 0.00 H new ATOM 0 HG2 GLU A 677 1.830 -4.407 -23.567 1.00 0.00 H new ATOM 0 HG3 GLU A 677 1.531 -3.067 -22.478 1.00 0.00 H new ATOM 1663 N ILE A 678 2.552 -5.104 -18.014 1.00 0.00 N ATOM 1664 CA ILE A 678 3.298 -5.711 -16.923 1.00 0.00 C ATOM 1665 C ILE A 678 3.059 -7.216 -16.847 1.00 0.00 C ATOM 1666 O ILE A 678 1.928 -7.671 -16.691 1.00 0.00 O ATOM 1667 CB ILE A 678 2.940 -5.051 -15.563 1.00 0.00 C ATOM 1668 CG1 ILE A 678 1.675 -5.672 -14.956 1.00 0.00 C ATOM 1669 CG2 ILE A 678 2.759 -3.545 -15.729 1.00 0.00 C ATOM 1670 CD1 ILE A 678 1.217 -4.992 -13.683 1.00 0.00 C ATOM 0 H ILE A 678 1.553 -4.996 -17.837 1.00 0.00 H new ATOM 0 HA ILE A 678 4.355 -5.542 -17.129 1.00 0.00 H new ATOM 0 HB ILE A 678 3.768 -5.234 -14.879 1.00 0.00 H new ATOM 0 HG12 ILE A 678 0.871 -5.629 -15.691 1.00 0.00 H new ATOM 0 HG13 ILE A 678 1.861 -6.726 -14.748 1.00 0.00 H new ATOM 0 HG21 ILE A 678 2.509 -3.100 -14.766 1.00 0.00 H new ATOM 0 HG22 ILE A 678 3.685 -3.106 -16.102 1.00 0.00 H new ATOM 0 HG23 ILE A 678 1.954 -3.351 -16.438 1.00 0.00 H new ATOM 0 HD11 ILE A 678 0.318 -5.484 -13.311 1.00 0.00 H new ATOM 0 HD12 ILE A 678 2.004 -5.058 -12.932 1.00 0.00 H new ATOM 0 HD13 ILE A 678 0.998 -3.944 -13.889 1.00 0.00 H new ATOM 1682 N LYS A 679 4.142 -7.979 -16.949 1.00 0.00 N ATOM 1683 CA LYS A 679 4.064 -9.432 -16.880 1.00 0.00 C ATOM 1684 C LYS A 679 4.043 -9.880 -15.429 1.00 0.00 C ATOM 1685 O LYS A 679 4.999 -9.662 -14.687 1.00 0.00 O ATOM 1686 CB LYS A 679 5.246 -10.070 -17.611 1.00 0.00 C ATOM 1687 CG LYS A 679 5.555 -9.421 -18.951 1.00 0.00 C ATOM 1688 CD LYS A 679 6.026 -10.445 -19.973 1.00 0.00 C ATOM 1689 CE LYS A 679 7.508 -10.290 -20.277 1.00 0.00 C ATOM 1690 NZ LYS A 679 7.879 -10.925 -21.572 1.00 0.00 N ATOM 0 H LYS A 679 5.085 -7.614 -17.080 1.00 0.00 H new ATOM 0 HA LYS A 679 3.144 -9.755 -17.367 1.00 0.00 H new ATOM 0 HB2 LYS A 679 6.130 -10.011 -16.976 1.00 0.00 H new ATOM 0 HB3 LYS A 679 5.037 -11.128 -17.769 1.00 0.00 H new ATOM 0 HG2 LYS A 679 4.665 -8.915 -19.325 1.00 0.00 H new ATOM 0 HG3 LYS A 679 6.323 -8.659 -18.818 1.00 0.00 H new ATOM 0 HD2 LYS A 679 5.834 -11.450 -19.597 1.00 0.00 H new ATOM 0 HD3 LYS A 679 5.452 -10.333 -20.893 1.00 0.00 H new ATOM 0 HE2 LYS A 679 7.764 -9.231 -20.306 1.00 0.00 H new ATOM 0 HE3 LYS A 679 8.092 -10.737 -19.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 679 8.897 -10.797 -21.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 679 7.659 -11.941 -21.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 679 7.341 -10.481 -22.343 1.00 0.00 H new ATOM 1704 N ILE A 680 2.942 -10.495 -15.028 1.00 0.00 N ATOM 1705 CA ILE A 680 2.785 -10.958 -13.659 1.00 0.00 C ATOM 1706 C ILE A 680 3.600 -12.223 -13.396 1.00 0.00 C ATOM 1707 O ILE A 680 4.104 -12.424 -12.291 1.00 0.00 O ATOM 1708 CB ILE A 680 1.293 -11.208 -13.336 1.00 0.00 C ATOM 1709 CG1 ILE A 680 0.919 -10.573 -11.996 1.00 0.00 C ATOM 1710 CG2 ILE A 680 0.971 -12.696 -13.321 1.00 0.00 C ATOM 1711 CD1 ILE A 680 0.195 -9.249 -12.124 1.00 0.00 C ATOM 0 H ILE A 680 2.143 -10.685 -15.632 1.00 0.00 H new ATOM 0 HA ILE A 680 3.163 -10.173 -13.003 1.00 0.00 H new ATOM 0 HB ILE A 680 0.701 -10.742 -14.124 1.00 0.00 H new ATOM 0 HG12 ILE A 680 0.290 -11.267 -11.439 1.00 0.00 H new ATOM 0 HG13 ILE A 680 1.826 -10.425 -11.410 1.00 0.00 H new ATOM 0 HG21 ILE A 680 -0.085 -12.837 -13.091 1.00 0.00 H new ATOM 0 HG22 ILE A 680 1.190 -13.126 -14.299 1.00 0.00 H new ATOM 0 HG23 ILE A 680 1.577 -13.192 -12.563 1.00 0.00 H new ATOM 0 HD11 ILE A 680 -0.036 -8.863 -11.131 1.00 0.00 H new ATOM 0 HD12 ILE A 680 0.829 -8.537 -12.652 1.00 0.00 H new ATOM 0 HD13 ILE A 680 -0.731 -9.393 -12.681 1.00 0.00 H new ATOM 1723 N ILE A 681 3.724 -13.079 -14.408 1.00 0.00 N ATOM 1724 CA ILE A 681 4.476 -14.318 -14.252 1.00 0.00 C ATOM 1725 C ILE A 681 5.021 -14.828 -15.584 1.00 0.00 C ATOM 1726 O ILE A 681 4.304 -14.879 -16.583 1.00 0.00 O ATOM 1727 CB ILE A 681 3.612 -15.418 -13.594 1.00 0.00 C ATOM 1728 CG1 ILE A 681 4.511 -16.518 -13.018 1.00 0.00 C ATOM 1729 CG2 ILE A 681 2.612 -15.994 -14.590 1.00 0.00 C ATOM 1730 CD1 ILE A 681 3.780 -17.804 -12.691 1.00 0.00 C ATOM 0 H ILE A 681 3.318 -12.939 -15.333 1.00 0.00 H new ATOM 0 HA ILE A 681 5.320 -14.088 -13.601 1.00 0.00 H new ATOM 0 HB ILE A 681 3.044 -14.972 -12.777 1.00 0.00 H new ATOM 0 HG12 ILE A 681 5.305 -16.735 -13.733 1.00 0.00 H new ATOM 0 HG13 ILE A 681 4.990 -16.144 -12.113 1.00 0.00 H new ATOM 0 HG21 ILE A 681 2.016 -16.766 -14.103 1.00 0.00 H new ATOM 0 HG22 ILE A 681 1.956 -15.200 -14.947 1.00 0.00 H new ATOM 0 HG23 ILE A 681 3.148 -16.428 -15.434 1.00 0.00 