USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 924 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 739 THR OG1 : rot 102:sc= -0.247 USER MOD Set 1.2: A 740 GLN :FLIP amide:sc= 0.51 F(o=-1.6,f=0.26) USER MOD Set 2.1: A 711 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 735 HIS :FLIP no HD1:sc= -0.232 F(o=-1.8,f=-0.23) USER MOD Set 3.1: A 652 SER OG : rot -36:sc= 0.256 USER MOD Set 3.2: A 672 GLN : amide:sc= -0.225 X(o=0.031,f=0.31) USER MOD Single : A 628 GLN : amide:sc= -3.84! C(o=-3.8!,f=-9.4!) USER MOD Single : A 629 SER OG : rot 180:sc= 0 USER MOD Single : A 638 ASN :FLIP amide:sc= -0.677 F(o=-2.1!,f=-0.68) USER MOD Single : A 640 ASN : amide:sc= -0.665 K(o=-0.66,f=-2.6!) USER MOD Single : A 642 LYS NZ :NH3+ -155:sc= 1.71 (180deg=1.5) USER MOD Single : A 644 LYS NZ :NH3+ -161:sc= -0.0428 (180deg=-0.339) USER MOD Single : A 645 THR OG1 : rot 180:sc= 0.0404 USER MOD Single : A 646 LYS NZ :NH3+ 177:sc= 1.25 (180deg=1.09) USER MOD Single : A 649 TYR OH : rot 180:sc= -0.219 USER MOD Single : A 651 HIS : no HD1:sc= -0.265 X(o=-0.27,f=-0.004) USER MOD Single : A 657 TYR OH : rot -142:sc= 0.91 USER MOD Single : A 658 TYR OH : rot 180:sc=-0.00258 USER MOD Single : A 660 ASN : amide:sc= -0.838 K(o=-0.84,f=-4.4!) USER MOD Single : A 665 MET CE :methyl -122:sc= -3.37! (180deg=-6.65!) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 669 ASN :FLIP amide:sc= -0.199 F(o=-0.88,f=-0.2) USER MOD Single : A 670 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 679 THR OG1 : rot 80:sc= 0.935 USER MOD Single : A 680 THR OG1 : rot 180:sc= 0 USER MOD Single : A 689 SER OG : rot 61:sc= 0.117 USER MOD Single : A 690 THR OG1 : rot 180:sc= 0 USER MOD Single : A 699 HIS : no HD1:sc= -0.0306 X(o=-0.031,f=-0.031) USER MOD Single : A 703 GLN :FLIP amide:sc= -2.61! C(o=-4!,f=-2.6!) USER MOD Single : A 705 SER OG : rot 180:sc= 0 USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 709 TYR OH : rot 180:sc= -1.4 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 714 SER OG : rot 180:sc= 0 USER MOD Single : A 718 ASN : amide:sc= 0.726 K(o=0.73,f=-0.6) USER MOD Single : A 720 SER OG : rot 180:sc= 0 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 724 THR OG1 : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl -139:sc= -2.72 (180deg=-4.55!) USER MOD Single : A 728 HIS : no HD1:sc= -0.202 X(o=-0.2,f=-0.068) USER MOD Single : A 730 SER OG : rot 120:sc= -1.7 USER MOD Single : A 732 THR OG1 : rot 180:sc= 0 USER MOD Single : A 743 GLN :FLIP amide:sc= -0.438 F(o=-2.7!,f=-0.44) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 621 30.093 -15.677 -17.226 1.00 0.00 N ATOM 2 CA GLU A 621 28.991 -16.214 -16.440 1.00 0.00 C ATOM 3 C GLU A 621 27.798 -15.261 -16.704 1.00 0.00 C ATOM 4 O GLU A 621 27.772 -14.608 -17.758 1.00 0.00 O ATOM 5 CB GLU A 621 29.442 -16.223 -14.959 1.00 0.00 C ATOM 6 CG GLU A 621 28.928 -17.386 -14.098 1.00 0.00 C ATOM 7 CD GLU A 621 27.447 -17.386 -13.916 1.00 0.00 C ATOM 8 OE1 GLU A 621 26.936 -16.451 -13.290 1.00 0.00 O ATOM 9 OE2 GLU A 621 26.762 -18.291 -14.419 1.00 0.00 O ATOM 0 HA GLU A 621 28.701 -17.233 -16.697 1.00 0.00 H new ATOM 0 HB2 GLU A 621 30.532 -16.234 -14.933 1.00 0.00 H new ATOM 0 HB3 GLU A 621 29.122 -15.289 -14.498 1.00 0.00 H new ATOM 0 HG2 GLU A 621 29.229 -18.328 -14.557 1.00 0.00 H new ATOM 0 HG3 GLU A 621 29.406 -17.341 -13.119 1.00 0.00 H new ATOM 18 N ALA A 622 26.823 -15.170 -15.801 1.00 0.00 N ATOM 19 CA ALA A 622 25.701 -14.254 -15.974 1.00 0.00 C ATOM 20 C ALA A 622 26.186 -12.821 -15.791 1.00 0.00 C ATOM 21 O ALA A 622 25.577 -11.871 -16.296 1.00 0.00 O ATOM 22 CB ALA A 622 24.589 -14.580 -14.984 1.00 0.00 C ATOM 0 H ALA A 622 26.789 -15.720 -14.943 1.00 0.00 H new ATOM 0 HA ALA A 622 25.296 -14.366 -16.980 1.00 0.00 H new ATOM 0 HB1 ALA A 622 23.760 -13.887 -15.127 1.00 0.00 H new ATOM 0 HB2 ALA A 622 24.242 -15.600 -15.149 1.00 0.00 H new ATOM 0 HB3 ALA A 622 24.969 -14.486 -13.967 1.00 0.00 H new ATOM 28 N GLU A 623 27.300 -12.704 -15.070 1.00 0.00 N ATOM 29 CA GLU A 623 28.016 -11.473 -14.802 1.00 0.00 C ATOM 30 C GLU A 623 27.273 -10.619 -13.814 1.00 0.00 C ATOM 31 O GLU A 623 26.396 -9.820 -14.166 1.00 0.00 O ATOM 32 CB GLU A 623 28.376 -10.684 -16.081 1.00 0.00 C ATOM 33 CG GLU A 623 29.091 -11.509 -17.146 1.00 0.00 C ATOM 34 CD GLU A 623 30.352 -12.174 -16.657 1.00 0.00 C ATOM 35 OE1 GLU A 623 30.279 -13.253 -16.040 1.00 0.00 O ATOM 36 OE2 GLU A 623 31.449 -11.656 -16.916 1.00 0.00 O ATOM 0 H GLU A 623 27.745 -13.513 -14.637 1.00 0.00 H new ATOM 0 HA GLU A 623 28.967 -11.762 -14.355 1.00 0.00 H new ATOM 0 HB2 GLU A 623 27.462 -10.273 -16.509 1.00 0.00 H new ATOM 0 HB3 GLU A 623 29.008 -9.839 -15.807 1.00 0.00 H new ATOM 0 HG2 GLU A 623 28.409 -12.274 -17.518 1.00 0.00 H new ATOM 0 HG3 GLU A 623 29.336 -10.863 -17.989 1.00 0.00 H new ATOM 43 N ALA A 624 27.561 -10.846 -12.565 1.00 0.00 N ATOM 44 CA ALA A 624 26.985 -10.064 -11.504 1.00 0.00 C ATOM 45 C ALA A 624 27.766 -8.782 -11.380 1.00 0.00 C ATOM 46 O ALA A 624 27.250 -7.772 -10.882 1.00 0.00 O ATOM 47 CB ALA A 624 27.019 -10.828 -10.189 1.00 0.00 C ATOM 0 H ALA A 624 28.200 -11.576 -12.251 1.00 0.00 H new ATOM 0 HA ALA A 624 25.942 -9.848 -11.736 1.00 0.00 H new ATOM 0 HB1 ALA A 624 26.578 -10.217 -9.402 1.00 0.00 H new ATOM 0 HB2 ALA A 624 26.452 -11.753 -10.291 1.00 0.00 H new ATOM 0 HB3 ALA A 624 28.052 -11.062 -9.931 1.00 0.00 H new ATOM 53 N ALA A 625 29.030 -8.854 -11.833 1.00 0.00 N ATOM 54 CA ALA A 625 30.017 -7.769 -11.840 1.00 0.00 C ATOM 55 C ALA A 625 30.607 -7.596 -10.480 1.00 0.00 C ATOM 56 O ALA A 625 31.817 -7.690 -10.273 1.00 0.00 O ATOM 57 CB ALA A 625 29.472 -6.465 -12.413 1.00 0.00 C ATOM 0 H ALA A 625 29.407 -9.718 -12.224 1.00 0.00 H new ATOM 0 HA ALA A 625 30.817 -8.060 -12.521 1.00 0.00 H new ATOM 0 HB1 ALA A 625 30.251 -5.703 -12.390 1.00 0.00 H new ATOM 0 HB2 ALA A 625 29.152 -6.626 -13.443 1.00 0.00 H new ATOM 0 HB3 ALA A 625 28.622 -6.133 -11.817 1.00 0.00 H new ATOM 63 N GLY A 626 29.755 -7.433 -9.579 1.00 0.00 N ATOM 64 CA GLY A 626 30.075 -7.308 -8.227 1.00 0.00 C ATOM 65 C GLY A 626 29.063 -8.056 -7.436 1.00 0.00 C ATOM 66 O GLY A 626 27.951 -8.310 -7.924 1.00 0.00 O ATOM 0 H GLY A 626 28.754 -7.379 -9.766 1.00 0.00 H new ATOM 0 HA2 GLY A 626 31.073 -7.702 -8.035 1.00 0.00 H new ATOM 0 HA3 GLY A 626 30.085 -6.258 -7.935 1.00 0.00 H new ATOM 70 N VAL A 627 29.409 -8.378 -6.252 1.00 0.00 N ATOM 71 CA VAL A 627 28.595 -9.144 -5.364 1.00 0.00 C ATOM 72 C VAL A 627 29.246 -9.238 -3.992 1.00 0.00 C ATOM 73 O VAL A 627 29.983 -10.174 -3.658 1.00 0.00 O ATOM 74 CB VAL A 627 28.173 -10.547 -5.925 1.00 0.00 C ATOM 75 CG1 VAL A 627 29.367 -11.374 -6.369 1.00 0.00 C ATOM 76 CG2 VAL A 627 27.347 -11.295 -4.907 1.00 0.00 C ATOM 0 H VAL A 627 30.305 -8.108 -5.846 1.00 0.00 H new ATOM 0 HA VAL A 627 27.654 -8.603 -5.263 1.00 0.00 H new ATOM 0 HB VAL A 627 27.564 -10.372 -6.812 1.00 0.00 H new ATOM 0 HG11 VAL A 627 29.022 -12.336 -6.749 1.00 0.00 H new ATOM 0 HG12 VAL A 627 29.904 -10.844 -7.156 1.00 0.00 H new ATOM 0 HG13 VAL A 627 30.033 -11.536 -5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 627 27.062 -12.266 -5.312 1.00 0.00 H new ATOM 0 HG22 VAL A 627 27.932 -11.438 -3.998 1.00 0.00 H new ATOM 0 HG23 VAL A 627 26.450 -10.722 -4.675 1.00 0.00 H new ATOM 86 N GLN A 628 29.035 -8.219 -3.251 1.00 0.00 N ATOM 87 CA GLN A 628 29.512 -8.121 -1.908 1.00 0.00 C ATOM 88 C GLN A 628 28.615 -8.909 -0.961 1.00 0.00 C ATOM 89 O GLN A 628 28.835 -10.111 -0.773 1.00 0.00 O ATOM 90 CB GLN A 628 29.686 -6.646 -1.479 1.00 0.00 C ATOM 91 CG GLN A 628 28.891 -5.637 -2.292 1.00 0.00 C ATOM 92 CD GLN A 628 27.395 -5.807 -2.261 1.00 0.00 C ATOM 93 OE1 GLN A 628 26.819 -6.499 -3.103 1.00 0.00 O ATOM 94 NE2 GLN A 628 26.770 -5.208 -1.301 1.00 0.00 N ATOM 0 H GLN A 628 28.511 -7.401 -3.562 1.00 0.00 H new ATOM 0 HA GLN A 628 30.503 -8.572 -1.858 1.00 0.00 H new ATOM 0 HB2 GLN A 628 29.398 -6.553 -0.432 1.00 0.00 H new ATOM 0 HB3 GLN A 628 30.743 -6.388 -1.543 1.00 0.00 H new ATOM 0 HG2 GLN A 628 29.132 -4.637 -1.932 1.00 0.00 H new ATOM 0 HG3 GLN A 628 29.223 -5.691 -3.329 1.00 0.00 H new ATOM 0 HE21 GLN A 628 27.289 -4.646 -0.627 1.00 0.00 H new ATOM 0 HE22 GLN A 628 25.757 -5.298 -1.217 1.00 0.00 H new ATOM 103 N SER A 629 27.573 -8.258 -0.459 1.00 0.00 N ATOM 104 CA SER A 629 26.605 -8.831 0.457 1.00 0.00 C ATOM 105 C SER A 629 25.766 -7.708 1.029 1.00 0.00 C ATOM 106 O SER A 629 26.284 -6.636 1.344 1.00 0.00 O ATOM 107 CB SER A 629 27.284 -9.579 1.632 1.00 0.00 C ATOM 108 OG SER A 629 26.329 -10.198 2.493 1.00 0.00 O ATOM 0 H SER A 629 27.375 -7.284 -0.689 1.00 0.00 H new ATOM 0 HA SER A 629 26.000 -9.549 -0.097 1.00 0.00 H new ATOM 0 HB2 SER A 629 27.961 -10.336 1.237 1.00 0.00 H new ATOM 0 HB3 SER A 629 27.890 -8.878 2.206 1.00 0.00 H new ATOM 0 HG SER A 629 26.796 -10.661 3.220 1.00 0.00 H new ATOM 114 N CYS A 630 24.499 -7.932 1.121 1.00 0.00 N ATOM 115 CA CYS A 630 23.606 -7.014 1.774 1.00 0.00 C ATOM 116 C CYS A 630 22.756 -7.822 2.708 1.00 0.00 C ATOM 117 O CYS A 630 22.305 -8.940 2.336 1.00 0.00 O ATOM 118 CB CYS A 630 22.695 -6.279 0.782 1.00 0.00 C ATOM 119 SG CYS A 630 23.546 -5.320 -0.511 1.00 0.00 S ATOM 0 H CYS A 630 24.042 -8.763 0.744 1.00 0.00 H new ATOM 0 HA CYS A 630 24.192 -6.255 2.293 1.00 0.00 H new ATOM 0 HB2 CYS A 630 22.049 -7.012 0.299 1.00 0.00 H new ATOM 0 HB3 CYS A 630 22.048 -5.604 1.343 1.00 0.00 H new ATOM 124 N GLY A 631 22.568 -7.330 3.899 1.00 0.00 N ATOM 125 CA GLY A 631 