H new ATOM 0 HD11 ILE A 681 4.485 -18.531 -12.289 1.00 0.00 H new ATOM 0 HD12 ILE A 681 3.004 -17.604 -11.952 1.00 0.00 H new ATOM 0 HD13 ILE A 681 3.324 -18.204 -13.597 1.00 0.00 H new ATOM 1742 N TRP A 682 6.293 -15.214 -15.584 1.00 0.00 N ATOM 1743 CA TRP A 682 6.937 -15.732 -16.784 1.00 0.00 C ATOM 1744 C TRP A 682 7.763 -16.974 -16.462 1.00 0.00 C ATOM 1745 O TRP A 682 8.712 -16.910 -15.680 1.00 0.00 O ATOM 1746 CB TRP A 682 7.828 -14.664 -17.421 1.00 0.00 C ATOM 1747 CG TRP A 682 8.531 -15.143 -18.654 1.00 0.00 C ATOM 1748 CD1 TRP A 682 8.095 -16.100 -19.525 1.00 0.00 C ATOM 1749 CD2 TRP A 682 9.797 -14.695 -19.152 1.00 0.00 C ATOM 1750 NE1 TRP A 682 9.010 -16.273 -20.533 1.00 0.00 N ATOM 1751 CE2 TRP A 682 10.064 -15.422 -20.328 1.00 0.00 C ATOM 1752 CE3 TRP A 682 10.731 -13.748 -18.718 1.00 0.00 C ATOM 1753 CZ2 TRP A 682 11.225 -15.232 -21.073 1.00 0.00 C ATOM 1754 CZ3 TRP A 682 11.882 -13.561 -19.459 1.00 0.00 C ATOM 1755 CH2 TRP A 682 12.121 -14.299 -20.625 1.00 0.00 C ATOM 0 H TRP A 682 6.899 -15.177 -14.764 1.00 0.00 H new ATOM 0 HA TRP A 682 6.156 -16.007 -17.493 1.00 0.00 H new ATOM 0 HB2 TRP A 682 7.220 -13.795 -17.671 1.00 0.00 H new ATOM 0 HB3 TRP A 682 8.569 -14.336 -16.692 1.00 0.00 H new ATOM 0 HD1 TRP A 682 7.165 -16.642 -19.434 1.00 0.00 H new ATOM 0 HE1 TRP A 682 8.920 -16.929 -21.309 1.00 0.00 H new ATOM 0 HE3 TRP A 682 10.555 -13.174 -17.820 1.00 0.00 H new ATOM 0 HZ2 TRP A 682 11.412 -15.800 -21.972 1.00 0.00 H new ATOM 0 HZ3 TRP A 682 12.610 -12.833 -19.133 1.00 0.00 H new ATOM 0 HH2 TRP A 682 13.030 -14.129 -21.182 1.00 0.00 H new ATOM 1766 N ASP A 683 7.403 -18.100 -17.069 1.00 0.00 N ATOM 1767 CA ASP A 683 8.121 -19.350 -16.844 1.00 0.00 C ATOM 1768 C ASP A 683 8.627 -19.931 -18.160 1.00 0.00 C ATOM 1769 O ASP A 683 7.842 -20.266 -19.046 1.00 0.00 O ATOM 1770 CB ASP A 683 7.214 -20.363 -16.141 1.00 0.00 C ATOM 1771 CG ASP A 683 7.959 -21.192 -15.114 1.00 0.00 C ATOM 1772 OD1 ASP A 683 8.944 -21.860 -15.492 1.00 0.00 O ATOM 1773 OD2 ASP A 683 7.558 -21.173 -13.931 1.00 0.00 O ATOM 0 H ASP A 683 6.620 -18.173 -17.719 1.00 0.00 H new ATOM 0 HA ASP A 683 8.980 -19.138 -16.207 1.00 0.00 H new ATOM 0 HB2 ASP A 683 6.395 -19.835 -15.653 1.00 0.00 H new ATOM 0 HB3 ASP A 683 6.769 -21.025 -16.884 1.00 0.00 H new ATOM 1778 N LYS A 684 9.946 -20.046 -18.278 1.00 0.00 N ATOM 1779 CA LYS A 684 10.562 -20.585 -19.484 1.00 0.00 C ATOM 1780 C LYS A 684 10.223 -22.061 -19.673 1.00 0.00 C ATOM 1781 O LYS A 684 9.871 -22.491 -20.772 1.00 0.00 O ATOM 1782 CB LYS A 684 12.072 -20.397 -19.431 1.00 0.00 C ATOM 1783 CG LYS A 684 12.620 -19.543 -20.565 1.00 0.00 C ATOM 1784 CD LYS A 684 13.736 -20.256 -21.315 1.00 0.00 C ATOM 1785 CE LYS A 684 14.885 -19.313 -21.633 1.00 0.00 C ATOM 1786 NZ LYS A 684 14.791 -18.771 -23.017 1.00 0.00 N ATOM 0 H LYS A 684 10.609 -19.773 -17.552 1.00 0.00 H new ATOM 0 HA LYS A 684 10.161 -20.038 -20.337 1.00 0.00 H new ATOM 0 HB2 LYS A 684 12.339 -19.937 -18.479 1.00 0.00 H new ATOM 0 HB3 LYS A 684 12.553 -21.375 -19.459 1.00 0.00 H new ATOM 0 HG2 LYS A 684 11.815 -19.297 -21.257 1.00 0.00 H new ATOM 0 HG3 LYS A 684 12.994 -18.601 -20.164 1.00 0.00 H new ATOM 0 HD2 LYS A 684 14.103 -21.090 -20.716 1.00 0.00 H new ATOM 0 HD3 LYS A 684 13.343 -20.677 -22.240 1.00 0.00 H new ATOM 0 HE2 LYS A 684 14.887 -18.489 -20.920 1.00 0.00 H new ATOM 0 HE3 LYS A 684 15.831 -19.840 -21.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 684 15.592 -18.133 -23.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 684 14.815 -19.555 -23.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 684 13.900 -18.246 -23.124 1.00 0.00 H new ATOM 1800 N ASN A 685 10.343 -22.836 -18.598 1.00 0.00 N ATOM 1801 CA ASN A 685 10.061 -24.267 -18.648 1.00 0.00 C ATOM 1802 C ASN A 685 8.561 -24.542 -18.600 1.00 0.00 C ATOM 1803 O ASN A 685 8.061 -25.422 -19.301 1.00 0.00 O ATOM 1804 CB ASN A 685 10.759 -24.982 -17.490 1.00 0.00 C ATOM 1805 CG ASN A 685 12.060 -25.636 -17.914 1.00 0.00 C ATOM 1806 OD1 ASN A 685 13.088 -24.971 -18.048 1.00 0.00 O ATOM 1807 ND2 ASN A 685 12.021 -26.946 -18.128 1.00 0.00 N ATOM 0 H ASN A 685 10.634 -22.496 -17.681 1.00 0.00 H new ATOM 0 HA ASN A 685 10.444 -24.650 -19.594 1.00 0.00 H new ATOM 0 HB2 ASN A 685 10.958 -24.267 -16.692 1.00 0.00 H new ATOM 0 HB3 ASN A 685 10.092 -25.740 -17.079 1.00 0.00 H new ATOM 0 HD21 ASN A 685 12.865 -27.441 -18.416 1.00 0.00 H new ATOM 0 HD22 ASN A 685 11.147 -27.457 -18.005 1.00 0.00 H new ATOM 1814 N ASN A 686 7.848 -23.792 -17.768 1.00 0.00 N ATOM 1815 CA ASN A 686 6.405 -23.965 -17.631 1.00 0.00 C ATOM 1816 C ASN A 686 5.650 -23.265 -18.759 1.00 0.00 C ATOM 1817 O ASN A 686 4.446 -23.464 -18.926 1.00 0.00 O ATOM 1818 CB ASN A 686 5.933 -23.431 -16.278 1.00 0.00 C ATOM 1819 CG ASN A 686 4.891 -24.326 -15.636 1.00 0.00 C ATOM 1820 OD1 ASN A 686 5.221 -25.256 -14.900 1.00 0.00 O ATOM 1821 ND2 ASN A 686 3.621 -24.048 -15.912 1.00 0.00 N ATOM 0 H ASN A 686 8.244 -23.059 -17.179 1.00 0.00 H new ATOM 0 HA ASN A 686 6.191 -25.032 -17.691 1.00 0.00 H new ATOM 0 HB2 ASN A 686 6.788 -23.336 -15.609 1.00 0.00 H new ATOM 0 HB3 ASN A 686 5.519 -22.431 -16.409 1.00 0.00 H new ATOM 0 HD21 ASN A 686 2.875 -24.615 -15.508 1.00 0.00 H new ATOM 0 HD22 ASN A 686 3.392 -23.267 -16.527 1.00 0.00 H new ATOM 1828 N LYS A 687 6.356 -22.442 -19.532 1.00 0.00 N ATOM 1829 CA LYS A 687 5.740 -21.715 -20.637 1.00 0.00 C ATOM 1830 C LYS A 687 4.557 -20.883 -20.150 1.00 0.00 C ATOM 1831 O LYS A 687 3.627 -20.605 -20.907 1.00 0.00 O ATOM 1832 CB LYS A 687 5.281 -22.687 -21.725 1.00 0.00 C ATOM 1833 CG LYS A 687 5.468 -22.153 -23.136 1.00 0.00 C ATOM 1834 CD LYS A 687 5.477 -23.274 -24.163 1.00 0.00 C ATOM 1835 CE LYS A 687 5.307 -22.737 -25.575 1.00 0.00 C ATOM 1836 NZ LYS A 687 6.349 -21.729 -25.916 1.00 0.00 N ATOM 0 H LYS A 687 7.353 -22.263 -19.413 1.00 0.00 H new ATOM 0 HA LYS A 687 6.488 -21.041 -21.055 1.00 0.00 H new ATOM 0 HB2 LYS A 687 5.833 -23.621 -21.623 1.00 0.00 H new ATOM 0 HB3 LYS A 687 4.228 -22.921 -21.571 1.00 0.00 H new ATOM 0 HG2 LYS A 687 4.667 -21.452 -23.369 1.00 0.00 H new ATOM 0 HG3 LYS A 687 6.404 -21.598 -23.194 1.00 0.00 H new ATOM 0 HD2 LYS A 687 6.414 -23.826 -24.093 1.00 0.00 H new ATOM 0 HD3 LYS A 687 4.675 -23.978 -23.941 1.00 0.00 H new ATOM 0 HE2 LYS A 687 5.354 -23.562 -26.285 1.00 0.00 H new ATOM 0 HE3 LYS A 687 4.320 -22.286 -25.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 6.282 -21.488 -26.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 6.203 -20.872 -25.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 7.291 -22.122 -25.716 1.00 0.00 H new ATOM 1850 N PHE A 688 4.600 -20.489 -18.881 1.00 0.00 N ATOM 1851 CA PHE A 688 3.534 -19.688 -18.291 1.00 0.00 C ATOM 1852 C PHE A 688 3.808 -18.201 -18.485 1.00 0.00 C ATOM 1853 O PHE A 688 4.677 -17.630 -17.826 1.00 0.00 O ATOM 1854 CB PHE A 688 3.401 -20.004 -16.800 1.00 0.00 C ATOM 1855 CG PHE A 688 1.979 -20.029 -16.315 1.00 0.00 C ATOM 1856 CD1 PHE A 688 1.185 -18.897 -16.399 1.00 0.00 C ATOM 1857 CD2 PHE A 688 1.439 -21.185 -15.774 1.00 0.00 C ATOM 1858 CE1 PHE A 688 -0.123 -18.917 -15.953 1.00 0.00 C ATOM 1859 CE2 PHE A 688 0.133 -21.210 -15.325 1.00 0.00 C ATOM 1860 CZ PHE A 688 -0.649 -20.075 -15.415 1.00 0.00 C ATOM 0 H PHE A 688 5.363 -20.712 -18.241 1.00 0.00 H new ATOM 0 HA PHE A 688 2.599 -19.937 -18.793 1.00 0.00 H new ATOM 0 HB2 PHE A 688 3.861 -20.971 -16.600 1.00 0.00 H new ATOM 0 HB3 PHE A 688 3.958 -19.261 -16.229 1.00 0.00 H new ATOM 0 HD1 PHE A 688 1.593 -17.989 -16.818 1.00 0.00 H new ATOM 0 HD2 PHE A 688 2.046 -22.076 -15.703 1.00 0.00 H new ATOM 0 HE1 PHE A 688 -0.733 -18.028 -16.025 1.00 0.00 H new ATOM 0 HE2 PHE A 688 -0.276 -22.116 -14.904 1.00 0.00 H new ATOM 0 HZ PHE A 688 -1.671 -20.093 -15.065 1.00 0.00 H new ATOM 1870 N VAL A 689 3.066 -17.579 -19.395 1.00 0.00 N ATOM 1871 CA VAL A 689 3.238 -16.158 -19.672 1.00 0.00 C ATOM 1872 C VAL A 689 1.989 -15.363 -19.318 1.00 0.00 C ATOM 1873 O VAL A 689 0.897 -15.639 -19.815 1.00 0.00 O ATOM 1874 CB VAL A 689 3.588 -15.896 -21.151 1.00 0.00 C ATOM 1875 CG1 VAL A 689 5.093 -15.926 -21.356 1.00 0.00 C ATOM 1876 CG2 VAL A 689 2.895 -16.903 -22.056 1.00 0.00 C ATOM 0 H VAL A 689 2.342 -18.035 -19.951 1.00 0.00 H new ATOM 0 HA VAL A 689 4.068 -15.829 -19.047 1.00 0.00 H new ATOM 0 HB VAL A 689 3.229 -14.902 -21.418 1.00 0.00 H new ATOM 0 HG11 VAL A 689 5.321 -15.739 -22.405 1.00 0.00 H new ATOM 0 HG12 VAL A 689 5.559 -15.157 -20.741 1.00 0.00 H new ATOM 0 HG13 VAL A 689 5.480 -16.904 -21.069 1.00 0.00 H new ATOM 0 HG21 VAL A 689 3.156 -16.699 -23.094 1.00 0.00 H new ATOM 0 HG22 VAL A 689 3.216 -17.911 -21.792 1.00 0.00 H new ATOM 0 HG23 VAL A 689 1.815 -16.822 -21.931 1.00 0.00 H new ATOM 1886 N ILE A 690 2.167 -14.365 -18.464 1.00 0.00 N ATOM 1887 CA ILE A 690 1.073 -13.504 -18.040 1.00 0.00 C ATOM 1888 C ILE A 690 1.457 -12.042 -18.241 1.00 0.00 C ATOM 1889 O ILE A 690 2.641 -11.709 -18.287 1.00 0.00 O ATOM 1890 CB ILE A 690 0.711 -13.745 -16.560 1.00 0.00 C ATOM 1891 CG1 ILE A 690 0.165 -15.164 -16.366 1.00 0.00 C ATOM 1892 CG2 ILE A 690 -0.289 -12.703 -16.064 1.00 0.00 C ATOM 1893 CD1 ILE A 690 -1.302 -15.318 -16.711 1.00 0.00 C ATOM 0 H ILE A 690 