21.738 -7.990 4.828 1.00 0.00 C ATOM 126 C GLY A 631 20.370 -7.370 4.822 1.00 0.00 C ATOM 127 O GLY A 631 19.810 -7.135 3.757 1.00 0.00 O ATOM 0 H GLY A 631 22.989 -6.465 4.239 1.00 0.00 H new ATOM 0 HA2 GLY A 631 21.668 -9.049 4.578 1.00 0.00 H new ATOM 0 HA3 GLY A 631 22.172 -7.926 5.826 1.00 0.00 H new ATOM 131 N PRO A 632 19.816 -7.074 5.983 1.00 0.00 N ATOM 132 CA PRO A 632 18.490 -6.478 6.099 1.00 0.00 C ATOM 133 C PRO A 632 18.430 -5.084 5.453 1.00 0.00 C ATOM 134 O PRO A 632 19.339 -4.273 5.639 1.00 0.00 O ATOM 135 CB PRO A 632 18.274 -6.380 7.611 1.00 0.00 C ATOM 136 CG PRO A 632 19.275 -7.296 8.211 1.00 0.00 C ATOM 137 CD PRO A 632 20.448 -7.267 7.293 1.00 0.00 C ATOM 0 HA PRO A 632 17.727 -7.066 5.588 1.00 0.00 H new ATOM 0 HB2 PRO A 632 18.416 -5.358 7.963 1.00 0.00 H new ATOM 0 HB3 PRO A 632 17.260 -6.673 7.883 1.00 0.00 H new ATOM 0 HG2 PRO A 632 19.554 -6.970 9.213 1.00 0.00 H new ATOM 0 HG3 PRO A 632 18.876 -8.306 8.304 1.00 0.00 H new ATOM 0 HD2 PRO A 632 21.135 -6.456 7.536 1.00 0.00 H new ATOM 0 HD3 PRO A 632 21.021 -8.194 7.336 1.00 0.00 H new ATOM 145 N PRO A 633 17.363 -4.799 4.687 1.00 0.00 N ATOM 146 CA PRO A 633 17.196 -3.519 3.973 1.00 0.00 C ATOM 147 C PRO A 633 17.166 -2.295 4.908 1.00 0.00 C ATOM 148 O PRO A 633 16.862 -2.420 6.104 1.00 0.00 O ATOM 149 CB PRO A 633 15.828 -3.677 3.286 1.00 0.00 C ATOM 150 CG PRO A 633 15.145 -4.751 4.048 1.00 0.00 C ATOM 151 CD PRO A 633 16.227 -5.694 4.444 1.00 0.00 C ATOM 0 HA PRO A 633 18.031 -3.334 3.297 1.00 0.00 H new ATOM 0 HB2 PRO A 633 15.260 -2.747 3.317 1.00 0.00 H new ATOM 0 HB3 PRO A 633 15.941 -3.947 2.236 1.00 0.00 H new ATOM 0 HG2 PRO A 633 14.633 -4.349 4.922 1.00 0.00 H new ATOM 0 HG3 PRO A 633 14.392 -5.249 3.438 1.00 0.00 H new ATOM 0 HD2 PRO A 633 15.962 -6.263 5.335 1.00 0.00 H new ATOM 0 HD3 PRO A 633 16.442 -6.417 3.657 1.00 0.00 H new ATOM 159 N PRO A 634 17.487 -1.110 4.368 1.00 0.00 N ATOM 160 CA PRO A 634 17.464 0.151 5.113 1.00 0.00 C ATOM 161 C PRO A 634 16.035 0.627 5.428 1.00 0.00 C ATOM 162 O PRO A 634 15.070 -0.170 5.434 1.00 0.00 O ATOM 163 CB PRO A 634 18.159 1.141 4.174 1.00 0.00 C ATOM 164 CG PRO A 634 18.049 0.558 2.817 1.00 0.00 C ATOM 165 CD PRO A 634 17.930 -0.923 2.976 1.00 0.00 C ATOM 0 HA PRO A 634 17.950 0.050 6.084 1.00 0.00 H new ATOM 0 HB2 PRO A 634 17.684 2.121 4.218 1.00 0.00 H new ATOM 0 HB3 PRO A 634 19.203 1.280 4.456 1.00 0.00 H new ATOM 0 HG2 PRO A 634 17.180 0.959 2.296 1.00 0.00 H new ATOM 0 HG3 PRO A 634 18.924 0.811 2.218 1.00 0.00 H new ATOM 0 HD2 PRO A 634 17.211 -1.341 2.271 1.00 0.00 H new ATOM 0 HD3 PRO A 634 18.883 -1.420 2.793 1.00 0.00 H new ATOM 173 N GLU A 635 15.892 1.891 5.702 1.00 0.00 N ATOM 174 CA GLU A 635 14.608 2.452 6.056 1.00 0.00 C ATOM 175 C GLU A 635 14.030 3.239 4.884 1.00 0.00 C ATOM 176 O GLU A 635 14.669 3.386 3.849 1.00 0.00 O ATOM 177 CB GLU A 635 14.768 3.404 7.240 1.00 0.00 C ATOM 178 CG GLU A 635 15.545 4.662 6.882 1.00 0.00 C ATOM 179 CD GLU A 635 15.820 5.547 8.054 1.00 0.00 C ATOM 180 OE1 GLU A 635 14.905 6.281 8.496 1.00 0.00 O ATOM 181 OE2 GLU A 635 16.953 5.536 8.548 1.00 0.00 O ATOM 0 H GLU A 635 16.657 2.566 5.688 1.00 0.00 H new ATOM 0 HA GLU A 635 13.938 1.633 6.316 1.00 0.00 H new ATOM 0 HB2 GLU A 635 13.782 3.684 7.611 1.00 0.00 H new ATOM 0 HB3 GLU A 635 15.279 2.885 8.051 1.00 0.00 H new ATOM 0 HG2 GLU A 635 16.491 4.376 6.423 1.00 0.00 H new ATOM 0 HG3 GLU A 635 14.985 5.225 6.135 1.00 0.00 H new ATOM 188 N LEU A 636 12.821 3.706 5.048 1.00 0.00 N ATOM 189 CA LEU A 636 12.245 4.638 4.138 1.00 0.00 C ATOM 190 C LEU A 636 11.976 5.909 4.961 1.00 0.00 C ATOM 191 O LEU A 636 11.644 5.821 6.152 1.00 0.00 O ATOM 192 CB LEU A 636 10.934 4.061 3.529 1.00 0.00 C ATOM 193 CG LEU A 636 10.355 4.684 2.223 1.00 0.00 C ATOM 194 CD1 LEU A 636 9.080 4.054 1.790 1.00 0.00 C ATOM 195 CD2 LEU A 636 10.254 6.171 2.203 1.00 0.00 C ATOM 0 H LEU A 636 12.211 3.444 5.823 1.00 0.00 H new ATOM 0 HA LEU A 636 12.904 4.852 3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 636 11.101 3.001 3.339 1.00 0.00 H new ATOM 0 HB3 LEU A 636 10.161 4.129 4.294 1.00 0.00 H new ATOM 0 HG LEU A 636 11.121 4.443 1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 636 8.730 4.533 0.876 1.00 0.00 H new ATOM 0 HD12 LEU A 636 9.243 2.992 1.604 1.00 0.00 H new ATOM 0 HD13 LEU A 636 8.331 4.174 2.572 1.00 0.00 H new ATOM 0 HD21 LEU A 636 9.839 6.495 1.248 1.00 0.00 H new ATOM 0 HD22 LEU A 636 9.604 6.502 3.012 1.00 0.00 H new ATOM 0 HD23 LEU A 636 11.245 6.605 2.333 1.00 0.00 H new ATOM 207 N LEU A 637 12.199 7.039 4.327 1.00 0.00 N ATOM 208 CA LEU A 637 11.960 8.392 4.816 1.00 0.00 C ATOM 209 C LEU A 637 10.706 8.495 5.701 1.00 0.00 C ATOM 210 O LEU A 637 10.802 8.732 6.889 1.00 0.00 O ATOM 211 CB LEU A 637 11.803 9.285 3.577 1.00 0.00 C ATOM 212 CG LEU A 637 11.419 10.730 3.786 1.00 0.00 C ATOM 213 CD1 LEU A 637 12.440 11.458 4.640 1.00 0.00 C ATOM 214 CD2 LEU A 637 11.260 11.400 2.448 1.00 0.00 C ATOM 0 H LEU A 637 12.582 7.043 3.382 1.00 0.00 H new ATOM 0 HA LEU A 637 12.795 8.701 5.444 1.00 0.00 H new ATOM 0 HB2 LEU A 637 12.746 9.266 3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 637 11.052 8.830 2.931 1.00 0.00 H new ATOM 0 HG LEU A 637 10.471 10.767 4.322 1.00 0.00 H new ATOM 0 HD11 LEU A 637 12.132 12.495 4.770 1.00 0.00 H new ATOM 0 HD12 LEU A 637 12.510 10.975 5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 637 13.413 11.427 4.150 1.00 0.00 H new ATOM 0 HD21 LEU A 637 10.983 12.444 2.594 1.00 0.00 H new ATOM 0 HD22 LEU A 637 12.201 11.348 1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 637 10.481 10.894 1.878 1.00 0.00 H new ATOM 226 N ASN A 638 9.544 8.322 5.116 1.00 0.00 N ATOM 227 CA ASN A 638 8.312 8.403 5.904 1.00 0.00 C ATOM 228 C ASN A 638 7.615 7.070 5.877 1.00 0.00 C ATOM 229 O ASN A 638 6.895 6.686 6.797 1.00 0.00 O ATOM 230 CB ASN A 638 7.373 9.494 5.376 1.00 0.00 C ATOM 231 CG ASN A 638 6.174 9.737 6.300 1.00 0.00 C ATOM 232 OD1 ASN A 638 5.086 9.015 6.103 1.00 0.00 O flip ATOM 233 ND2 ASN A 638 6.232 10.566 7.184 1.00 0.00 N flip ATOM 0 H ASN A 638 9.414 8.128 4.123 1.00 0.00 H new ATOM 0 HA ASN A 638 8.579 8.664 6.928 1.00 0.00 H new ATOM 0 HB2 ASN A 638 7.931 10.423 5.259 1.00 0.00 H new ATOM 0 HB3 ASN A 638 7.013 9.211 4.387 1.00 0.00 H new ATOM 0 HD21 ASN A 638 7.084 11.111 7.317 1.00 0.00 H new ATOM 0 HD22 ASN A 638 5.429 10.717 7.795 1.00 0.00 H new ATOM 240 N GLY A 639 7.798 6.391 4.786 1.00 0.00 N ATOM 241 CA GLY A 639 7.273 5.066 4.618 1.00 0.00 C ATOM 242 C GLY A 639 8.128 4.045 5.326 1.00 0.00 C ATOM 243 O GLY A 639 8.905 4.397 6.227 1.00 0.00 O ATOM 0 H GLY A 639 8.318 6.740 3.981 1.00 0.00 H new ATOM 0 HA2 GLY A 639 6.255 5.024 5.006 1.00 0.00 H new ATOM 0 HA3 GLY A 639 7.219 4.825 3.556 1.00 0.00 H new ATOM 247 N ASN A 640 8.054 2.813 4.895 1.00 0.00 N ATOM 248 CA ASN A 640 8.847 1.758 5.494 1.00 0.00 C ATOM 249 C ASN A 640 8.751 0.519 4.637 1.00 0.00 C ATOM 250 O ASN A 640 8.123 0.546 3.597 1.00 0.00 O ATOM 251 CB ASN A 640 8.406 1.479 6.935 1.00 0.00 C ATOM 252 CG ASN A 640 9.516 0.841 7.748 1.00 0.00 C ATOM 253 OD1 ASN A 640 9.557 -0.369 7.925 1.00 0.00 O ATOM 254 ND2 ASN A 640 10.481 1.631 8.121 1.00 0.00 N ATOM 0 H ASN A 640 7.452 2.509 4.129 1.00 0.00 H new ATOM 0 HA ASN A 640 9.888 2.077 5.541 1.00 0.00 H new ATOM 0 HB2 ASN A 640 8.098 2.411 7.408 1.00 0.00 H new ATOM 0 HB3 ASN A 640 7.536 0.822 6.929 1.00 0.00 H new ATOM 0 HD21 ASN A 640 11.308 1.246 8.578 1.00 0.00 H new ATOM 0 HD22 ASN A 640 10.411 2.635 7.956 1.00 0.00 H new ATOM 261 N VAL A 641 9.354 -0.535 5.062 1.00 0.00 N ATOM 262 CA VAL A 641 9.415 -1.764 4.321 1.00 0.00 C ATOM 263 C VAL A 641 8.392 -2.752 4.878 1.00 0.00 C ATOM 264 O VAL A 641 8.164 -2.807 6.089 1.00 0.00 O ATOM 265 CB VAL A 641 10.861 -2.335 4.375 1.00 0.00 C ATOM 266 CG1 VAL A 641 11.373 -2.310 5.788 1.00 0.00 C ATOM 267 CG2 VAL A 641 10.938 -3.742 3.818 1.00 0.00 C ATOM 0 H VAL A 641 9.835 -0.576 5.960 1.00 0.00 H new ATOM 0 HA VAL A 641 9.167 -1.583 3.275 1.00 0.00 H new ATOM 0 HB VAL A 641 11.488 -1.700 3.749 1.00 0.00 H new ATOM 0 HG11 VAL A 641 12.386 -2.712 5.815 1.00 0.00 H new ATOM 0 HG12 VAL A 641 11.380 -1.283 6.154 1.00 0.00 H new ATOM 0 HG13 VAL A 641 10.725 -2.917 6.421 1.00 0.00 H new ATOM 0 HG21 VAL A 641 11.966 -4.100 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 641 10.291 -4.399 4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 641 10.612 -3.740 2.778 1.00 0.00 H new ATOM 277 N LYS A 642 7.743 -3.486 4.001 1.00 0.00 N ATOM 278 CA LYS A 642 6.714 -4.418 4.429 1.00 0.00 C ATOM 279 C LYS A 642 7.289 -5.806 4.578 1.00 0.00 C ATOM 280 O LYS A 642 6.868 -6.577 5.439 1.00 0.00 O ATOM 281 CB LYS A 642 5.553 -4.416 3.428 1.00 0.00 C ATOM 282 CG LYS A 642 5.890 -4.980 2.059 1.00 0.00 C ATOM 283 CD LYS A 642 5.004 -4.399 0.994 1.00 0.00 C ATOM 284 CE LYS A 642 5.391 -2.967 0.711 1.00 0.00 C ATOM 285 NZ LYS A 642 4.581 -2.383 -0.385 1.00 0.00 N ATOM 0 H LYS A 642 7.905 -3.459 2.994 1.00 0.00 H new ATOM 0 HA LYS A 642 6.334 -4.102 5.400 1.00 0.00 H new ATOM 0 HB2 LYS A 642 4.728 -4.991 3.849 1.00 0.00 H new ATOM 0 HB3 LYS A 642 5.199 -3.392 3.306 1.00 0.00 H new ATOM 0 HG2 LYS A 642 6.933 -4.768 1.823 1.00 0.00 H new ATOM 0 HG3 LYS A 642 5.781 -6.064 2.074 1.00 0.00 H new ATOM 0 HD2 LYS A 642 5.084 -4.991 0.082 1.00 0.00 H new ATOM 0 HD3 LYS A 642 3.963 -4.445 1.313 1.00 0.00 H new ATOM 0 HE2 LYS A 642 5.263 -2.371 1.615 1.00 0.00 H new ATOM 0 HE3 LYS A 642 6.447 -2.922 0.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 5.111 -1.609 -0.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 4.374 -3.117 -1.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 3.689 -2.013 0.002 1.00 0.00 H new ATOM 299 N GLU A 643 8.285 -6.099 3.769 1.00 0.00 N ATOM 300 CA GLU A 643 8.871 -7.402 3.746 1.00 0.00 C ATOM 301 C GLU A 643 9.783 -7.564 4.920 1.00 0.00 C ATOM 302 O GLU A 643 10.364 -6.589 5.413 1.00 0.00 O ATOM 303 CB GLU A 643 9.631 -7.628 2.455 1.00 0.00 C ATOM 304 CG GLU A 643 8.807 -7.349 1.218 1.00 0.00 C ATOM 305 CD GLU A 643 9.524 -7.691 -0.053 1.00 0.00 C ATOM 306 OE1 GLU A 643 10.649 -7.206 -0.264 1.00 0.00 O ATOM 307 OE2 GLU A 643 8.972 -8.465 -0.866 1.00 0.00 O ATOM 0 H GLU A 643 8.703 -5.437 3.115 1.00 0.00 H new ATOM 0 HA GLU A 643 8.075 -8.145 3.804 1.00 0.00 H new ATOM 0 HB2 GLU A 643 10.515 -6.990 2.446 1.00 0.00 H new ATOM 0 HB3 GLU A 643 9.982 -8.659 2.424 1.00 0.00 H new ATOM 0 HG2 GLU A 643 7.879 -7.919 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 643 8.533 -6.294 1.201 1.00 0.00 H new ATOM 314 N LYS A 644 9.892 -8.753 5.380 1.00 0.00 N ATOM 315 CA LYS A 644 10.706 -9.042 6.498 1.00 0.00 C ATOM 316 C LYS A 644 12.112 -9.307 6.075 1.00 0.00 C ATOM 317 O LYS A 644 12.384 -9.584 4.901 1.00 0.00 O ATOM 318 CB LYS A 644 10.096 -10.147 7.341 1.00 0.00 C ATOM 319 CG LYS A 644 8.840 -9.663 8.033 1.00 0.00 C ATOM 320 CD LYS A 644 9.184 -8.562 9.025 1.00 0.00 C ATOM 321 CE LYS A 644 7.965 -7.796 9.502 1.00 0.00 C ATOM 322 NZ LYS A 644 7.323 -7.048 8.398 1.00 0.00 N ATOM 0 H LYS A 644 9.413 -9.563 4.986 1.00 0.00 H new ATOM 0 HA LYS A 644 10.751 -8.167 7.146 1.00 0.00 H new ATOM 0 HB2 LYS A 644 9.862 -11.005 6.710 1.00 0.00 H new ATOM 0 HB3 LYS A 644 10.819 -10.485 8.084 1.00 0.00 H new ATOM 0 HG2 LYS A 644 8.129 -9.290 7.295 1.00 0.00 H new ATOM 0 HG3 LYS A 644 8.357 -10.492 8.550 1.00 0.00 H new ATOM 0 HD2 LYS A 644 9.691 -9.000 9.885 1.00 0.00 H new ATOM 0 HD3 LYS A 644 9.885 -7.868 8.561 1.00 0.00 H new ATOM 0 HE2 LYS A 644 7.246 -8.490 9.938 1.00 0.00 H new ATOM 0 HE3 LYS A 644 8.257 -7.102 10.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 644 6.715 -6.302 8.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 644 8.056 -6.617 7.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 644 6.747 -7.699 7.827 1.00 0.00 H new ATOM 336 N THR A 645 12.992 -9.219 6.997 1.00 0.00 N ATOM 337 CA THR A 645 14.360 -9.261 6.714 1.00 0.00 C ATOM 338 C THR A 645 14.891 -10.674 6.597 1.00 0.00 C ATOM 339 O THR A 645 14.744 -11.491 7.500 1.00 0.00 O ATOM 340 CB THR A 645 15.113 -8.430 7.749 1.00 0.00 C ATOM 341 OG1 THR A 645 14.627 -8.748 9.065 1.00 0.00 O ATOM 342 CG2 THR A 645 14.861 -6.958 7.497 1.00 0.00 C ATOM 0 H THR A 645 12.770 -9.114 7.987 1.00 0.00 H new ATOM 0 HA THR A 645 14.525 -8.822 5.730 1.00 0.00 H new ATOM 0 HB THR A 645 16.178 -8.650 7.674 1.00 0.00 H new ATOM 0 HG1 THR A 645 15.112 -8.216 9.730 1.00 0.00 H new ATOM 0 HG21 THR A 645 15.399 -6.365 8.237 1.00 0.00 H new ATOM 0 HG22 THR A 645 15.209 -6.695 6.498 1.00 0.00 H new ATOM 0 HG23 THR A 645 13.793 -6.753 7.575 1.00 0.00 H new ATOM 350 N LYS A 646 15.471 -10.963 5.457 1.00 0.00 N ATOM 351 CA LYS A 646 16.058 -12.274 5.216 1.00 0.00 C ATOM 352 C LYS A 646 17.435 -12.323 5.816 1.00 0.00 C ATOM 353 O LYS A 646 17.967 -13.388 6.077 1.00 0.00 O ATOM 354 CB LYS A 646 16.126 -12.611 3.718 1.00 0.00 C ATOM 355 CG LYS A 646 14.782 -12.560 3.037 1.00 0.00 C ATOM 356 CD LYS A 646 14.799 -13.152 1.626 1.00 0.00 C ATOM 357 CE LYS A 646 15.675 -12.388 0.654 1.00 0.00 C ATOM 358 NZ LYS A 646 15.618 -12.987 -0.700 1.00 0.00 N ATOM 0 H LYS A 646 15.553 -10.312 4.676 1.00 0.00 H new ATOM 0 HA LYS A 646 15.417 -13.019 5.687 1.00 0.00 H new ATOM 0 HB2 LYS A 646 16.803 -11.913 3.225 1.00 0.00 H new ATOM 0 HB3 LYS A 646 16.551 -13.607 3.595 1.00 0.00 H new ATOM 0 HG2 LYS A 646 14.054 -13.101 3.642 1.00 0.00 H new ATOM 0 HG3 LYS A 646 14.447 -11.524 2.986 1.00 0.00 H new ATOM 0 HD2 LYS A 646 15.145 -14.184 1.679 1.00 0.00 H new ATOM 0 HD3 LYS A 646 13.780 -13.177 1.240 1.00 0.00 H new ATOM 0 HE2 LYS A 646 15.352 -11.348 0.609 1.00 0.00 H new ATOM 0 HE3 LYS A 646 16.705 -12.387 1.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 646 16.186 -12.415 -1.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 646 15.996 -13.955 -0.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 646 14.631 -13.012 -1.027 1.00 0.00 H new ATOM 372 N GLU A 647 18.025 -11.132 5.972 1.00 0.00 N ATOM 373 CA GLU A 647 19.348 -10.913 6.588 1.00 0.00 C ATOM 374 C GLU A 647 20.513 -11.475 5.761 1.00 0.00 C ATOM 375 O GLU A 647 21.672 -11.154 6.010 1.00 0.00 O ATOM 376 CB GLU A 647 19.362 -11.377 8.047 1.00 0.00 C ATOM 377 CG GLU A 647 18.305 -10.666 8.886 1.00 0.00 C ATOM 378 CD GLU A 647 18.333 -11.044 10.335 1.00 0.00 C ATOM 379 OE1 GLU A 647 19.072 -10.421 11.108 1.00 0.00 O ATOM 380 OE2 GLU A 647 17.601 -11.954 10.742 1.00 0.00 O ATOM 0 H GLU A 647 17.585 -10.265 5.665 1.00 0.00 H new ATOM 0 HA GLU A 647 19.517 -9.836 6.592 1.00 0.00 H new ATOM 0 HB2 GLU A 647 19.192 -12.453 8.086 1.00 0.00 H new ATOM 0 HB3 GLU A 647 20.347 -11.194 8.476 1.00 0.00 H new ATOM 0 HG2 GLU A 647 18.448 -9.589 8.798 1.00 0.00 H new ATOM 0 HG3 GLU A 647 17.319 -10.891 8.480 1.00 0.00 H new ATOM 387 N GLU A 648 20.207 -12.297 4.798 1.00 0.00 N ATOM 388 CA GLU A 648 21.179 -12.763 3.865 1.00 0.00 C ATOM 389 C GLU A 648 20.579 -12.628 2.506 1.00 0.00 C ATOM 390 O GLU A 648 19.859 -13.503 2.037 1.00 0.00 O ATOM 391 CB GLU A 648 21.612 -14.209 4.126 1.00 0.00 C ATOM 392 CG GLU A 648 22.797 -14.651 3.267 1.00 0.00 C ATOM 393 CD GLU A 648 23.264 -16.049 3.573 1.00 0.00 C ATOM 394 OE1 GLU A 648 23.829 -16.275 4.664 1.00 0.00 O ATOM 395 OE2 GLU A 648 23.116 -16.953 2.714 1.00 0.00 O ATOM 0 H GLU A 648 19.268 -12.662 4.642 1.00 0.00 H new ATOM 0 HA GLU A 648 22.086 -12.167 3.963 1.00 0.00 H new ATOM 0 HB2 GLU A 648 21.875 -14.318 5.178 1.00 0.00 H new ATOM 0 HB3 GLU A 648 20.768 -14.873 3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 648 22.517 -14.591 2.215 1.00 0.00 H new ATOM 0 HG3 GLU A 648 23.625 -13.958 3.417 1.00 0.00 H new ATOM 402 N TYR A 649 20.749 -11.477 1.940 1.00 0.00 N ATOM 403 CA TYR A 649 20.244 -11.217 0.628 1.00 0.00 C ATOM 404 C TYR A 649 21.318 -11.556 -0.375 1.00 0.00 C ATOM 405 O TYR A 649 21.187 -12.502 -1.146 1.00 0.00 O ATOM 406 CB TYR A 649 19.766 -9.756 0.503 1.00 0.00 C ATOM 407 CG TYR A 649 18.496 -9.446 1.293 1.00 0.00 C ATOM 408 CD1 TYR A 649 18.467 -9.519 2.677 1.00 0.00 C ATOM 409 CD2 TYR A 649 17.322 -9.099 0.643 1.00 0.00 C ATOM 410 CE1 TYR A 649 17.323 -9.253 3.378 1.00 0.00 C ATOM 411 CE2 TYR A 649 16.167 -8.835 1.347 1.00 0.00 C ATOM 412 CZ TYR A 649 16.178 -8.912 2.716 1.00 0.00 C ATOM 413 OH TYR A 649 15.034 -8.669 3.439 1.00 0.00 O ATOM 0 H TYR A 649 21.239 -10.693 2.370 1.00 0.00 H new ATOM 0 HA TYR A 649 19.372 -11.841 0.430 1.00 0.00 H new ATOM 0 HB2 TYR A 649 20.563 -9.094 0.842 1.00 0.00 H new ATOM 0 HB3 TYR A 649 19.591 -9.531 -0.549 1.00 0.00 H new ATOM 0 HD1 TYR A 649 19.365 -9.791 3.212 1.00 0.00 H new ATOM 0 HD2 TYR A 649 17.312 -9.034 -0.435 1.00 0.00 H new ATOM 0 HE1 TYR A 649 17.325 -9.313 4.456 1.00 0.00 H new ATOM 0 HE2 TYR A 649 15.260 -8.569 0.824 1.00 0.00 H new ATOM 0 HH TYR A 649 14.304 -8.437 2.828 1.00 0.00 H new ATOM 423 N GLY A 650 22.383 -10.818 -0.336 1.00 0.00 N ATOM 424 CA GLY A 650 23.506 -11.110 -1.187 1.00 0.00 C ATOM 425 C GLY A 650 23.705 -10.058 -2.229 1.00 0.00 C ATOM 426 O GLY A 650 24.428 -9.104 -2.000 1.00 0.00 O ATOM 0 H GLY A 650 22.504 -10.009 0.273 1.00 0.00 H new ATOM 0 HA2 GLY A 650 24.408 -11.196 -0.581 1.00 0.00 H new ATOM 0 HA3 GLY A 650 23.354 -12.075 -1.670 1.00 0.00 H new ATOM 430 N HIS A 651 23.050 -10.218 -3.361 1.00 0.00 N ATOM 431 CA HIS A 651 23.157 -9.276 -4.454 1.00 0.00 C ATOM 432 C HIS A 651 21.982 -9.465 -5.398 1.00 0.00 C ATOM 433 O HIS A 651 21.500 -10.575 -5.555 1.00 0.00 O ATOM 434 CB HIS A 651 24.496 -9.477 -5.196 1.00 0.00 C ATOM 435 CG HIS A 651 24.724 -8.556 -6.350 1.00 0.00 C ATOM 436 ND1 HIS A 651 25.151 -7.263 -6.204 1.00 0.00 N ATOM 437 CD2 HIS A 651 24.557 -8.748 -7.680 1.00 0.00 C ATOM 438 CE1 HIS A 651 25.226 -6.704 -7.393 1.00 0.00 C ATOM 439 NE2 HIS A 651 24.873 -7.581 -8.292 1.00 0.00 N ATOM 0 H HIS A 651 22.429 -11.005 -3.548 1.00 0.00 H new ATOM 0 HA HIS A 651 23.135 -8.258 -4.064 1.00 0.00 H new ATOM 0 HB2 HIS A 651 25.311 -9.351 -4.484 1.00 0.00 H new ATOM 0 HB3 HIS A 651 24.544 -10.505 -5.556 1.00 0.00 H new ATOM 0 HD2 HIS A 651 24.233 -9.659 -8.162 1.00 0.00 H new ATOM 0 HE1 HIS A 651 25.530 -5.687 -7.592 1.00 0.00 H new ATOM 0 HE2 HIS A 651 24.840 -7.414 -9.298 1.00 0.00 H new ATOM 448 N SER A 652 21.503 -8.352 -5.968 1.00 0.00 N ATOM 449 CA SER A 652 20.404 -8.306 -6.945 1.00 0.00 C ATOM 450 C SER A 652 19.044 -8.550 -6.271 1.00 0.00 C ATOM 451 O SER A 652 17.996 -8.540 -6.915 1.00 0.00 O ATOM 452 CB SER A 652 20.664 -9.257 -8.142 1.00 0.00 C ATOM 453 OG SER A 652 19.720 -9.108 -9.181 1.00 0.00 O ATOM 0 H SER A 652 21.881 -7.428 -5.756 1.00 0.00 H new ATOM 0 HA SER A 652 20.366 -7.299 -7.360 1.00 0.00 H new ATOM 0 HB2 SER A 652 21.663 -9.070 -8.537 1.00 0.00 H new ATOM 0 HB3 SER A 652 20.648 -10.288 -7.789 1.00 0.00 H new ATOM 0 HG SER A 652 18.837 -8.924 -8.797 1.00 0.00 H new ATOM 459 N GLU A 653 19.081 -8.688 -4.974 1.00 0.00 N ATOM 460 CA GLU A 653 17.905 -8.905 -4.176 1.00 0.00 C ATOM 461 C GLU A 653 17.130 -7.622 -4.049 1.00 0.00 C ATOM 462 O GLU A 653 17.733 -6.550 -3.896 1.00 0.00 O