3.068 -14.131 -18.048 1.00 0.00 H new ATOM 0 HA ILE A 690 0.201 -13.743 -18.648 1.00 0.00 H new ATOM 0 HB ILE A 690 1.619 -13.643 -15.966 1.00 0.00 H new ATOM 0 HG12 ILE A 690 0.745 -15.852 -16.981 1.00 0.00 H new ATOM 0 HG13 ILE A 690 0.316 -15.460 -15.328 1.00 0.00 H new ATOM 0 HG21 ILE A 690 -0.527 -12.896 -15.018 1.00 0.00 H new ATOM 0 HG22 ILE A 690 0.145 -11.708 -16.160 1.00 0.00 H new ATOM 0 HG23 ILE A 690 -1.200 -12.760 -16.660 1.00 0.00 H new ATOM 0 HD11 ILE A 690 -1.608 -16.351 -16.546 1.00 0.00 H new ATOM 0 HD12 ILE A 690 -1.896 -14.658 -16.078 1.00 0.00 H new ATOM 0 HD13 ILE A 690 -1.459 -15.056 -17.757 1.00 0.00 H new ATOM 1905 N GLY A 691 0.462 -11.170 -18.362 1.00 0.00 N ATOM 1906 CA GLY A 691 0.748 -9.763 -18.556 1.00 0.00 C ATOM 1907 C GLY A 691 -0.485 -8.936 -18.864 1.00 0.00 C ATOM 1908 O GLY A 691 -1.308 -9.313 -19.700 1.00 0.00 O ATOM 0 H GLY A 691 -0.529 -11.410 -18.329 1.00 0.00 H new ATOM 0 HA2 GLY A 691 1.226 -9.370 -17.659 1.00 0.00 H new ATOM 0 HA3 GLY A 691 1.463 -9.654 -19.372 1.00 0.00 H new ATOM 1912 N PHE A 692 -0.608 -7.800 -18.188 1.00 0.00 N ATOM 1913 CA PHE A 692 -1.740 -6.903 -18.391 1.00 0.00 C ATOM 1914 C PHE A 692 -1.254 -5.548 -18.891 1.00 0.00 C ATOM 1915 O PHE A 692 -0.169 -5.098 -18.524 1.00 0.00 O ATOM 1916 CB PHE A 692 -2.540 -6.724 -17.094 1.00 0.00 C ATOM 1917 CG PHE A 692 -2.441 -7.884 -16.139 1.00 0.00 C ATOM 1918 CD1 PHE A 692 -2.458 -9.191 -16.602 1.00 0.00 C ATOM 1919 CD2 PHE A 692 -2.329 -7.663 -14.776 1.00 0.00 C ATOM 1920 CE1 PHE A 692 -2.366 -10.252 -15.724 1.00 0.00 C ATOM 1921 CE2 PHE A 692 -2.237 -8.722 -13.894 1.00 0.00 C ATOM 1922 CZ PHE A 692 -2.255 -10.019 -14.369 1.00 0.00 C ATOM 0 H PHE A 692 0.064 -7.477 -17.492 1.00 0.00 H new ATOM 0 HA PHE A 692 -2.395 -7.349 -19.140 1.00 0.00 H new ATOM 0 HB2 PHE A 692 -2.194 -5.822 -16.589 1.00 0.00 H new ATOM 0 HB3 PHE A 692 -3.588 -6.565 -17.347 1.00 0.00 H new ATOM 0 HD1 PHE A 692 -2.544 -9.381 -17.662 1.00 0.00 H new ATOM 0 HD2 PHE A 692 -2.313 -6.651 -14.399 1.00 0.00 H new ATOM 0 HE1 PHE A 692 -2.381 -11.265 -16.098 1.00 0.00 H new ATOM 0 HE2 PHE A 692 -2.151 -8.536 -12.834 1.00 0.00 H new ATOM 0 HZ PHE A 692 -2.182 -10.848 -13.681 1.00 0.00 H new ATOM 1932 N LYS A 693 -2.055 -4.903 -19.731 1.00 0.00 N ATOM 1933 CA LYS A 693 -1.689 -3.602 -20.278 1.00 0.00 C ATOM 1934 C LYS A 693 -2.411 -2.479 -19.547 1.00 0.00 C ATOM 1935 O LYS A 693 -3.640 -2.456 -19.476 1.00 0.00 O ATOM 1936 CB LYS A 693 -2.010 -3.541 -21.771 1.00 0.00 C ATOM 1937 CG LYS A 693 -1.458 -2.303 -22.461 1.00 0.00 C ATOM 1938 CD LYS A 693 -1.364 -2.497 -23.965 1.00 0.00 C ATOM 1939 CE LYS A 693 -2.706 -2.271 -24.645 1.00 0.00 C ATOM 1940 NZ LYS A 693 -3.246 -3.527 -25.237 1.00 0.00 N ATOM 0 H LYS A 693 -2.958 -5.257 -20.047 1.00 0.00 H new ATOM 0 HA LYS A 693 -0.616 -3.471 -20.139 1.00 0.00 H new ATOM 0 HB2 LYS A 693 -1.606 -4.429 -22.258 1.00 0.00 H new ATOM 0 HB3 LYS A 693 -3.092 -3.569 -21.903 1.00 0.00 H new ATOM 0 HG2 LYS A 693 -2.098 -1.448 -22.243 1.00 0.00 H new ATOM 0 HG3 LYS A 693 -0.471 -2.072 -22.061 1.00 0.00 H new ATOM 0 HD2 LYS A 693 -0.627 -1.807 -24.376 1.00 0.00 H new ATOM 0 HD3 LYS A 693 -1.012 -3.506 -24.181 1.00 0.00 H new ATOM 0 HE2 LYS A 693 -3.418 -1.875 -23.921 1.00 0.00 H new ATOM 0 HE3 LYS A 693 -2.595 -1.519 -25.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 693 -4.161 -3.331 -25.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 693 -2.579 -3.891 -25.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 693 -3.376 -4.236 -24.487 1.00 0.00 H new ATOM 1954 N VAL A 694 -1.637 -1.547 -19.005 1.00 0.00 N ATOM 1955 CA VAL A 694 -2.195 -0.416 -18.280 1.00 0.00 C ATOM 1956 C VAL A 694 -2.631 0.687 -19.241 1.00 0.00 C ATOM 1957 O VAL A 694 -1.827 1.206 -20.017 1.00 0.00 O ATOM 1958 CB VAL A 694 -1.181 0.140 -17.248 1.00 0.00 C ATOM 1959 CG1 VAL A 694 -0.932 1.629 -17.444 1.00 0.00 C ATOM 1960 CG2 VAL A 694 -1.668 -0.139 -15.835 1.00 0.00 C ATOM 0 H VAL A 694 -0.618 -1.554 -19.055 1.00 0.00 H new ATOM 0 HA VAL A 694 -3.073 -0.771 -17.740 1.00 0.00 H new ATOM 0 HB VAL A 694 -0.231 -0.371 -17.406 1.00 0.00 H new ATOM 0 HG11 VAL A 694 -0.216 1.979 -16.701 1.00 0.00 H new ATOM 0 HG12 VAL A 694 -0.532 1.803 -18.443 1.00 0.00 H new ATOM 0 HG13 VAL A 694 -1.870 2.173 -17.329 1.00 0.00 H new ATOM 0 HG21 VAL A 694 -0.948 0.256 -15.118 1.00 0.00 H new ATOM 0 HG22 VAL A 694 -2.634 0.342 -15.682 1.00 0.00 H new ATOM 0 HG23 VAL A 694 -1.771 -1.215 -15.691 1.00 0.00 H new ATOM 1970 N GLU A 695 -3.907 1.041 -19.177 1.00 0.00 N ATOM 1971 CA GLU A 695 -4.456 2.084 -20.029 1.00 0.00 C ATOM 1972 