ATOM 463 CB GLU A 653 18.309 -9.414 -2.808 1.00 0.00 C ATOM 464 CG GLU A 653 18.938 -10.780 -2.840 1.00 0.00 C ATOM 465 CD GLU A 653 18.007 -11.812 -3.412 1.00 0.00 C ATOM 466 OE1 GLU A 653 16.941 -12.070 -2.813 1.00 0.00 O ATOM 467 OE2 GLU A 653 18.294 -12.357 -4.480 1.00 0.00 O ATOM 0 H GLU A 653 19.944 -8.652 -4.432 1.00 0.00 H new ATOM 0 HA GLU A 653 17.271 -9.649 -4.658 1.00 0.00 H new ATOM 0 HB2 GLU A 653 19.010 -8.710 -2.359 1.00 0.00 H new ATOM 0 HB3 GLU A 653 17.429 -9.442 -2.165 1.00 0.00 H new ATOM 0 HG2 GLU A 653 19.851 -10.745 -3.434 1.00 0.00 H new ATOM 0 HG3 GLU A 653 19.226 -11.071 -1.830 1.00 0.00 H new ATOM 474 N VAL A 654 15.828 -7.727 -4.103 1.00 0.00 N ATOM 475 CA VAL A 654 14.960 -6.571 -4.061 1.00 0.00 C ATOM 476 C VAL A 654 14.088 -6.555 -2.832 1.00 0.00 C ATOM 477 O VAL A 654 13.765 -7.602 -2.266 1.00 0.00 O ATOM 478 CB VAL A 654 14.085 -6.421 -5.334 1.00 0.00 C ATOM 479 CG1 VAL A 654 14.899 -5.863 -6.485 1.00 0.00 C ATOM 480 CG2 VAL A 654 13.485 -7.753 -5.721 1.00 0.00 C ATOM 0 H VAL A 654 15.335 -8.617 -4.178 1.00 0.00 H new ATOM 0 HA VAL A 654 15.632 -5.714 -4.019 1.00 0.00 H new ATOM 0 HB VAL A 654 13.279 -5.722 -5.111 1.00 0.00 H new ATOM 0 HG11 VAL A 654 14.265 -5.767 -7.366 1.00 0.00 H new ATOM 0 HG12 VAL A 654 15.292 -4.884 -6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 654 15.727 -6.537 -6.706 1.00 0.00 H new ATOM 0 HG21 VAL A 654 12.874 -7.631 -6.615 1.00 0.00 H new ATOM 0 HG22 VAL A 654 14.284 -8.467 -5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 654 12.864 -8.123 -4.905 1.00 0.00 H new ATOM 490 N VAL A 655 13.733 -5.376 -2.414 1.00 0.00 N ATOM 491 CA VAL A 655 12.902 -5.165 -1.245 1.00 0.00 C ATOM 492 C VAL A 655 11.813 -4.172 -1.575 1.00 0.00 C ATOM 493 O VAL A 655 12.090 -3.139 -2.203 1.00 0.00 O ATOM 494 CB VAL A 655 13.750 -4.640 -0.050 1.00 0.00 C ATOM 495 CG1 VAL A 655 12.871 -4.163 1.079 1.00 0.00 C ATOM 496 CG2 VAL A 655 14.670 -5.726 0.457 1.00 0.00 C ATOM 0 H VAL A 655 14.013 -4.512 -2.878 1.00 0.00 H new ATOM 0 HA VAL A 655 12.457 -6.117 -0.957 1.00 0.00 H new ATOM 0 HB VAL A 655 14.341 -3.798 -0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 655 13.494 -3.803 1.898 1.00 0.00 H new ATOM 0 HG12 VAL A 655 12.232 -3.354 0.726 1.00 0.00 H new ATOM 0 HG13 VAL A 655 12.251 -4.988 1.431 1.00 0.00 H new ATOM 0 HG21 VAL A 655 15.257 -5.345 1.293 1.00 0.00 H new ATOM 0 HG22 VAL A 655 14.078 -6.579 0.789 1.00 0.00 H new ATOM 0 HG23 VAL A 655 15.340 -6.039 -0.344 1.00 0.00 H new ATOM 506 N GLU A 656 10.590 -4.477 -1.174 1.00 0.00 N ATOM 507 CA GLU A 656 9.490 -3.597 -1.432 1.00 0.00 C ATOM 508 C GLU A 656 9.112 -2.779 -0.184 1.00 0.00 C ATOM 509 O GLU A 656 8.837 -3.324 0.912 1.00 0.00 O ATOM 510 CB GLU A 656 8.276 -4.362 -1.931 1.00 0.00 C ATOM 511 CG GLU A 656 7.212 -3.437 -2.492 1.00 0.00 C ATOM 512 CD GLU A 656 5.990 -4.139 -3.027 1.00 0.00 C ATOM 513 OE1 GLU A 656 6.004 -4.614 -4.179 1.00 0.00 O ATOM 514 OE2 GLU A 656 4.975 -4.187 -2.320 1.00 0.00 O ATOM 0 H GLU A 656 10.346 -5.329 -0.670 1.00 0.00 H new ATOM 0 HA GLU A 656 9.815 -2.907 -2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 656 8.584 -5.069 -2.701 1.00 0.00 H new ATOM 0 HB3 GLU A 656 7.854 -4.946 -1.113 1.00 0.00 H new ATOM 0 HG2 GLU A 656 6.903 -2.743 -1.710 1.00 0.00 H new ATOM 0 HG3 GLU A 656 7.652 -2.841 -3.292 1.00 0.00 H new ATOM 521 N TYR A 657 9.098 -1.497 -0.363 1.00 0.00 N ATOM 522 CA TYR A 657 8.700 -0.537 0.636 1.00 0.00 C ATOM 523 C TYR A 657 7.279 -0.075 0.369 1.00 0.00 C ATOM 524 O TYR A 657 6.707 -0.380 -0.680 1.00 0.00 O ATOM 525 CB TYR A 657 9.620 0.691 0.630 1.00 0.00 C ATOM 526 CG TYR A 657 11.002 0.468 1.192 1.00 0.00 C ATOM 527 CD1 TYR A 657 11.998 -0.124 0.438 1.00 0.00 C ATOM 528 CD2 TYR A 657 11.305 0.845 2.493 1.00 0.00 C ATOM 529 CE1 TYR A 657 13.236 -0.340 0.962 1.00 0.00 C ATOM 530 CE2 TYR A 657 12.549 0.636 3.021 1.00 0.00 C ATOM 531 CZ TYR A 657 13.513 0.035 2.246 1.00 0.00 C ATOM 532 OH TYR A 657 14.753 -0.187 2.748 1.00 0.00 O ATOM 0 H TYR A 657 9.374 -1.064 -1.244 1.00 0.00 H new ATOM 0 HA TYR A 657 8.767 -1.026 1.608 1.00 0.00 H new ATOM 0 HB2 TYR A 657 9.717 1.046 -0.396 1.00 0.00 H new ATOM 0 HB3 TYR A 657 9.139 1.487 1.199 1.00 0.00 H new ATOM 0 HD1 TYR A 657 11.791 -0.419 -0.580 1.00 0.00 H new ATOM 0 HD2 TYR A 657 10.544 1.312 3.100 1.00 0.00 H new ATOM 0 HE1 TYR A 657 14.001 -0.809 0.361 1.00 0.00 H new ATOM 0 HE2 TYR A 657 12.772 0.939 4.033 1.00 0.00 H new ATOM 0 HH TYR A 657 14.682 -0.455 3.688 1.00 0.00 H new ATOM 542 N TYR A 658 6.717 0.621 1.325 1.00 0.00 N ATOM 543 CA TYR A 658 5.405 1.212 1.228 1.00 0.00 C ATOM 544 C TYR A 658 5.476 2.584 1.851 1.00 0.00 C ATOM 545 O TYR A 658 6.332 2.819 2.710 1.00 0.00 O ATOM 546 CB TYR A 658 4.349 0.372 2.001 1.00 0.00 C ATOM 547 CG TYR A 658 4.602 0.209 3.508 1.00 0.00 C ATOM 548 CD1 TYR A 658 4.228 1.192 4.427 1.00 0.00 C ATOM 549 CD2 TYR A 658 5.207 -0.922 4.001 1.00 0.00 C ATOM 550 CE1 TYR A 658 4.463 1.037 5.776 1.00 0.00 C ATOM 551 CE2 TYR A 658 5.440 -1.085 5.352 1.00 0.00 C ATOM 552 CZ TYR A 658 5.068 -0.106 6.232 1.00 0.00 C ATOM 553 OH TYR A 658 5.315 -0.265 7.579 1.00 0.00 O ATOM 0 H TYR A 658 7.174 0.798 2.220 1.00 0.00 H new ATOM 0 HA TYR A 658 5.107 1.255 0.180 1.00 0.00 H new ATOM 0 HB2 TYR A 658 3.372 0.835 1.863 1.00 0.00 H new ATOM 0 HB3 TYR A 658 4.299 -0.619 1.550 1.00 0.00 H new ATOM 0 HD1 TYR A 658 3.745 2.091 4.074 1.00 0.00 H new ATOM 0 HD2 TYR A 658 5.507 -1.701 3.316 1.00 0.00 H new ATOM 0 HE1 TYR A 658 4.172 1.811 6.470 1.00 0.00 H new ATOM 0 HE2 TYR A 658 5.916 -1.985 5.714 1.00 0.00 H new ATOM 0 HH TYR A 658 5.748 -1.131 7.732 1.00 0.00 H new ATOM 563 N CYS A 659 4.646 3.476 1.440 1.00 0.00 N ATOM 564 CA CYS A 659 4.546 4.732 2.121 1.00 0.00 C ATOM 565 C CYS A 659 3.442 4.657 3.126 1.00 0.00 C ATOM 566 O CYS A 659 2.622 3.732 3.100 1.00 0.00 O ATOM 567 CB CYS A 659 4.338 5.915 1.169 1.00 0.00 C ATOM 568 SG CYS A 659 5.812 6.380 0.225 1.00 0.00 S ATOM 0 H CYS A 659 4.025 3.367 0.638 1.00 0.00 H new ATOM 0 HA CYS A 659 5.496 4.915 2.622 1.00 0.00 H new ATOM 0 HB2 CYS A 659 3.537 5.669 0.472 1.00 0.00 H new ATOM 0 HB3 CYS A 659 4.004 6.777 1.747 1.00 0.00 H new ATOM 573 N ASN A 660 3.446 5.584 4.045 1.00 0.00 N ATOM 574 CA ASN A 660 2.395 5.675 5.028 1.00 0.00 C ATOM 575 C ASN A 660 1.080 5.984 4.309 1.00 0.00 C ATOM 576 O ASN A 660 1.104 6.571 3.245 1.00 0.00 O ATOM 577 CB ASN A 660 2.717 6.766 6.042 1.00 0.00 C ATOM 578 CG ASN A 660 3.005 6.218 7.445 1.00 0.00 C ATOM 579 OD1 ASN A 660 2.098 6.057 8.249 1.00 0.00 O ATOM 580 ND2 ASN A 660 4.254 5.969 7.764 1.00 0.00 N ATOM 0 H ASN A 660 4.172 6.295 4.136 1.00 0.00 H new ATOM 0 HA ASN A 660 2.306 4.731 5.565 1.00 0.00 H new ATOM 0 HB2 ASN A 660 3.581 7.332 5.695 1.00 0.00 H new ATOM 0 HB3 ASN A 660 1.880 7.462 6.095 1.00 0.00 H new ATOM 0 HD21 ASN A 660 4.484 5.634 8.699 1.00 0.00 H new ATOM 0 HD22 ASN A 660 4.994 6.111 7.076 1.00 0.00 H new ATOM 587 N PRO A 661 -0.066 5.645 4.891 1.00 0.00 N ATOM 588 CA PRO A 661 -1.393 5.756 4.227 1.00 0.00 C ATOM 589 C PRO A 661 -1.881 7.199 3.992 1.00 0.00 C ATOM 590 O PRO A 661 -3.027 7.420 3.647 1.00 0.00 O ATOM 591 CB PRO A 661 -2.310 5.029 5.199 1.00 0.00 C ATOM 592 CG PRO A 661 -1.660 5.200 6.517 1.00 0.00 C ATOM 593 CD PRO A 661 -0.196 5.138 6.257 1.00 0.00 C ATOM 0 HA PRO A 661 -1.363 5.341 3.219 1.00 0.00 H new ATOM 0 HB2 PRO A 661 -3.313 5.455 5.193 1.00 0.00 H new ATOM 0 HB3 PRO A 661 -2.409 3.975 4.939 1.00 0.00 H new ATOM 0 HG2 PRO A 661 -1.937 6.152 6.969 1.00 0.00 H new ATOM 0 HG3 PRO A 661 -1.968 4.417 7.210 1.00 0.00 H new ATOM 0 HD2 PRO A 661 0.363 5.749 6.966 1.00 0.00 H new ATOM 0 HD3 PRO A 661 0.184 4.120 6.344 1.00 0.00 H new ATOM 601 N ARG A 662 -1.020 8.151 4.208 1.00 0.00 N ATOM 602 CA ARG A 662 -1.333 9.541 3.939 1.00 0.00 C ATOM 603 C ARG A 662 -0.203 10.178 3.146 1.00 0.00 C ATOM 604 O ARG A 662 -0.149 11.378 2.956 1.00 0.00 O ATOM 605 CB ARG A 662 -1.541 10.283 5.231 1.00 0.00 C ATOM 606 CG ARG A 662 -0.329 10.339 6.103 1.00 0.00 C ATOM 607 CD ARG A 662 -0.639 11.139 7.295 1.00 0.00 C ATOM 608 NE ARG A 662 0.525 11.336 8.166 1.00 0.00 N ATOM 609 CZ ARG A 662 0.627 12.298 9.100 1.00 0.00 C ATOM 610 NH1 ARG A 662 -0.383 13.135 9.300 1.00 0.00 N ATOM 611 NH2 ARG A 662 1.745 12.423 9.819 1.00 0.00 N ATOM 0 H ARG A 662 -0.081 7.995 4.575 1.00 0.00 H new ATOM 0 HA ARG A 662 -2.251 9.593 3.354 1.00 0.00 H new ATOM 0 HB2 ARG A 662 -1.861 11.300 5.006 1.00 0.00 H new ATOM 0 HB3 ARG A 662 -2.352 9.809 5.784 1.00 0.00 H new ATOM 0 HG2 ARG A 662 -0.026 9.333 6.392 1.00 0.00 H new ATOM 0 HG3 ARG A 662 0.507 10.780 5.560 1.00 0.00 H new ATOM 0 HD2 ARG A 662 -1.024 12.111 6.985 1.00 0.00 H new ATOM 0 HD3 ARG A 662 -1.431 10.648 7.860 1.00 0.00 H new ATOM 0 HE ARG A 662 1.313 10.698 8.055 1.00 0.00 H new ATOM 0 HH11 ARG A 662 -1.235 13.048 8.746 1.00 0.00 H new ATOM 0 HH12 ARG A 662 -0.308 13.865 10.008 1.00 0.00 H new ATOM 0 HH21 ARG A 662 2.527 11.787 9.661 1.00 0.00 H new ATOM 0 HH22 ARG A 662 1.817 13.154 10.526 1.00 0.00 H new ATOM 625 N PHE A 663 0.732 9.355 2.773 1.00 0.00 N ATOM 626 CA PHE A 663 1.852 9.763 1.951 1.00 0.00 C ATOM 627 C PHE A 663 1.934 8.915 0.699 1.00 0.00 C ATOM 628 O PHE A 663 1.682 7.716 0.737 1.00 0.00 O ATOM 629 CB PHE A 663 3.186 9.688 2.705 1.00 0.00 C ATOM 630 CG PHE A 663 3.445 10.819 3.672 1.00 0.00 C ATOM 631 CD1 PHE A 663 2.812 10.878 4.894 1.00 0.00 C ATOM 632 CD2 PHE A 663 4.348 11.815 3.351 1.00 0.00 C ATOM 633 CE1 PHE A 663 3.071 11.910 5.781 1.00 0.00 C ATOM 634 CE2 PHE A 663 4.611 12.849 4.226 1.00 0.00 C ATOM 635 CZ PHE A 663 3.972 12.896 5.445 1.00 0.00 C ATOM 0 H PHE A 663 0.746 8.368 3.030 1.00 0.00 H new ATOM 0 HA PHE A 663 1.677 10.804 1.679 1.00 0.00 H new ATOM 0 HB2 PHE A 663 3.222 8.747 3.254 1.00 0.00 H new ATOM 0 HB3 PHE A 663 3.996 9.663 1.976 1.00 0.00 H new ATOM 0 HD1 PHE A 663 2.104 10.109 5.164 1.00 0.00 H new ATOM 0 HD2 PHE A 663 4.857 11.783 2.399 1.00 0.00 H new ATOM 0 HE1 PHE A 663 2.567 11.941 6.736 1.00 0.00 H new ATOM 0 HE2 PHE A 663 5.317 13.620 3.955 1.00 0.00 H new ATOM 0 HZ PHE A 663 4.176 13.702 6.134 1.00 0.00 H new ATOM 645 N LEU A 664 2.303 9.521 -0.387 1.00 0.00 N ATOM 646 CA LEU A 664 2.422 8.828 -1.641 1.00 0.00 C ATOM 647 C LEU A 664 3.845 8.444 -1.881 1.00 0.00 C ATOM 648 O LEU A 664 4.783 9.167 -1.487 1.00 0.00 O ATOM 649 CB LEU A 664 1.988 9.688 -2.830 1.00 0.00 C ATOM 650 CG LEU A 664 0.688 10.413 -2.736 1.00 0.00 C ATOM 651 CD1 LEU A 664 0.266 10.925 -4.094 1.00 0.00 C ATOM 652 CD2 LEU A 664 -0.364 9.579 -2.125 1.00 0.00 C ATOM 0 H LEU A 664 2.532 10.514 -0.433 1.00 0.00 H new ATOM 0 HA LEU A 664 1.772 7.956 -1.568 1.00 0.00 H new ATOM 0 HB2 LEU A 664 2.769 10.427 -3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 664 1.948 9.045 -3.709 1.00 0.00 H new ATOM 0 HG LEU A 664 0.833 11.270 -2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 664 -0.685 11.451 -4.005 1.00 0.00 H new ATOM 0 HD12 LEU A 664 1.024 11.608 -4.477 1.00 0.00 H new ATOM 0 HD13 LEU A 664 0.153 10.086 -4.780 1.00 0.00 H new ATOM 0 HD21 LEU A 664 -1.294 10.145 -2.076 1.00 0.00 H new ATOM 0 HD22 LEU A 664 -0.515 8.684 -2.729 1.00 0.00 H new ATOM 0 HD23 LEU A 664 -0.061 9.291 -1.119 1.00 0.00 H new ATOM 664 N MET A 665 4.004 7.324 -2.505 1.00 0.00 N ATOM 665 CA MET A 665 5.280 6.853 -2.943 1.00 0.00 C ATOM 666 C MET A 665 5.691 7.617 -4.187 1.00 0.00 C ATOM 667 O MET A 665 5.024 7.524 -5.226 1.00 0.00 O ATOM 668 CB MET A 665 5.211 5.362 -3.265 1.00 0.00 C ATOM 669 CG MET A 665 6.526 4.790 -3.742 1.00 0.00 C ATOM 670 SD MET A 665 7.804 4.848 -2.476 1.00 0.00 S ATOM 671 CE MET A 665 7.120 3.725 -1.257 1.00 0.00 C ATOM 0 H MET A 665 3.234 6.695 -2.731 1.00 0.00 H new ATOM 0 HA MET A 665 6.011 7.010 -2.149 1.00 0.00 H new ATOM 0 HB2 MET A 665 4.889 4.820 -2.376 1.00 0.00 H new ATOM 0 HB3 MET A 665 4.453 5.198 -4.031 1.00 0.00 H new ATOM 0 HG2 MET A 665 6.377 3.757 -4.055 1.00 0.00 H new ATOM 0 HG3 MET A 665 6.862 5.344 -4.619 1.00 0.00 H new ATOM 0 HE1 MET A 665 7.004 4.246 -0.307 1.00 0.00 H new ATOM 0 HE2 MET A 665 6.148 3.368 -1.596 1.00 0.00 H new ATOM 0 HE3 MET A 665 7.792 2.877 -1.126 1.00 0.00 H new ATOM 681 N LYS A 666 6.722 8.406 -4.069 1.00 0.00 N ATOM 682 CA LYS A 666 7.250 9.134 -5.203 1.00 0.00 C ATOM 683 C LYS A 666 8.366 8.333 -5.854 1.00 0.00 C ATOM 684 O LYS A 666 8.377 8.117 -7.063 1.00 0.00 O ATOM 685 CB LYS A 666 7.803 10.511 -4.781 1.00 0.00 C ATOM 686 CG LYS A 666 8.443 11.267 -5.945 1.00 0.00 C ATOM 687 CD LYS A 666 9.132 12.554 -5.529 1.00 0.00 C ATOM 688 CE LYS A 666 8.148 13.580 -5.030 1.00 0.00 C ATOM 689 NZ LYS A 666 8.784 14.875 -4.783 1.00 0.00 N ATOM 0 H LYS A 666 7.221 8.566 -3.194 1.00 0.00 H new ATOM 0 HA LYS A 666 6.434 9.288 -5.908 1.00 0.00 H new ATOM 0 HB2 LYS A 666 6.995 11.111 -4.363 1.00 0.00 H new ATOM 0 HB3 LYS A 666 8.541 10.376 -3.990 1.00 0.00 H new ATOM 0 HG2 LYS A 666 9.169 10.617 -6.433 1.00 0.00 H new ATOM 0 HG3 LYS A 666 7.675 11.498 -6.683 1.00 0.00 H new ATOM 0 HD2 LYS A 666 9.861 12.340 -4.748 1.00 0.00 H new ATOM 0 HD3 LYS A 666 9.683 12.961 -6.376 1.00 0.00 H new ATOM 0 HE2 LYS A 666 7.349 13.702 -5.762 1.00 0.00 H new ATOM 0 HE3 LYS A 666 7.686 13.222 -4.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 666 8.072 15.552 -4.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 666 9.529 14.765 -4.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 666 9.203 15.230 -5.666 1.00 0.00 H new ATOM 703 N GLY A 667 9.279 7.871 -5.036 1.00 0.00 N ATOM 704 CA GLY A 667 10.461 7.203 -5.538 1.00 0.00 C ATOM 705 C GLY A 667 10.255 5.729 -5.819 1.00 0.00 C ATOM 706 O GLY A 667 9.117 5.247 -5.847 1.00 0.00 O ATOM 0 H GLY A 667 9.229 7.944 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY A 667 10.785 7.697 -6.454 1.00 0.00 H new ATOM 0 HA3 GLY A 667 11.267 7.316 -4.813 1.00 0.00 H new ATOM 710 N PRO A 668 11.345 4.988 -6.050 1.00 0.00 N ATOM 711 CA PRO A 668 11.284 3.564 -6.295 1.00 0.00 C ATOM 712 C PRO A 668 11.071 2.798 -5.011 1.00 0.00 C ATOM 713 O PRO A 668 11.951 2.694 -4.159 1.00 0.00 O ATOM 714 CB PRO A 668 12.633 3.228 -6.900 1.00 0.00 C ATOM 715 CG PRO A 668 13.550 4.259 -6.377 1.00 0.00 C ATOM 716 CD PRO A 668 12.730 5.489 -6.103 1.00 0.00 C ATOM 0 HA PRO A 668 10.453 3.295 -6.947 1.00 0.00 H new ATOM 0 HB2 PRO A 668 12.957 2.228 -6.612 1.00 0.00 H new ATOM 0 HB3 PRO A 668 12.594 3.249 -7.989 1.00 0.00 H new ATOM 0 HG2 PRO A 668 14.039 3.912 -5.467 1.00 0.00 H new ATOM 0 HG3 PRO A 668 14.337 4.475 -7.099 1.00 0.00 H new ATOM 0 HD2 PRO A 668 13.020 5.961 -5.164 1.00 0.00 H new ATOM 0 HD3 PRO A 668 12.855 6.235 -6.888 1.00 0.00 H new ATOM 724 N ASN A 669 9.899 2.298 -4.873 1.00 0.00 N ATOM 725 CA ASN A 669 9.489 1.554 -3.693 1.00 0.00 C ATOM 726 C ASN A 669 10.124 0.170 -3.640 1.00 0.00 C ATOM 727 O ASN A 669 9.942 -0.555 -2.683 1.00 0.00 O ATOM 728 CB ASN A 669 7.963 1.452 -3.618 1.00 0.00 C ATOM 729 CG ASN A 669 7.342 0.589 -4.686 1.00 0.00 C ATOM 730 OD1 ASN A 669 7.008 -0.616 -4.329 1.00 0.00 O flip ATOM 731 ND2 ASN A 669 7.114 1.038 -5.811 1.00 0.00 N flip ATOM 0 H ASN A 669 9.168 2.384 -5.579 1.00 0.00 H new ATOM 0 HA ASN A 669 9.845 2.107 -2.824 1.00 0.00 H new ATOM 0 HB2 ASN A 669 7.685 1.056 -2.641 1.00 0.00 H new ATOM 0 HB3 ASN A 669 7.540 2.454 -3.687 1.00 0.00 H new ATOM 0 HD21 ASN A 669 7.394 1.990 -6.047 1.00 0.00 H new ATOM 0 HD22 ASN A 669 6.645 0.458 -6.506 1.00 0.00 H new ATOM 738 N LYS A 670 10.841 -0.197 -4.667 1.00 0.00 N ATOM 739 CA LYS A 670 11.544 -1.449 -4.683 1.00 0.00 C ATOM 740 C LYS A 670 12.991 -1.228 -5.002 1.00 0.00 C ATOM 741 O LYS A 670 13.344 -0.748 -6.097 1.00 0.00 O ATOM 742 CB LYS A 670 10.895 -2.451 -5.624 1.00 0.00 C ATOM 743 CG LYS A 670 9.584 -2.987 -5.096 1.00 0.00 C ATOM 744 CD LYS A 670 8.841 -3.798 -6.122 1.00 0.00 C ATOM 745 CE LYS A 670 8.393 -2.924 -7.273 1.00 0.00 C ATOM 746 NZ LYS A 670 7.627 -3.680 -8.278 1.00 0.00 N ATOM 0 H LYS A 670 10.954 0.362 -5.513 1.00 0.00 H new ATOM 0 HA LYS A 670 11.484 -1.886 -3.686 1.00 0.00 H new ATOM 0 HB2 LYS A 670 10.725 -1.977 -6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 670 11.581 -3.282 -5.792 1.00 0.00 H new ATOM 0 HG2 LYS A 670 9.774 -3.604 -4.218 1.00 0.00 H new ATOM 0 HG3 LYS A 670 8.959 -2.155 -4.772 1.00 0.00 H new ATOM 0 HD2 LYS A 670 9.482 -4.598 -6.494 1.00 0.00 H new ATOM 0 HD3 LYS A 670 7.975 -4.272 -5.660 1.00 0.00 H new ATOM 0 HE2 LYS A 670 7.781 -2.107 -6.890 1.00 0.00 H new ATOM 0 HE3 LYS A 670 9.265 -2.474 -7.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 670 7.340 -3.042 -9.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 670 8.219 -4.444 -8.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 670 6.780 -4.089 -7.834 1.00 0.00 H new ATOM 760 N ILE A 671 13.815 -1.579 -4.063 1.00 0.00 N ATOM 761 CA ILE A 671 15.227 -1.348 -4.149 1.00 0.00 C ATOM 762 C ILE A 671 15.936 -2.657 -4.357 1.00 0.00 C ATOM 763 O ILE A 671 15.348 -3.706 -4.166 1.00 0.00 O ATOM 764 CB ILE A 671 15.782 -0.667 -2.874 1.00 0.00 C ATOM 765 CG1 ILE A 671 15.592 -1.578 -1.650 1.00 0.00 C ATOM 766 CG2 ILE A 671 15.093 0.678 -2.665 1.00 0.00 C ATOM 767 CD1 ILE A 671 16.241 -1.061 -0.392 1.00 0.00 C ATOM 0 H ILE A 671 13.523 -2.041 -3.202 1.00 0.00 H new ATOM 0 HA ILE A 671 15.402 -0.679 -4.991 1.00 0.00 H new ATOM 0 HB ILE A 671 16.851 -0.494 -2.999 1.00 0.00 H new ATOM 0 HG12 ILE A 671 14.525 -1.707 -1.469 1.00 0.00 H new ATOM 0 HG13 ILE A 671 15.999 -2.563 -1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 671 15.487 1.153 -1.767 1.00 0.00 H new ATOM 0 HG22 ILE A 671 15.279 1.320 -3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 671 14.020 0.524 -2.553 1.00 0.00 H new ATOM 0 HD11 ILE A 671 16.061 -1.761 0.424 1.00 0.00 H new ATOM 0 HD12 ILE A 671 17.314 -0.959 -0.552 1.00 0.00 H new ATOM 0 HD13 ILE A 671 15.818 -0.089 -0.137 1.00 0.00 H new ATOM 779 N GLN A 672 17.185 -2.585 -4.687 1.00 0.00 N ATOM 780 CA GLN A 672 17.989 -3.727 -4.997 1.00 0.00 C ATOM 781 C GLN A 672 19.361 -3.580 -4.430 1.00 0.00 C ATOM 782 O GLN A 672 19.920 -2.491 -4.383 1.00 0.00 O ATOM 783 CB GLN A 672 18.039 -3.973 -6.523 1.00 0.00 C ATOM 784 CG GLN A 672 19.181 -4.871 -6.987 1.00 0.00 C ATOM 785 CD GLN A 672 19.138 -5.190 -8.457 1.00 0.00 C ATOM 786 OE1 GLN A 672 19.668 -4.450 -9.280 1.00 0.00 O ATOM 787 NE2 GLN A 672 18.572 -6.312 -8.791 1.00 0.00 N ATOM 0 H GLN A 672 17.692 -1.702 -4.751 1.00 0.00 H new ATOM 0 HA GLN A 672 17.527 -4.600 -4.536 1.00 0.00 H new ATOM 0 HB2 GLN A 672 17.095 -4.418 -6.837 1.00 0.00 H new ATOM 0 HB3 GLN A 672 18.122 -3.012 -7.030 1.00 0.00 H new ATOM 0 HG2 GLN A 672 20.130 -4.386 -6.757 1.00 0.00 H new ATOM 0 HG3 GLN A 672 19.153 -5.802 -6.421 1.00 0.00 H new ATOM 0 HE21 GLN A 672 18.142 -6.899 -8.076 1.00 0.00 H new ATOM 0 HE22 GLN A 672 18.558 -6.605 -9.768 1.00 0.00 H new ATOM 796 N CYS A 673 19.858 -4.663 -3.937 1.00 0.00 N ATOM 797 CA CYS A 673 21.196 -4.729 -3.449 1.00 0.00 C ATOM 798 C CYS A 673 22.158 -4.791 -4.607 1.00 0.00 C ATOM 799 O CYS A 673 22.247 -5.818 -5.313 1.00 0.00 O ATOM 800 CB CYS A 673 