C GLU A 695 -5.272 3.070 -19.202 1.00 0.00 C ATOM 1973 O GLU A 695 -6.337 2.733 -18.686 1.00 0.00 O ATOM 1974 CB GLU A 695 -5.323 1.473 -21.129 1.00 0.00 C ATOM 1975 CG GLU A 695 -5.024 2.033 -22.509 1.00 0.00 C ATOM 1976 CD GLU A 695 -3.558 1.920 -22.880 1.00 0.00 C ATOM 1977 OE1 GLU A 695 -3.042 0.783 -22.923 1.00 0.00 O ATOM 1978 OE2 GLU A 695 -2.926 2.967 -23.128 1.00 0.00 O ATOM 0 H GLU A 695 -4.583 0.619 -18.541 1.00 0.00 H new ATOM 0 HA GLU A 695 -3.629 2.620 -20.495 1.00 0.00 H new ATOM 0 HB2 GLU A 695 -5.174 0.393 -21.142 1.00 0.00 H new ATOM 0 HB3 GLU A 695 -6.373 1.647 -20.893 1.00 0.00 H new ATOM 0 HG2 GLU A 695 -5.624 1.504 -23.249 1.00 0.00 H new ATOM 0 HG3 GLU A 695 -5.324 3.080 -22.545 1.00 0.00 H new ATOM 1985 N ILE A 696 -4.758 4.286 -19.074 1.00 0.00 N ATOM 1986 CA ILE A 696 -5.428 5.324 -18.302 1.00 0.00 C ATOM 1987 C ILE A 696 -6.406 6.107 -19.162 1.00 0.00 C ATOM 1988 O ILE A 696 -6.005 6.905 -20.010 1.00 0.00 O ATOM 1989 CB ILE A 696 -4.417 6.306 -17.680 1.00 0.00 C ATOM 1990 CG1 ILE A 696 -3.226 5.552 -17.086 1.00 0.00 C ATOM 1991 CG2 ILE A 696 -5.094 7.158 -16.616 1.00 0.00 C ATOM 1992 CD1 ILE A 696 -1.959 6.375 -17.048 1.00 0.00 C ATOM 0 H ILE A 696 -3.877 4.578 -19.496 1.00 0.00 H new ATOM 0 HA ILE A 696 -5.972 4.817 -17.505 1.00 0.00 H new ATOM 0 HB ILE A 696 -4.046 6.963 -18.467 1.00 0.00 H new ATOM 0 HG12 ILE A 696 -3.475 5.233 -16.074 1.00 0.00 H new ATOM 0 HG13 ILE A 696 -3.048 4.649 -17.670 1.00 0.00 H new ATOM 0 HG21 ILE A 696 -4.368 7.847 -16.185 1.00 0.00 H new ATOM 0 HG22 ILE A 696 -5.908 7.725 -17.067 1.00 0.00 H new ATOM 0 HG23 ILE A 696 -5.492 6.513 -15.832 1.00 0.00 H new ATOM 0 HD11 ILE A 696 -1.153 5.782 -16.616 1.00 0.00 H new ATOM 0 HD12 ILE A 696 -1.688 6.672 -18.061 1.00 0.00 H new ATOM 0 HD13 ILE A 696 -2.121 7.265 -16.440 1.00 0.00 H new ATOM 2004 N ASN A 697 -7.693 5.886 -18.929 1.00 0.00 N ATOM 2005 CA ASN A 697 -8.728 6.586 -19.673 1.00 0.00 C ATOM 2006 C ASN A 697 -8.980 7.946 -19.043 1.00 0.00 C ATOM 2007 O ASN A 697 -9.080 8.959 -19.734 1.00 0.00 O ATOM 2008 CB ASN A 697 -10.020 5.767 -19.694 1.00 0.00 C ATOM 2009 CG ASN A 697 -9.789 4.335 -20.135 1.00 0.00 C ATOM 2010 OD1 ASN A 697 -10.287 3.395 -19.517 1.00 0.00 O ATOM 2011 ND2 ASN A 697 -9.028 4.164 -21.209 1.00 0.00 N ATOM 0 H ASN A 697 -8.043 5.229 -18.232 1.00 0.00 H new ATOM 0 HA ASN A 697 -8.392 6.723 -20.701 1.00 0.00 H new ATOM 0 HB2 ASN A 697 -10.466 5.771 -18.699 1.00 0.00 H new ATOM 0 HB3 ASN A 697 -10.736 6.240 -20.366 1.00 0.00 H new ATOM 0 HD21 ASN A 697 -8.835 3.223 -21.553 1.00 0.00 H new ATOM 0 HD22 ASN A 697 -8.636 4.973 -21.690 1.00 0.00 H new ATOM 2018 N ASP A 698 -9.068 7.956 -17.719 1.00 0.00 N ATOM 2019 CA ASP A 698 -9.293 9.185 -16.976 1.00 0.00 C ATOM 2020 C ASP A 698 -8.060 9.574 -16.188 1.00 0.00 C ATOM 2021 O ASP A 698 -7.405 8.729 -15.578 1.00 0.00 O ATOM 2022 CB ASP A 698 -10.476 9.025 -16.031 1.00 0.00 C ATOM 2023 CG ASP A 698 -11.563 8.123 -16.589 1.00 0.00 C ATOM 2024 OD1 ASP A 698 -11.265 6.949 -16.891 1.00 0.00 O ATOM 2025 OD2 ASP A 698 -12.713 8.593 -16.724 1.00 0.00 O ATOM 0 H ASP A 698 -8.986 7.122 -17.137 1.00 0.00 H new ATOM 0 HA ASP A 698 -9.512 9.975 -17.694 1.00 0.00 H new ATOM 0 HB2 ASP A 698 -10.124 8.617 -15.083 1.00 0.00 H new ATOM 0 HB3 ASP A 698 -10.900 10.007 -15.818 1.00 0.00 H new ATOM 2030 N THR A 699 -7.769 10.866 -16.171 1.00 0.00 N ATOM 2031 CA THR A 699 -6.646 11.364 -15.422 1.00 0.00 C ATOM 2032 C THR A 699 -7.154 12.226 -14.284 1.00 0.00 C ATOM 2033 O THR A 699 -7.445 13.410 -14.450 1.00 0.00 O ATOM 2034 CB THR A 699 -5.680 12.176 -16.308 1.00 0.00 C ATOM 2035 OG1 THR A 699 -6.167 13.511 -16.485 1.00 0.00 O ATOM 2036 CG2 THR A 699 -5.503 11.516 -17.667 1.00 0.00 C ATOM 0 H THR A 699 -8.299 11.581 -16.669 1.00 0.00 H new ATOM 0 HA THR A 699 -6.090 10.512 -15.031 1.00 0.00 H new ATOM 0 HB THR A 699 -4.713 12.208 -15.805 1.00 0.00 H new ATOM 0 HG1 THR A 699 -6.959 13.647 -15.924 1.00 0.00 H new ATOM 0 HG21 THR A 699 -4.817 12.108 -18.273 1.00 0.00 H new ATOM 0 HG22 THR A 699 -5.097 10.513 -17.534 1.00 0.00 H new ATOM 0 HG23 THR A 699 -6.468 11.453 -18.169 1.00 0.00 H new ATOM 2044 N THR A 700 -7.256 11.606 -13.130 1.00 0.00 N ATOM 2045 CA THR A 700 -7.730 12.284 -11.930 1.00 0.00 C ATOM 2046 C THR A 700 -6.724 13.327 -11.460 1.00 0.00 C ATOM 2047 O THR A 700 -6.050 13.144 -10.446 1.00 0.00 O ATOM 2048 CB THR A 700 -7.995 11.285 -10.787 1.00 0.00 C ATOM 2049 OG1 THR A 700 -8.392 11.988 -9.603 1.00 0.00 O ATOM 2050 CG2 THR A 700 -6.755 10.453 -10.496 1.00 0.00 C ATOM 0 H THR A 700 -7.016 10.625 -12.990 1.00 0.00 H new