21.380 -5.950 -2.569 1.00 0.00 C ATOM 801 SG CYS A 673 23.136 -6.346 -2.211 1.00 0.00 S ATOM 0 H CYS A 673 19.341 -5.539 -3.860 1.00 0.00 H new ATOM 0 HA CYS A 673 21.395 -3.836 -2.857 1.00 0.00 H new ATOM 0 HB2 CYS A 673 20.854 -5.791 -1.628 1.00 0.00 H new ATOM 0 HB3 CYS A 673 20.915 -6.809 -3.053 1.00 0.00 H new ATOM 806 N VAL A 674 22.844 -3.720 -4.844 1.00 0.00 N ATOM 807 CA VAL A 674 23.837 -3.718 -5.878 1.00 0.00 C ATOM 808 C VAL A 674 25.170 -4.014 -5.249 1.00 0.00 C ATOM 809 O VAL A 674 25.236 -4.272 -4.047 1.00 0.00 O ATOM 810 CB VAL A 674 23.895 -2.402 -6.681 1.00 0.00 C ATOM 811 CG1 VAL A 674 22.562 -2.142 -7.357 1.00 0.00 C ATOM 812 CG2 VAL A 674 24.321 -1.234 -5.806 1.00 0.00 C ATOM 0 H VAL A 674 22.739 -2.839 -4.341 1.00 0.00 H new ATOM 0 HA VAL A 674 23.566 -4.485 -6.603 1.00 0.00 H new ATOM 0 HB VAL A 674 24.654 -2.505 -7.457 1.00 0.00 H new ATOM 0 HG11 VAL A 674 22.615 -1.211 -7.921 1.00 0.00 H new ATOM 0 HG12 VAL A 674 22.332 -2.964 -8.035 1.00 0.00 H new ATOM 0 HG13 VAL A 674 21.780 -2.065 -6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 674 24.351 -0.323 -6.404 1.00 0.00 H new ATOM 0 HG22 VAL A 674 23.607 -1.110 -4.992 1.00 0.00 H new ATOM 0 HG23 VAL A 674 25.311 -1.430 -5.394 1.00 0.00 H new ATOM 822 N ASP A 675 26.216 -4.015 -6.027 1.00 0.00 N ATOM 823 CA ASP A 675 27.526 -4.324 -5.500 1.00 0.00 C ATOM 824 C ASP A 675 28.106 -3.153 -4.704 1.00 0.00 C ATOM 825 O ASP A 675 28.818 -2.285 -5.212 1.00 0.00 O ATOM 826 CB ASP A 675 28.502 -4.856 -6.578 1.00 0.00 C ATOM 827 CG ASP A 675 28.843 -3.901 -7.716 1.00 0.00 C ATOM 828 OD1 ASP A 675 28.012 -3.714 -8.640 1.00 0.00 O ATOM 829 OD2 ASP A 675 29.947 -3.358 -7.726 1.00 0.00 O ATOM 0 H ASP A 675 26.193 -3.807 -7.025 1.00 0.00 H new ATOM 0 HA ASP A 675 27.392 -5.148 -4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 675 29.430 -5.145 -6.085 1.00 0.00 H new ATOM 0 HB3 ASP A 675 28.074 -5.761 -7.009 1.00 0.00 H new ATOM 834 N GLY A 676 27.664 -3.073 -3.482 1.00 0.00 N ATOM 835 CA GLY A 676 28.202 -2.159 -2.539 1.00 0.00 C ATOM 836 C GLY A 676 27.189 -1.731 -1.514 1.00 0.00 C ATOM 837 O GLY A 676 27.498 -1.637 -0.322 1.00 0.00 O ATOM 0 H GLY A 676 26.909 -3.653 -3.116 1.00 0.00 H new ATOM 0 HA2 GLY A 676 29.052 -2.619 -2.036 1.00 0.00 H new ATOM 0 HA3 GLY A 676 28.579 -1.280 -3.063 1.00 0.00 H new ATOM 841 N GLU A 677 25.980 -1.516 -1.954 1.00 0.00 N ATOM 842 CA GLU A 677 24.917 -1.042 -1.095 1.00 0.00 C ATOM 843 C GLU A 677 23.596 -1.235 -1.807 1.00 0.00 C ATOM 844 O GLU A 677 23.549 -1.876 -2.852 1.00 0.00 O ATOM 845 CB GLU A 677 25.148 0.448 -0.760 1.00 0.00 C ATOM 846 CG GLU A 677 25.222 1.350 -1.985 1.00 0.00 C ATOM 847 CD GLU A 677 25.627 2.755 -1.652 1.00 0.00 C ATOM 848 OE1 GLU A 677 24.791 3.527 -1.135 1.00 0.00 O ATOM 849 OE2 GLU A 677 26.792 3.125 -1.920 1.00 0.00 O ATOM 0 H GLU A 677 25.697 -1.664 -2.923 1.00 0.00 H new ATOM 0 HA GLU A 677 24.905 -1.604 -0.161 1.00 0.00 H new ATOM 0 HB2 GLU A 677 24.342 0.795 -0.114 1.00 0.00 H new ATOM 0 HB3 GLU A 677 26.074 0.544 -0.193 1.00 0.00 H new ATOM 0 HG2 GLU A 677 25.934 0.931 -2.696 1.00 0.00 H new ATOM 0 HG3 GLU A 677 24.250 1.365 -2.478 1.00 0.00 H new ATOM 856 N TRP A 678 22.546 -0.705 -1.258 1.00 0.00 N ATOM 857 CA TRP A 678 21.254 -0.791 -1.887 1.00 0.00 C ATOM 858 C TRP A 678 21.075 0.375 -2.841 1.00 0.00 C ATOM 859 O TRP A 678 21.847 1.344 -2.798 1.00 0.00 O ATOM 860 CB TRP A 678 20.153 -0.790 -0.839 1.00 0.00 C ATOM 861 CG TRP A 678 20.133 -2.012 0.031 1.00 0.00 C ATOM 862 CD1 TRP A 678 20.826 -2.225 1.185 1.00 0.00 C ATOM 863 CD2 TRP A 678 19.363 -3.183 -0.195 1.00 0.00 C ATOM 864 NE1 TRP A 678 20.527 -3.469 1.685 1.00 0.00 N ATOM 865 CE2 TRP A 678 19.629 -4.076 0.851 1.00 0.00 C ATOM 866 CE3 TRP A 678 18.474 -3.553 -1.186 1.00 0.00 C ATOM 867 CZ2 TRP A 678 19.027 -5.331 0.923 1.00 0.00 C ATOM 868 CZ3 TRP A 678 17.877 -4.775 -1.128 1.00 0.00 C ATOM 869 CH2 TRP A 678 18.150 -5.663 -0.078 1.00 0.00 C ATOM 0 H TRP A 678 22.554 -0.204 -0.370 1.00 0.00 H new ATOM 0 HA TRP A 678 21.192 -1.724 -2.447 1.00 0.00 H new ATOM 0 HB2 TRP A 678 20.269 0.091 -0.207 1.00 0.00 H new ATOM 0 HB3 TRP A 678 19.189 -0.698 -1.340 1.00 0.00 H new ATOM 0 HD1 TRP A 678 21.508 -1.521 1.638 1.00 0.00 H new ATOM 0 HE1 TRP A 678 20.912 -3.874 2.539 1.00 0.00 H new ATOM 0 HE3 TRP A 678 18.255 -2.878 -2.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 678 19.242 -6.013 1.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 678 17.182 -5.065 -1.903 1.00 0.00 H new ATOM 0 HH2 TRP A 678 17.661 -6.626 -0.057 1.00 0.00 H new ATOM 880 N THR A 679 20.089 0.288 -3.687 1.00 0.00 N ATOM 881 CA THR A 679 19.801 1.323 -4.639 1.00 0.00 C ATOM 882 C THR A 679 19.138 2.526 -3.967 1.00 0.00 C ATOM 883 O THR A 679 18.937 2.533 -2.736 1.00 0.00 O ATOM 884 CB THR A 679 18.922 0.769 -5.770 1.00 0.00 C ATOM 885 OG1 THR A 679 17.837 0.028 -5.217 1.00 0.00 O ATOM 886 CG2 THR A 679 19.722 -0.123 -6.700 1.00 0.00 C ATOM 0 H THR A 679 19.456 -0.511 -3.736 1.00 0.00 H new ATOM 0 HA THR A 679 20.742 1.668 -5.067 1.00 0.00 H new ATOM 0 HB THR A 679 18.540 1.612 -6.346 1.00 0.00 H new ATOM 0 HG1 THR A 679 17.137 0.646 -4.919 1.00 0.00 H new ATOM 0 HG21 THR A 679 19.073 -0.500 -7.490 1.00 0.00 H new ATOM 0 HG22 THR A 679 20.537 0.450 -7.142 1.00 0.00 H new ATOM 0 HG23 THR A 679 20.132 -0.961 -6.137 1.00 0.00 H new ATOM 894 N THR A 680 18.826 3.532 -4.746 1.00 0.00 N ATOM 895 CA THR A 680 18.247 4.749 -4.240 1.00 0.00 C ATOM 896 C THR A 680 16.886 4.511 -3.598 1.00 0.00 C ATOM 897 O THR A 680 15.936 4.072 -4.243 1.00 0.00 O ATOM 898 CB THR A 680 18.158 5.808 -5.352 1.00 0.00 C ATOM 899 OG1 THR A 680 19.461 5.990 -5.919 1.00 0.00 O ATOM 900 CG2 THR A 680 17.654 7.145 -4.818 1.00 0.00 C ATOM 0 H THR A 680 18.968 3.528 -5.756 1.00 0.00 H new ATOM 0 HA THR A 680 18.905 5.125 -3.457 1.00 0.00 H new ATOM 0 HB THR A 680 17.451 5.458 -6.104 1.00 0.00 H new ATOM 0 HG1 THR A 680 19.417 6.662 -6.631 1.00 0.00 H new ATOM 0 HG21 THR A 680 17.605 7.867 -5.633 1.00 0.00 H new ATOM 0 HG22 THR A 680 16.661 7.014 -4.389 1.00 0.00 H new ATOM 0 HG23 THR A 680 18.336 7.510 -4.050 1.00 0.00 H new ATOM 908 N LEU A 681 16.849 4.765 -2.315 1.00 0.00 N ATOM 909 CA LEU A 681 15.658 4.658 -1.527 1.00 0.00 C ATOM 910 C LEU A 681 14.621 5.659 -1.969 1.00 0.00 C ATOM 911 O LEU A 681 14.965 6.779 -2.389 1.00 0.00 O ATOM 912 CB LEU A 681 15.995 4.858 -0.066 1.00 0.00 C ATOM 913 CG LEU A 681 16.950 3.833 0.495 1.00 0.00 C ATOM 914 CD1 LEU A 681 17.166 4.072 1.955 1.00 0.00 C ATOM 915 CD2 LEU A 681 16.428 2.431 0.231 1.00 0.00 C ATOM 0 H LEU A 681 17.667 5.058 -1.781 1.00 0.00 H new ATOM 0 HA LEU A 681 15.239 3.662 -1.667 1.00 0.00 H new ATOM 0 HB2 LEU A 681 16.428 5.850 0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 681 15.073 4.835 0.514 1.00 0.00 H new ATOM 0 HG LEU A 681 17.914 3.930 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 681 17.857 3.326 2.348 1.00 0.00 H new ATOM 0 HD12 LEU A 681 17.585 5.067 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 681 16.214 3.997 2.481 1.00 0.00 H new ATOM 0 HD21 LEU A 681 17.125 1.700 0.640 1.00 0.00 H new ATOM 0 HD22 LEU A 681 15.455 2.310 0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 681 16.329 2.276 -0.843 1.00 0.00 H new ATOM 927 N PRO A 682 13.349 5.288 -1.879 1.00 0.00 N ATOM 928 CA PRO A 682 12.249 6.129 -2.316 1.00 0.00 C ATOM 929 C PRO A 682 12.015 7.364 -1.418 1.00 0.00 C ATOM 930 O PRO A 682 12.783 7.651 -0.480 1.00 0.00 O ATOM 931 CB PRO A 682 11.049 5.187 -2.257 1.00 0.00 C ATOM 932 CG PRO A 682 11.403 4.191 -1.220 1.00 0.00 C ATOM 933 CD PRO A 682 12.873 3.988 -1.346 1.00 0.00 C ATOM 0 HA PRO A 682 12.441 6.554 -3.301 1.00 0.00 H new ATOM 0 HB2 PRO A 682 10.137 5.724 -1.996 1.00 0.00 H new ATOM 0 HB3 PRO A 682 10.873 4.709 -3.221 1.00 0.00 H new ATOM 0 HG2 PRO A 682 11.141 4.551 -0.225 1.00 0.00 H new ATOM 0 HG3 PRO A 682 10.864 3.256 -1.374 1.00 0.00 H new ATOM 0 HD2 PRO A 682 13.331 3.754 -0.385 1.00 0.00 H new ATOM 0 HD3 PRO A 682 13.110 3.165 -2.020 1.00 0.00 H new ATOM 941 N VAL A 683 10.960 8.076 -1.721 1.00 0.00 N ATOM 942 CA VAL A 683 10.557 9.286 -1.030 1.00 0.00 C ATOM 943 C VAL A 683 9.052 9.230 -0.897 1.00 0.00 C ATOM 944 O VAL A 683 8.361 8.843 -1.847 1.00 0.00 O ATOM 945 CB VAL A 683 10.933 10.574 -1.857 1.00 0.00 C ATOM 946 CG1 VAL A 683 10.502 11.847 -1.142 1.00 0.00 C ATOM 947 CG2 VAL A 683 12.424 10.631 -2.166 1.00 0.00 C ATOM 0 H VAL A 683 10.331 7.824 -2.483 1.00 0.00 H new ATOM 0 HA VAL A 683 11.063 9.343 -0.066 1.00 0.00 H new ATOM 0 HB VAL A 683 10.389 10.507 -2.799 1.00 0.00 H new ATOM 0 HG11 VAL A 683 10.778 12.713 -1.743 1.00 0.00 H new ATOM 0 HG12 VAL A 683 9.422 11.835 -0.998 1.00 0.00 H new ATOM 0 HG13 VAL A 683 10.997 11.905 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL A 683 12.643 11.533 -2.737 1.00 0.00 H new ATOM 0 HG22 VAL A 683 12.988 10.646 -1.234 1.00 0.00 H new ATOM 0 HG23 VAL A 683 12.709 9.755 -2.749 1.00 0.00 H new ATOM 957 N CYS A 684 8.563 9.571 0.257 1.00 0.00 N ATOM 958 CA CYS A 684 7.151 9.604 0.518 1.00 0.00 C ATOM 959 C CYS A 684 6.738 11.054 0.715 1.00 0.00 C ATOM 960 O CYS A 684 7.353 11.769 1.508 1.00 0.00 O ATOM 961 CB CYS A 684 6.821 8.781 1.769 1.00 0.00 C ATOM 962 SG CYS A 684 7.125 7.003 1.640 1.00 0.00 S ATOM 0 H CYS A 684 9.139 9.838 1.056 1.00 0.00 H new ATOM 0 HA CYS A 684 6.606 9.171 -0.321 1.00 0.00 H new ATOM 0 HB2 CYS A 684 7.405 9.171 2.603 1.00 0.00 H new ATOM 0 HB3 CYS A 684 5.770 8.934 2.016 1.00 0.00 H new ATOM 967 N ILE A 685 5.735 11.479 -0.007 1.00 0.00 N ATOM 968 CA ILE A 685 5.263 12.860 0.023 1.00 0.00 C ATOM 969 C ILE A 685 3.788 12.873 0.338 1.00 0.00 C ATOM 970 O ILE A 685 3.092 11.964 -0.021 1.00 0.00 O ATOM 971 CB ILE A 685 5.478 13.556 -1.338 1.00 0.00 C ATOM 972 CG1 ILE A 685 4.849 12.710 -2.462 1.00 0.00 C ATOM 973 CG2 ILE A 685 6.964 13.809 -1.586 1.00 0.00 C ATOM 974 CD1 ILE A 685 4.851 13.364 -3.806 1.00 0.00 C ATOM 0 H ILE A 685 5.210 10.879 -0.643 1.00 0.00 H new ATOM 0 HA ILE A 685 5.829 13.395 0.785 1.00 0.00 H new ATOM 0 HB ILE A 685 4.983 14.527 -1.326 1.00 0.00 H new ATOM 0 HG12 ILE A 685 5.386 11.764 -2.532 1.00 0.00 H new ATOM 0 HG13 ILE A 685 3.821 12.473 -2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 685 7.093 14.300 -2.550 1.00 0.00 H new ATOM 0 HG22 ILE A 685 7.361 14.448 -0.797 1.00 0.00 H new ATOM 0 HG23 ILE A 685 7.499 12.860 -1.588 1.00 0.00 H new ATOM 0 HD11 ILE A 685 4.390 12.698 -4.535 1.00 0.00 H new ATOM 0 HD12 ILE A 685 4.287 14.296 -3.758 1.00 0.00 H new ATOM 0 HD13 ILE A 685 5.877 13.576 -4.106 1.00 0.00 H new ATOM 986 N VAL A 686 3.326 13.871 1.009 1.00 0.00 N ATOM 987 CA VAL A 686 1.921 13.921 1.370 1.00 0.00 C ATOM 988 C VAL A 686 1.145 14.674 0.304 1.00 0.00 C ATOM 989 O VAL A 686 1.394 15.861 0.047 1.00 0.00 O ATOM 990 CB VAL A 686 1.681 14.510 2.814 1.00 0.00 C ATOM 991 CG1 VAL A 686 2.236 15.910 2.973 1.00 0.00 C ATOM 992 CG2 VAL A 686 0.205 14.482 3.190 1.00 0.00 C ATOM 0 H VAL A 686 3.882 14.666 1.324 1.00 0.00 H new ATOM 0 HA VAL A 686 1.547 12.898 1.414 1.00 0.00 H new ATOM 0 HB VAL A 686 2.228 13.862 3.499 1.00 0.00 H new ATOM 0 HG11 VAL A 686 2.043 16.265 3.985 1.00 0.00 H new ATOM 0 HG12 VAL A 686 3.311 15.898 2.792 1.00 0.00 H new ATOM 0 HG13 VAL A 686 1.755 16.576 2.257 1.00 0.00 H new ATOM 0 HG21 VAL A 686 0.077 14.895 4.191 1.00 0.00 H new ATOM 0 HG22 VAL A 686 -0.364 15.078 2.476 1.00 0.00 H new ATOM 0 HG23 VAL A 686 -0.155 13.453 3.173 1.00 0.00 H new ATOM 1002 N GLU A 687 0.242 13.989 -0.344 1.00 0.00 N ATOM 1003 CA GLU A 687 -0.540 14.591 -1.391 1.00 0.00 C ATOM 1004 C GLU A 687 -1.644 15.443 -0.776 1.00 0.00 C ATOM 1005 O GLU A 687 -2.164 16.385 -1.404 1.00 0.00 O ATOM 1006 CB GLU A 687 -1.084 13.530 -2.359 1.00 0.00 C ATOM 1007 CG GLU A 687 -2.284 12.709 -1.919 1.00 0.00 C ATOM 1008 CD GLU A 687 -2.247 12.225 -0.488 1.00 0.00 C ATOM 1009 OE1 GLU A 687 -1.189 11.791 -0.021 1.00 0.00 O ATOM 1010 OE2 GLU A 687 -3.278 12.357 0.184 1.00 0.00 O ATOM 0 H GLU A 687 0.028 13.008 -0.164 1.00 0.00 H new ATOM 0 HA GLU A 687 0.096 15.245 -1.987 1.00 0.00 H new ATOM 0 HB2 GLU A 687 -1.346 14.032 -3.290 1.00 0.00 H new ATOM 0 HB3 GLU A 687 -0.272 12.839 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 687 -3.184 13.308 -2.059 1.00 0.00 H new ATOM 0 HG3 GLU A 687 -2.371 11.843 -2.576 1.00 0.00 H new ATOM 1017 N GLU A 688 -1.991 15.066 0.459 1.00 0.00 N ATOM 1018 CA GLU A 688 -2.939 15.740 1.313 1.00 0.00 C ATOM 1019 C GLU A 688 -4.302 15.812 0.612 1.00 0.00 C ATOM 1020 O GLU A 688 -4.945 16.859 0.549 1.00 0.00 O ATOM 1021 CB GLU A 688 -2.395 17.125 1.693 1.00 0.00 C ATOM 1022 CG GLU A 688 -2.811 17.581 3.073 1.00 0.00 C ATOM 1023 CD GLU A 688 -2.289 18.947 3.418 1.00 0.00 C ATOM 1024 OE1 GLU A 688 -1.133 19.064 3.863 1.00 0.00 O ATOM 1025 OE2 GLU A 688 -3.035 19.931 3.282 1.00 0.00 O ATOM 0 H GLU A 688 -1.590 14.238 0.900 1.00 0.00 H new ATOM 0 HA GLU A 688 -3.081 15.183 2.239 1.00 0.00 H new ATOM 0 HB2 GLU A 688 -1.307 17.106 1.639 1.00 0.00 H new ATOM 0 HB3 GLU A 688 -2.738 17.855 0.960 1.00 0.00 H new ATOM 0 HG2 GLU A 688 -3.899 17.587 3.136 1.00 0.00 H new ATOM 0 HG3 GLU A 688 -2.453 16.863 3.811 1.00 0.00 H new ATOM 1032 N SER A 689 -4.723 14.687 0.082 1.00 0.00 N ATOM 1033 CA SER A 689 -5.954 14.592 -0.662 1.00 0.00 C ATOM 1034 C SER A 689 -6.798 13.442 -0.121 1.00 0.00 C ATOM 1035 O SER A 689 -6.266 12.479 0.377 1.00 0.00 O ATOM 1036 CB SER A 689 -5.612 14.381 -2.132 1.00 0.00 C ATOM 1037 OG SER A 689 -4.765 15.437 -2.588 1.00 0.00 O ATOM 0 H SER A 689 -4.215 13.806 0.157 1.00 0.00 H new ATOM 0 HA SER A 689 -6.536 15.508 -0.558 1.00 0.00 H new ATOM 0 HB2 SER A 689 -5.114 13.420 -2.265 1.00 0.00 H new ATOM 0 HB3 SER A 689 -6.525 14.352 -2.727 1.00 0.00 H new ATOM 0 HG SER A 689 -3.936 15.440 -2.066 1.00 0.00 H new ATOM 1043 N THR A 690 -8.100 13.554 -0.203 1.00 0.00 N ATOM 1044 CA THR A 690 -8.960 12.551 0.355 1.00 0.00 C ATOM 1045 C THR A 690 -9.930 11.973 -0.667 1.00 0.00 C ATOM 1046 O THR A 690 -10.367 12.660 -1.586 1.00 0.00 O ATOM 1047 CB THR A 690 -9.743 13.117 1.550 1.00 0.00 C ATOM 1048 OG1 THR A 690 -10.296 14.397 1.199 1.00 0.00 O ATOM 1049 CG2 THR A 690 -8.856 13.264 2.762 1.00 0.00 C ATOM 0 H THR A 690 -8.584 14.332 -0.652 1.00 0.00 H new ATOM 0 HA THR A 690 -8.314 11.739 0.689 1.00 0.00 H new ATOM 0 HB THR A 690 -10.545 12.420 1.796 1.00 0.00 H new ATOM 0 HG1 THR A 690 -10.797 14.757 1.961 1.00 0.00 H new ATOM 0 HG21 THR A 690 -9.437 13.667 3.592 1.00 0.00 H new ATOM 0 HG22 THR A 690 -8.455 12.289 3.039 1.00 0.00 H new ATOM 0 HG23 THR A 690 -8.035 13.942 2.532 1.00 0.00 H new ATOM 1057 N CYS A 691 -10.241 10.708 -0.502 1.00 0.00 N ATOM 1058 CA CYS A 691 -11.220 10.013 -1.333 1.00 0.00 C ATOM 1059 C CYS A 691 -12.641 10.240 -0.855 1.00 0.00 C ATOM 1060 O CYS A 691 -13.591 9.788 -1.483 1.00 0.00 O ATOM 1061 CB CYS A 691 -10.909 8.517 -1.404 1.00 0.00 C ATOM 1062 SG CYS A 691 -9.711 8.075 -2.694 1.00 0.00 S ATOM 0 H CYS A 691 -9.822 10.119 0.218 1.00 0.00 H new ATOM 0 HA CYS A 691 -11.144 10.434 -2.335 1.00 0.00 H new ATOM 0 HB2 CYS A 691 -10.525 8.190 -0.438 1.00 0.00 H new ATOM 0 HB3 CYS A 691 -11.836 7.971 -1.580 1.00 0.00 H new ATOM 1067 N GLY A 692 -12.784 10.920 0.252 1.00 0.00 N ATOM 1068 CA GLY A 692 -14.089 11.199 0.769 1.00 0.00 C ATOM 1069 C GLY A 692 -14.451 10.189 1.797 1.00 0.00 C ATOM 1070 O GLY A 692 -14.171 10.381 2.978 1.00 0.00 O ATOM 0 H GLY A 692 -12.013 11.288 0.809 1.00 0.00 H new ATOM 0 HA2 GLY A 692 -14.112 12.198 1.204 1.00 0.00 H new ATOM 0 HA3 GLY A 692 -14.820 11.187 -0.039 1.00 0.00 H new ATOM 1074 N ASP A 693 -15.016 9.099 1.364 1.00 0.00 N ATOM 1075 CA ASP A 693 -15.380 8.024 2.255 1.00 0.00 C ATOM 1076 C ASP A 693 -15.406 6.718 1.495 1.00 0.00 C ATOM 1077 O ASP A 693 -14.956 6.650 0.346 1.00 0.00 O ATOM 1078 CB ASP A 693 -16.730 8.290 2.984 1.00 0.00 C ATOM 1079 CG ASP A 693 -17.973 8.148 2.127 1.00 0.00 C ATOM 1080 OD1 ASP A 693 -18.158 8.913 1.156 1.00 0.00 O ATOM 1081 OD2 ASP A 693 -18.809 7.281 2.433 1.00 0.00 O ATOM 0 H ASP A 693 -15.239 8.926 0.384 1.00 0.00 H new ATOM 0 HA ASP A 693 -14.623 7.962 3.037 1.00 0.00 H new ATOM 0 HB2 ASP A 693 -16.810 7.603 3.826 1.00 0.00 H new ATOM 0 HB3 ASP A 693 -16.708 9.299 3.397 1.00 0.00 H new ATOM 1086 N ILE A 694 -15.840 5.689 2.150 1.00 0.00 N ATOM 1087 CA ILE A 694 -15.973 4.394 1.582 1.00 0.00 C ATOM 1088 C ILE A 694 -17.124 4.320 0.585 1.00 0.00 C ATOM 1089 O ILE A 694 -18.226 4.811 0.840 1.00 0.00 O ATOM 1090 CB ILE A 694 -16.064 3.367 2.725 1.00 0.00 C ATOM 1091 CG1 ILE A 694 -14.651 2.920 3.058 1.00 0.00 C ATOM 1092 CG2 ILE A 694 -17.001 2.197 2.428 1.00 0.00 C ATOM 1093 CD1 ILE A 694 -14.406 2.680 4.505 1.00 0.00 C ATOM 0 H ILE A 694 -16.120 5.733 3.130 1.00 0.00 H new ATOM 0 HA ILE A 694 -15.093 4.155 0.985 1.00 0.00 H new ATOM 0 HB ILE A 694 -16.519 3.842 3.594 1.00 0.00 H new ATOM 0 HG12 ILE A 694 -14.434 2.004 2.509 1.00 0.00 H new ATOM 0 HG13 ILE A 694 -13.951 3.677 2.704 1.00 0.00 H new ATOM 0 HG21 ILE A 694 -17.013 1.516 3.279 1.00 0.00 H new ATOM 0 HG22 ILE A 694 -18.008 2.574 2.250 1.00 0.00 H new ATOM 0 HG23 ILE A 694 -16.651 1.666 1.543 1.00 0.00 H new ATOM 0 HD11 ILE A 694 -13.373 2.365 4.652 1.00 0.00 H new ATOM 0 HD12 ILE A 694 -14.587 3.599 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 694 -15.078 1.900 4.863 1.00 0.00 H new ATOM 1105 N PRO A 695 -16.850 3.734 -0.570 1.00 0.00 N ATOM 1106 CA PRO A 695 -17.814 3.600 -1.647 1.00 0.00 C ATOM 1107 C PRO A 695 -18.890 2.579 -1.328 1.00 0.00 C ATOM 1108 O PRO A 695 -18.916 1.972 -0.245 1.00 0.00 O ATOM 1109 CB PRO A 695 -16.964 3.102 -2.815 1.00 0.00 C ATOM 1110 CG PRO A 695 -15.850 2.381 -2.166 1.00 0.00 C ATOM 1111 CD PRO A 695 -15.564 3.136 -0.912 1.00 0.00 C ATOM 0 HA PRO A 695 -18.341 4.534 -1.841 1.00 0.00 H new ATOM 0 HB2 PRO A 695 -17.535 2.446 -3.472 1.00 0.00 H new ATOM 0 HB3 PRO A 695 -16.602 3.929 -3.426 1.00 0.00 H new ATOM 0 HG2 PRO A 695 -16.124 1.349 -1.949 1.00 0.00 H new ATOM 0 HG3 PRO A 695 -14.974 2.348 -2.813 1.00 0.00 H new ATOM 0 HD2 PRO A 695 -15.205 2.478 -0.121 1.00 0.00 H new ATOM 0 HD3 PRO A 695 -14.797 3.895 -1.067 1.00 0.00 H new ATOM 1119 N GLU A 696 -19.743 2.382 -2.253 1.00 0.00 N ATOM 1120 CA GLU A 696 -20.815 1.480 -2.097 1.00 0.00 C ATOM 1121 C GLU A 696 -20.619 0.271 -2.994 1.00 0.00 C ATOM 1122 O GLU A 696 -20.526 0.394 -4.223 1.00 0.00 O ATOM 1123 CB GLU A 696 -22.143 2.179 -2.383 1.00 0.00 C ATOM 1124 CG GLU A 696 -23.352 1.291 -2.216 1.00 0.00 C ATOM 1125 CD GLU A 696 -24.641 2.030 -2.390 1.00 0.00 C ATOM 1126 OE1 GLU A 696 -25.186 2.536 -1.387 1.00 0.00 O ATOM 1127 OE2 GLU A 696 -25.158 2.092 -3.520 1.00 0.00 O ATOM 0 H GLU A 696 -19.717 2.851 -3.158 1.00 0.00 H new ATOM 0 HA GLU A 696 -20.839 1.130 -1.065 1.00 0.00 H new ATOM 0 HB2 GLU A 696 -22.241 3.037 -1.718 1.00 0.00 H new ATOM 0 HB3 GLU A 696 -22.127 2.565 -3.402 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -23.303 0.478 -2.941 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -23.330 0.837 -1.226 1.00 0.00 H new ATOM 