ATOM 0 HA THR A 700 -8.666 12.777 -12.191 1.00 0.00 H new ATOM 0 HB THR A 700 -8.797 10.616 -11.099 1.00 0.00 H new ATOM 0 HG1 THR A 700 -8.560 11.346 -8.882 1.00 0.00 H new ATOM 0 HG21 THR A 700 -6.967 9.755 -9.686 1.00 0.00 H new ATOM 0 HG22 THR A 700 -6.472 9.896 -11.390 1.00 0.00 H new ATOM 0 HG23 THR A 700 -5.936 11.110 -10.204 1.00 0.00 H new ATOM 2275 N VAL A 715 12.947 2.270 -13.758 1.00 0.00 N ATOM 2276 CA VAL A 715 13.813 1.471 -12.908 1.00 0.00 C ATOM 2277 C VAL A 715 13.019 0.891 -11.747 1.00 0.00 C ATOM 2278 O VAL A 715 12.126 1.544 -11.208 1.00 0.00 O ATOM 2279 CB VAL A 715 14.984 2.300 -12.353 1.00 0.00 C ATOM 2280 CG1 VAL A 715 16.041 2.520 -13.426 1.00 0.00 C ATOM 2281 CG2 VAL A 715 14.488 3.628 -11.801 1.00 0.00 C ATOM 0 HA VAL A 715 14.219 0.666 -13.521 1.00 0.00 H new ATOM 0 HB VAL A 715 15.441 1.743 -11.535 1.00 0.00 H new ATOM 0 HG11 VAL A 715 16.861 3.108 -13.014 1.00 0.00 H new ATOM 0 HG12 VAL A 715 16.421 1.556 -13.766 1.00 0.00 H new ATOM 0 HG13 VAL A 715 15.599 3.053 -14.268 1.00 0.00 H new ATOM 0 HG21 VAL A 715 15.332 4.199 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL A 715 14.002 4.194 -12.596 1.00 0.00 H new ATOM 0 HG23 VAL A 715 13.775 3.444 -10.998 1.00 0.00 H new ATOM 2291 N VAL A 716 13.339 -0.339 -11.371 1.00 0.00 N ATOM 2292 CA VAL A 716 12.639 -0.997 -10.279 1.00 0.00 C ATOM 2293 C VAL A 716 13.126 -0.482 -8.928 1.00 0.00 C ATOM 2294 O VAL A 716 14.318 -0.535 -8.626 1.00 0.00 O ATOM 2295 CB VAL A 716 12.817 -2.528 -10.337 1.00 0.00 C ATOM 2296 CG1 VAL A 716 12.123 -3.199 -9.158 1.00 0.00 C ATOM 2297 CG2 VAL A 716 12.290 -3.074 -11.657 1.00 0.00 C ATOM 0 H VAL A 716 14.074 -0.898 -11.803 1.00 0.00 H new ATOM 0 HA VAL A 716 11.580 -0.763 -10.391 1.00 0.00 H new ATOM 0 HB VAL A 716 13.882 -2.753 -10.272 1.00 0.00 H new ATOM 0 HG11 VAL A 716 12.262 -4.278 -9.220 1.00 0.00 H new ATOM 0 HG12 VAL A 716 12.552 -2.831 -8.226 1.00 0.00 H new ATOM 0 HG13 VAL A 716 11.058 -2.968 -9.183 1.00 0.00 H new ATOM 0 HG21 VAL A 716 12.423 -4.156 -11.682 1.00 0.00 H new ATOM 0 HG22 VAL A 716 11.231 -2.836 -11.752 1.00 0.00 H new ATOM 0 HG23 VAL A 716 12.839 -2.622 -12.483 1.00 0.00 H new ATOM 2307 N LEU A 717 12.196 0.016 -8.119 1.00 0.00 N ATOM 2308 CA LEU A 717 12.532 0.540 -6.800 1.00 0.00 C ATOM 2309 C LEU A 717 12.159 -0.457 -5.708 1.00 0.00 C ATOM 2310 O LEU A 717 11.464 -1.440 -5.963 1.00 0.00 O ATOM 2311 CB LEU A 717 11.811 1.869 -6.556 1.00 0.00 C ATOM 2312 CG LEU A 717 11.769 2.818 -7.757 1.00 0.00 C ATOM 2313 CD1 LEU A 717 10.441 3.559 -7.808 1.00 0.00 C ATOM 2314 CD2 LEU A 717 12.928 3.801 -7.698 1.00 0.00 C ATOM 0 H LEU A 717 11.205 0.068 -8.354 1.00 0.00 H new ATOM 0 HA LEU A 717 13.609 0.705 -6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 717 10.788 1.657 -6.245 1.00 0.00 H new ATOM 0 HB3 LEU A 717 12.297 2.381 -5.726 1.00 0.00 H new ATOM 0 HG LEU A 717 11.865 2.226 -8.667 1.00 0.00 H new ATOM 0 HD11 LEU A 717 10.431 4.228 -8.668 1.00 0.00 H new ATOM 0 HD12 LEU A 717 9.626 2.840 -7.898 1.00 0.00 H new ATOM 0 HD13 LEU A 717 10.313 4.140 -6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 717 12.883 4.468 -8.559 1.00 0.00 H new ATOM 0 HD22 LEU A 717 12.862 4.387 -6.781 1.00 0.00 H new ATOM 0 HD23 LEU A 717 13.870 3.254 -7.712 1.00 0.00 H new ATOM 2326 N LYS A 718 12.623 -0.196 -4.490 1.00 0.00 N ATOM 2327 CA LYS A 718 12.332 -1.070 -3.358 1.00 0.00 C ATOM 2328 C LYS A 718 11.256 -0.455 -2.466 1.00 0.00 C ATOM 2329 O LYS A 718 11.316 0.729 -2.135 1.00 0.00 O ATOM 2330 CB LYS A 718 13.604 -1.330 -2.546 1.00 0.00 C ATOM 2331 CG LYS A 718 14.234 -2.687 -2.822 1.00 0.00 C ATOM 2332 CD LYS A 718 14.662 -3.376 -1.536 1.00 0.00 C ATOM 2333 CE LYS A 718 15.814 -4.339 -1.773 1.00 0.00 C ATOM 2334 NZ LYS A 718 15.366 -5.759 -1.748 1.00 0.00 N ATOM 0 H LYS A 718 13.201 0.612 -4.261 1.00 0.00 H new ATOM 0 HA LYS A 718 11.961 -2.019 -3.745 1.00 0.00 H new ATOM 0 HB2 LYS A 718 14.332 -0.549 -2.766 1.00 0.00 H new ATOM 0 HB3 LYS A 718 13.369 -1.257 -1.484 1.00 0.00 H new ATOM 0 HG2 LYS A 718 13.522 -3.318 -3.354 1.00 0.00 H new ATOM 0 HG3 LYS A 718 15.099 -2.562 -3.474 1.00 0.00 H new ATOM 0 HD2 LYS A 718 14.959 -2.626 -0.802 1.00 0.00 H new ATOM 0 HD3 LYS A 718 13.816 -3.917 -1.114 1.00 0.00 H new ATOM 0 HE2 LYS A 718 16.277 -4.121 -2.736 1.00 0.00 H new ATOM 0 HE3 LYS A 718 16.578 -4.186 -1.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 16.181 -6.383 -1.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 14.947 -5.975 -0.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 14.656 -5.912 -2.492 1.00 0.00 H new ATOM 2348 N GLN A 719 10.272 -1.264 -2.085 1.00 0.00 N ATOM 2349 CA GLN A 719 9.185 -0.792 -1.236 1.00 0.00 C ATOM 2350 C GLN A 719 9.602 -0.776 0.233 1.00 0.00 C ATOM 2351 O GLN A 719 10.558 -1.444 0.625 1.00 0.00 O ATOM 2352 CB GLN A 719 7.937 -1.665 -1.425 1.00 0.00 C ATOM 2353 CG GLN A 719 7.973 -2.980 -0.657 1.00 0.00 C ATOM 2354 CD GLN A 719 6.675 -3.754 -0.768 1.00 0.00 C ATOM 2355 OE1 GLN A 719 6.086 -4.148 0.237 1.00 0.00 O ATOM 2356 NE2 GLN A 719 6.223 -3.977 -1.997 1.00 0.00 N ATOM 0 H GLN A 719 10.206 -2.247 -2.350 1.00 0.00 H new ATOM 0 HA GLN A 719 8.947 0.229 -1.533 1.00 0.00 H new ATOM 0 HB2 GLN A 719 7.060 -1.098 -1.112 1.00 0.00 H new ATOM 0 HB3 GLN A 719 7.815 -1.880 -2.487 1.00 0.00 H new ATOM 0 HG2 GLN A 719 8.791 -3.594 -1.033 1.00 0.00 H new ATOM 0 HG3 GLN A 719 8.183 -2.778 0.393 1.00 0.00 H new ATOM 0 HE21 GLN A 719 6.744 -3.631 -2.803 1.00 0.00 H new ATOM 0 HE22 GLN A 719 5.354 -4.494 -2.135 1.00 0.00 H new ATOM 2365 N THR A 720 8.876 -0.008 1.036 1.00 0.00 N ATOM 2366 CA THR A 720 9.163 0.100 2.461 1.00 0.00 C ATOM 2367 C THR A 720 7.931 -0.239 3.293 1.00 0.00 C ATOM 2368 O THR A 720 6.909 -0.665 2.756 1.00 0.00 O ATOM 2369 CB THR A 720 9.652 1.515 2.826 1.00 0.00 C ATOM 2370 OG1 THR A 720 8.965 2.490 2.033 1.00 0.00 O ATOM 2371 CG2 THR A 720 11.152 1.643 2.606 1.00 0.00 C ATOM 0 H THR A 720 8.082 0.551 0.723 1.00 0.00 H new ATOM 0 HA THR A 720 9.954 -0.615 2.685 1.00 0.00 H new ATOM 0 HB THR A 720 9.439 1.688 3.881 1.00 0.00 H new ATOM 0 HG1 THR A 720 9.280 3.387 2.272 1.00 0.00 H new ATOM 0 HG21 THR A 720 11.474 2.650 2.870 1.00 0.00 H new ATOM 0 HG22 THR A 720 11.675 0.919 3.231 1.00 0.00 H new ATOM 0 HG23 THR A 720 11.384 1.451 1.558 1.00 0.00 H new ATOM 2379 N ALA A 721 8.032 -0.048 4.606 1.00 0.00 N ATOM 2380 CA ALA A 721 6.920 -0.337 5.505 1.00 0.00 C ATOM 2381 C ALA A 721 5.649 0.370 5.046 1.00 0.00 C ATOM 2382 O ALA A 721 4.541 -0.107 5.288 1.00 0.00 O ATOM 2383 CB ALA A 721 7.273 0.070 6.928 1.00 0.00 C ATOM 0 H ALA A 721 8.870 0.304 5.069 1.00 0.00 H new ATOM 0 HA ALA A 721 6.734 -1.411 5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 721 6.434 -0.151 7.588 1.00 0.00 H new ATOM 0 HB2 ALA A 721 8.151 -0.485 7.258 1.00 0.00 H new ATOM 0 HB3 ALA A 721 7.487 1.138 6.958 1.00 0.00 H new ATOM 2389 N GLU A 722 5.817 1.506 4.376 1.00 0.00 N ATOM 2390 CA GLU A 722 4.682 2.272 3.875 1.00 0.00 C ATOM 2391 C GLU A 722 3.847 1.428 2.917 1.00 0.00 C ATOM 2392 O GLU A 722 2.627 1.338 3.053 1.00 0.00 O ATOM 2393 CB GLU A 722 5.165 3.540 3.170 1.00 0.00 C ATOM 2394 CG GLU A 722 6.072 4.407 4.028 1.00 0.00 C ATOM 2395 CD GLU A 722 5.387 4.899 5.287 1.00 0.00 C ATOM 2396 OE1 GLU A 722 4.157 5.115 5.247 1.00 0.00 O ATOM 2397 OE2 GLU A 722 6.078 5.068 6.312 1.00 0.00 O ATOM 0 H GLU A 722 6.728 1.916 4.168 1.00 0.00 H new ATOM 0 HA GLU A 722 4.059 2.556 4.723 1.00 0.00 H new ATOM 0 HB2 GLU A 722 5.698 3.260 2.261 1.00 0.00 H new ATOM 0 HB3 GLU A 722 4.299 4.127 2.863 1.00 0.00 H new ATOM 0 HG2 GLU A 722 6.961 3.838 4.301 1.00 0.00 H new ATOM 0 HG3 GLU A 722 6.409 5.263 3.444 1.00 0.00 H new ATOM 2404 N GLU A 723 4.518 0.804 1.953 1.00 0.00 N ATOM 2405 CA GLU A 723 3.841 -0.042 0.977 1.00 0.00 C ATOM 2406 C GLU A 723 3.271 -1.284 1.652 1.00 0.00 C ATOM 2407 O GLU A 723 2.100 -1.623 1.470 1.00 0.00 O ATOM 2408 CB GLU A 723 4.808 -0.447 -0.137 1.00 0.00 C ATOM 2409 CG GLU A 723 5.288 0.722 -0.981 1.00 0.00 C ATOM 2410 CD GLU A 723 4.143 1.533 -1.558 1.00 0.00 C ATOM 2411 OE1 GLU A 723 3.640 1.165 -2.640 1.00 0.00 O ATOM 2412 OE2 GLU A 723 3.751 2.537 -0.927 1.00 0.00 O ATOM 0 H GLU A 723 5.528 0.868 1.827 1.00 0.00 H new ATOM 0 HA GLU A 723 3.020 0.526 0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 723 5.672 -0.943 0.306 1.00 0.00 H new ATOM 0 HB3 GLU A 723 4.319 -1.175 -0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 723 5.917 1.371 -0.372 1.00 0.00 H new ATOM 0 HG3 GLU A 723 5.909 0.347 -1.794 1.00 0.00 H new ATOM 2419 N LYS A 724 4.105 -1.953 2.442 1.00 0.00 N ATOM 2420 CA LYS A 724 3.684 -3.152 3.157 1.00 0.00 C ATOM 2421 C LYS A 724 2.478 -2.854 4.041 1.00 0.00 C ATOM 2422 O LYS A 724 1.618 -3.709 4.249 1.00 0.00 O ATOM 2423 CB LYS A 724 4.835 -3.697 4.006 1.00 0.00 C ATOM 2424 CG LYS A 724 5.994 -4.235 3.183 1.00 0.00 C ATOM 2425 CD LYS A 724 7.158 -4.654 4.065 1.00 0.00 C ATOM 2426 CE LYS A 724 6.818 -5.886 4.890 1.00 0.00 C ATOM 2427 NZ LYS A 724 6.732 -7.112 4.048 1.00 0.00 N ATOM 0 H LYS A 724 5.076 -1.685 2.603 1.00 0.00 H new ATOM 0 HA LYS A 724 3.399 -3.906 2.423 1.00 0.00 H new ATOM 0 HB2 LYS A 724 5.201 -2.905 4.659 1.00 0.00 H new ATOM 0 HB3 LYS A 724 4.457 -4.492 4.649 1.00 0.00 H new ATOM 0 HG2 LYS A 724 5.658 -5.088 2.594 1.00 0.00 H new ATOM 0 HG3 LYS A 724 6.326 -3.472 2.479 1.00 0.00 H new ATOM 0 HD2 LYS A 724 8.030 -4.860 3.444 1.00 0.00 H new ATOM 0 HD3 LYS A 724 7.426 -3.833 4.729 1.00 0.00 H new ATOM 0 HE2 LYS A 724 7.576 -6.027 5.661 1.00 0.00 H new ATOM 0 HE3 LYS A 724 5.868 -5.730 5.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 724 6.668 -7.950 4.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 724 5.887 -7.059 3.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 724 7.581 -7.184 3.451 1.00 0.00 H new ATOM 2441 N ASP A 725 2.424 -1.631 4.558 1.00 0.00 N ATOM 2442 CA ASP A 725 1.324 -1.211 5.418 1.00 0.00 C ATOM 2443 C ASP A 725 0.009 -1.178 4.645 1.00 0.00 C ATOM 2444 O ASP A 725 -1.045 -1.513 5.183 1.00 0.00 O ATOM 2445 CB ASP A 725 1.612 0.166 6.018 1.00 0.00 C ATOM 2446 CG ASP A 725 0.664 0.513 7.150 1.00 0.00 C ATOM 2447 OD1 ASP A 725 0.976 0.175 8.311 1.00 0.00 O ATOM 2448 OD2 ASP A 725 -0.391 1.123 6.875 1.00 0.00 O ATOM 0 H ASP A 725 3.130 -0.913 4.396 1.00 0.00 H new ATOM 0 HA ASP A 725 1.231 -1.938 6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 725 2.638 0.192 6.386 1.00 0.00 H new ATOM 0 HB3 ASP A 725 1.534 0.923 5.238 1.00 0.00 H new ATOM 2453 N LEU A 726 0.079 -0.773 3.379 1.00 0.00 N ATOM 2454 CA LEU A 726 -1.112 -0.700 2.536 1.00 0.00 C ATOM 2455 C LEU A 726 -1.765 -2.070 2.412 1.00 0.00 C ATOM 2456 O LEU A 726 -2.981 -2.205 2.542 1.00 0.00 O ATOM 2457 CB LEU A 726 -0.757 -0.176 1.143 1.00 0.00 C ATOM 2458 CG LEU A 726 0.335 0.895 1.102 1.00 0.00 C ATOM 2459 CD1 LEU A 726 0.532 1.397 -0.319 1.00 0.00 C ATOM 2460 CD2 LEU A 726 -0.014 2.043 2.036 1.00 0.00 C ATOM 0 H LEU A 726 0.943 -0.492 2.916 1.00 0.00 H new ATOM 0 HA LEU A 726 -1.814 -0.011 3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -0.440 -1.017 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -1.659 0.231 0.686 1.00 0.00 H new ATOM 0 HG LEU A 726 1.271 0.451 1.440 1.00 0.00 H new ATOM 0 HD11 LEU A 726 1.312 2.158 -0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 726 0.826 0.566 -0.961 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -0.400 1.827 -0.686 1.00 0.00 H new ATOM 0 HD21 LEU A 726 0.772 2.797 1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -0.960 2.488 1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -0.105 1.668 3.055 1.00 0.00 H new ATOM 2472 N VAL A 727 -0.944 -3.084 2.170 1.00 0.00 N ATOM 2473 CA VAL A 727 -1.434 -4.449 2.039 1.00 0.00 C ATOM 2474 C VAL A 727 -1.811 -5.017 3.402 1.00 0.00 C ATOM 2475 O VAL A 727 -2.697 -5.864 3.511 1.00 0.00 O ATOM 2476 CB VAL A 727 -0.382 -5.363 1.380 1.00 0.00 C ATOM 2477 CG1 VAL A 727 0.925 -5.319 2.155 1.00 0.00 C ATOM 2478 CG2 VAL A 727 -0.900 -6.791 1.278 1.00 0.00 C ATOM 0 H VAL A 727 0.065 -2.986 2.060 1.00 0.00 H new ATOM 0 HA VAL A 727 -2.317 -4.417 1.401 1.00 0.00 H new ATOM 0 HB VAL A 727 -0.193 -4.997 0.371 1.00 0.00 H new ATOM 0 HG11 VAL A 727 1.655 -5.970 1.675 1.00 0.00 H new ATOM 0 HG12 VAL A 727 1.305 -4.297 2.170 1.00 0.00 H new ATOM 0 HG13 VAL A 727 0.754 -5.658 3.177 1.00 0.00 H new ATOM 0 HG21 VAL A 727 -0.143 -7.420 0.810 1.00 0.00 H new ATOM 0 HG22 VAL A 727 -1.121 -7.170 2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 727 -1.808 -6.807 0.675 1.00 0.00 H new ATOM 2488 N LYS A 728 -1.132 -4.544 4.443 1.00 0.00 N ATOM 2489 CA LYS A 728 -1.397 -5.004 5.802 1.00 0.00 C ATOM 2490 C LYS A 728 -2.889 -4.940 6.120 1.00 0.00 C ATOM 2491 O LYS A 728 -3.398 -5.723 6.922 1.00 0.00 O ATOM 2492 CB LYS A 728 -0.609 -4.165 6.809 1.00 0.00 C ATOM 2493 CG LYS A 728 0.417 -4.968 7.589 1.00 0.00 C ATOM 2494 CD LYS A 728 -0.232 -5.772 8.703 1.00 0.00 C ATOM 2495 CE LYS A 728 -0.796 -4.867 9.787 1.00 0.00 C ATOM 2496 NZ LYS A 728 -1.218 -5.637 10.989 1.00 0.00 N ATOM 0 H LYS A 728 -0.395 -3.843 4.371 1.00 0.00 H new ATOM 0 HA LYS A 728 -1.076 -6.043 5.876 1.00 0.00 H new ATOM 0 HB2 LYS A 728 -0.102 -3.357 6.281 1.00 0.00 H new ATOM 0 HB3 LYS A 728 -1.305 -3.701 7.508 1.00 0.00 H new ATOM 0 HG2 LYS A 728 0.944 -5.641 6.913 1.00 0.00 H new ATOM 0 HG3 LYS A 728 1.162 -4.294 8.012 1.00 0.00 H new ATOM 0 HD2 LYS A 728 -1.030 -6.389 8.290 1.00 0.00 H new ATOM 0 HD3 LYS A 728 0.502 -6.450 9.139 1.00 0.00 H new ATOM 0 HE2 LYS A 728 -0.044 -4.131 10.073 1.00 0.00 H new ATOM 0 HE3 LYS A 728 -1.649 -4.315 9.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 728 -1.597 -4.984 11.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 728 -1.953 -6.322 10.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 728 -0.399 -6.144 11.382 1.00 0.00 H new