1134 N LEU A 697 -20.505 -0.873 -2.379 1.00 0.00 N ATOM 1135 CA LEU A 697 -20.405 -2.114 -3.094 1.00 0.00 C ATOM 1136 C LEU A 697 -21.837 -2.617 -3.176 1.00 0.00 C ATOM 1137 O LEU A 697 -22.579 -2.472 -2.201 1.00 0.00 O ATOM 1138 CB LEU A 697 -19.489 -3.089 -2.296 1.00 0.00 C ATOM 1139 CG LEU A 697 -18.944 -4.376 -2.989 1.00 0.00 C ATOM 1140 CD1 LEU A 697 -17.947 -5.057 -2.082 1.00 0.00 C ATOM 1141 CD2 LEU A 697 -20.033 -5.372 -3.335 1.00 0.00 C ATOM 0 H LEU A 697 -20.479 -0.971 -1.364 1.00 0.00 H new ATOM 0 HA LEU A 697 -19.965 -2.018 -4.087 1.00 0.00 H new ATOM 0 HB2 LEU A 697 -18.629 -2.517 -1.948 1.00 0.00 H new ATOM 0 HB3 LEU A 697 -20.041 -3.404 -1.411 1.00 0.00 H new ATOM 0 HG LEU A 697 -18.479 -4.053 -3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 697 -17.568 -5.956 -2.568 1.00 0.00 H new ATOM 0 HD12 LEU A 697 -17.119 -4.378 -1.877 1.00 0.00 H new ATOM 0 HD13 LEU A 697 -18.434 -5.329 -1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 697 -19.589 -6.245 -3.814 1.00 0.00 H new ATOM 0 HD22 LEU A 697 -20.547 -5.680 -2.424 1.00 0.00 H new ATOM 0 HD23 LEU A 697 -20.747 -4.908 -4.015 1.00 0.00 H new ATOM 1153 N GLU A 698 -22.213 -3.196 -4.311 1.00 0.00 N ATOM 1154 CA GLU A 698 -23.589 -3.654 -4.599 1.00 0.00 C ATOM 1155 C GLU A 698 -24.219 -4.435 -3.435 1.00 0.00 C ATOM 1156 O GLU A 698 -25.412 -4.329 -3.176 1.00 0.00 O ATOM 1157 CB GLU A 698 -23.592 -4.488 -5.878 1.00 0.00 C ATOM 1158 CG GLU A 698 -22.765 -5.760 -5.786 1.00 0.00 C ATOM 1159 CD GLU A 698 -22.457 -6.328 -7.124 1.00 0.00 C ATOM 1160 OE1 GLU A 698 -23.284 -7.058 -7.675 1.00 0.00 O ATOM 1161 OE2 GLU A 698 -21.381 -6.038 -7.648 1.00 0.00 O ATOM 0 H GLU A 698 -21.565 -3.369 -5.079 1.00 0.00 H new ATOM 0 HA GLU A 698 -24.207 -2.767 -4.736 1.00 0.00 H new ATOM 0 HB2 GLU A 698 -24.620 -4.752 -6.125 1.00 0.00 H new ATOM 0 HB3 GLU A 698 -23.213 -3.879 -6.698 1.00 0.00 H new ATOM 0 HG2 GLU A 698 -21.834 -5.549 -5.260 1.00 0.00 H new ATOM 0 HG3 GLU A 698 -23.304 -6.500 -5.195 1.00 0.00 H new ATOM 1168 N HIS A 699 -23.407 -5.215 -2.750 1.00 0.00 N ATOM 1169 CA HIS A 699 -23.830 -5.984 -1.603 1.00 0.00 C ATOM 1170 C HIS A 699 -22.680 -6.082 -0.623 1.00 0.00 C ATOM 1171 O HIS A 699 -22.468 -7.113 -0.006 1.00 0.00 O ATOM 1172 CB HIS A 699 -24.324 -7.394 -2.007 1.00 0.00 C ATOM 1173 CG HIS A 699 -25.606 -7.412 -2.794 1.00 0.00 C ATOM 1174 ND1 HIS A 699 -26.827 -7.177 -2.229 1.00 0.00 N ATOM 1175 CD2 HIS A 699 -25.844 -7.634 -4.104 1.00 0.00 C ATOM 1176 CE1 HIS A 699 -27.759 -7.255 -3.143 1.00 0.00 C ATOM 1177 NE2 HIS A 699 -27.192 -7.531 -4.289 1.00 0.00 N ATOM 0 H HIS A 699 -22.420 -5.332 -2.980 1.00 0.00 H new ATOM 0 HA HIS A 699 -24.672 -5.475 -1.134 1.00 0.00 H new ATOM 0 HB2 HIS A 699 -23.546 -7.881 -2.595 1.00 0.00 H new ATOM 0 HB3 HIS A 699 -24.460 -7.989 -1.104 1.00 0.00 H new ATOM 0 HD2 HIS A 699 -25.107 -7.852 -4.862 1.00 0.00 H new ATOM 0 HE1 HIS A 699 -28.817 -7.115 -2.979 1.00 0.00 H new ATOM 0 HE2 HIS A 699 -27.679 -7.650 -5.177 1.00 0.00 H new ATOM 1186 N GLY A 700 -21.929 -5.008 -0.504 1.00 0.00 N ATOM 1187 CA GLY A 700 -20.820 -4.982 0.427 1.00 0.00 C ATOM 1188 C GLY A 700 -20.589 -3.616 1.052 1.00 0.00 C ATOM 1189 O GLY A 700 -21.184 -2.613 0.632 1.00 0.00 O ATOM 0 H GLY A 700 -22.064 -4.148 -1.035 1.00 0.00 H new ATOM 0 HA2 GLY A 700 -21.002 -5.709 1.218 1.00 0.00 H new ATOM 0 HA3 GLY A 700 -19.913 -5.295 -0.091 1.00 0.00 H new ATOM 1193 N TRP A 701 -19.705 -3.594 2.029 1.00 0.00 N ATOM 1194 CA TRP A 701 -19.332 -2.445 2.815 1.00 0.00 C ATOM 1195 C TRP A 701 -17.961 -2.720 3.357 1.00 0.00 C ATOM 1196 O TRP A 701 -17.249 -3.502 2.766 1.00 0.00 O ATOM 1197 CB TRP A 701 -20.361 -2.154 3.915 1.00 0.00 C ATOM 1198 CG TRP A 701 -20.970 -3.370 4.516 1.00 0.00 C ATOM 1199 CD1 TRP A 701 -22.075 -3.978 4.074 1.00 0.00 C ATOM 1200 CD2 TRP A 701 -20.515 -4.123 5.634 1.00 0.00 C ATOM 1201 NE1 TRP A 701 -22.369 -5.060 4.840 1.00 0.00 N ATOM 1202 CE2 TRP A 701 -21.423 -5.180 5.813 1.00 0.00 C ATOM 1203 CE3 TRP A 701 -19.440 -4.006 6.498 1.00 0.00 C ATOM 1204 CZ2 TRP A 701 -21.282 -6.117 6.827 1.00 0.00 C ATOM 1205 CZ3 TRP A 701 -19.293 -4.927 7.499 1.00 0.00 C ATOM 1206 CH2 TRP A 701 -20.210 -5.976 7.661 1.00 0.00 C ATOM 0 H TRP A 701 -19.198 -4.434 2.309 1.00 0.00 H new ATOM 0 HA TRP A 701 -19.314 -1.541 2.206 1.00 0.00 H new ATOM 0 HB2 TRP A 701 -19.880 -1.575 4.703 1.00 0.00 H new ATOM 0 HB3 TRP A 701 -21.154 -1.531 3.500 1.00 0.00 H new ATOM 0 HD1 TRP A 701 -22.655 -3.653 3.223 1.00 0.00 H new ATOM 0 HE1 TRP A 701 -23.167 -5.681 4.708 1.00 0.00 H new ATOM 0 HE3 TRP A 701 -18.729 -3.201 6.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 -21.990 -6.923 6.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 -18.456 -4.845 8.177 1.00 0.00 H new ATOM 0 HH2 TRP A 701 -20.065 -6.686 8.461 1.00 0.00 H new ATOM 1217 N ALA A 702 -17.590 -2.180 4.467 1.00 0.00 N ATOM 1218 CA ALA A 702 -16.207 -2.237 4.827 1.00 0.00 C ATOM 1219 C ALA A 702 -15.965 -2.631 6.271 1.00 0.00 C ATOM 1220 O ALA A 702 -16.796 -2.405 7.133 1.00 0.00 O ATOM 1221 CB ALA A 702 -15.609 -0.904 4.509 1.00 0.00 C ATOM 0 H ALA A 702 -18.203 -1.705 5.129 1.00 0.00 H new ATOM 0 HA ALA A 702 -15.727 -3.029 4.252 1.00 0.00 H new ATOM 0 HB1 ALA A 702 -14.551 -0.908 4.771 1.00 0.00 H new ATOM 0 HB2 ALA A 702 -15.719 -0.701 3.444 1.00 0.00 H new ATOM 0 HB3 ALA A 702 -16.121 -0.130 5.080 1.00 0.00 H new ATOM 1227 N GLN A 703 -14.806 -3.233 6.519 1.00 0.00 N ATOM 1228 CA GLN A 703 -14.424 -3.628 7.875 1.00 0.00 C ATOM 1229 C GLN A 703 -13.731 -2.490 8.566 1.00 0.00 C ATOM 1230 O GLN A 703 -14.051 -2.155 9.693 1.00 0.00 O ATOM 1231 CB GLN A 703 -13.503 -4.871 7.919 1.00 0.00 C ATOM 1232 CG GLN A 703 -14.170 -6.184 7.559 1.00 0.00 C ATOM 1233 CD GLN A 703 -13.763 -6.749 6.207 1.00 0.00 C ATOM 1234 OE1 GLN A 703 -13.384 -5.917 5.286 1.00 0.00 O flip ATOM 1235 NE2 GLN A 703 -13.770 -7.943 6.011 1.00 0.00 N flip ATOM 0 H GLN A 703 -14.115 -3.458 5.803 1.00 0.00 H new ATOM 0 HA GLN A 703 -15.351 -3.890 8.385 1.00 0.00 H new ATOM 0 HB2 GLN A 703 -12.668 -4.708 7.238 1.00 0.00 H new ATOM 0 HB3 GLN A 703 -13.085 -4.958 8.922 1.00 0.00 H new ATOM 0 HG2 GLN A 703 -13.938 -6.918 8.330 1.00 0.00 H new ATOM 0 HG3 GLN A 703 -15.251 -6.043 7.569 1.00 0.00 H new ATOM 0 HE21 GLN A 703 -14.072 -8.579 6.749 1.00 0.00 H new ATOM 0 HE22 GLN A 703 -13.474 -8.313 5.108 1.00 0.00 H new ATOM 1244 N LEU A 704 -12.787 -1.890 7.880 1.00 0.00 N ATOM 1245 CA LEU A 704 -12.036 -0.816 8.454 1.00 0.00 C ATOM 1246 C LEU A 704 -12.200 0.445 7.664 1.00 0.00 C ATOM 1247 O LEU A 704 -12.135 0.439 6.434 1.00 0.00 O ATOM 1248 CB LEU A 704 -10.541 -1.197 8.690 1.00 0.00 C ATOM 1249 CG LEU A 704 -9.672 -1.678 7.492 1.00 0.00 C ATOM 1250 CD1 LEU A 704 -9.244 -0.537 6.575 1.00 0.00 C ATOM 1251 CD2 LEU A 704 -8.455 -2.424 7.999 1.00 0.00 C ATOM 0 H LEU A 704 -12.526 -2.132 6.924 1.00 0.00 H new ATOM 0 HA LEU A 704 -12.448 -0.622 9.444 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -10.047 -0.327 9.123 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -10.520 -1.983 9.445 1.00 0.00 H new ATOM 0 HG LEU A 704 -10.294 -2.346 6.896 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -8.641 -0.933 5.758 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -10.128 -0.046 6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -8.657 0.185 7.142 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -7.853 -2.756 7.153 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -7.860 -1.764 8.630 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -8.774 -3.290 8.579 1.00 0.00 H new ATOM 1263 N SER A 705 -12.511 1.483 8.356 1.00 0.00 N ATOM 1264 CA SER A 705 -12.609 2.778 7.800 1.00 0.00 C ATOM 1265 C SER A 705 -11.732 3.692 8.635 1.00 0.00 C ATOM 1266 O SER A 705 -11.854 3.711 9.867 1.00 0.00 O ATOM 1267 CB SER A 705 -14.047 3.245 7.915 1.00 0.00 C ATOM 1268 OG SER A 705 -14.940 2.197 7.574 1.00 0.00 O ATOM 0 H SER A 705 -12.710 1.449 9.356 1.00 0.00 H new ATOM 0 HA SER A 705 -12.301 2.784 6.755 1.00 0.00 H new ATOM 0 HB2 SER A 705 -14.245 3.583 8.932 1.00 0.00 H new ATOM 0 HB3 SER A 705 -14.212 4.099 7.258 1.00 0.00 H new ATOM 0 HG SER A 705 -15.864 2.515 7.655 1.00 0.00 H new ATOM 1274 N SER A 706 -10.834 4.397 8.022 1.00 0.00 N ATOM 1275 CA SER A 706 -10.032 5.317 8.760 1.00 0.00 C ATOM 1276 C SER A 706 -9.939 6.641 8.005 1.00 0.00 C ATOM 1277 O SER A 706 -9.142 6.796 7.093 1.00 0.00 O ATOM 1278 CB SER A 706 -8.649 4.710 9.037 1.00 0.00 C ATOM 1279 OG SER A 706 -7.908 5.475 9.974 1.00 0.00 O ATOM 0 H SER A 706 -10.640 4.354 7.022 1.00 0.00 H new ATOM 0 HA SER A 706 -10.496 5.518 9.726 1.00 0.00 H new ATOM 0 HB2 SER A 706 -8.768 3.694 9.413 1.00 0.00 H new ATOM 0 HB3 SER A 706 -8.090 4.641 8.104 1.00 0.00 H new ATOM 0 HG SER A 706 -7.036 5.054 10.123 1.00 0.00 H new ATOM 1285 N PRO A 707 -10.835 7.575 8.311 1.00 0.00 N ATOM 1286 CA PRO A 707 -10.823 8.889 7.716 1.00 0.00 C ATOM 1287 C PRO A 707 -9.914 9.855 8.490 1.00 0.00 C ATOM 1288 O PRO A 707 -9.691 9.677 9.700 1.00 0.00 O ATOM 1289 CB PRO A 707 -12.283 9.331 7.776 1.00 0.00 C ATOM 1290 CG PRO A 707 -13.006 8.267 8.567 1.00 0.00 C ATOM 1291 CD PRO A 707 -11.957 7.430 9.227 1.00 0.00 C ATOM 0 HA PRO A 707 -10.427 8.881 6.701 1.00 0.00 H new ATOM 0 HB2 PRO A 707 -12.377 10.305 8.256 1.00 0.00 H new ATOM 0 HB3 PRO A 707 -12.703 9.427 6.775 1.00 0.00 H new ATOM 0 HG2 PRO A 707 -13.664 8.718 9.310 1.00 0.00 H new ATOM 0 HG3 PRO A 707 -13.632 7.658 7.914 1.00 0.00 H new ATOM 0 HD2 PRO A 707 -11.717 7.791 10.227 1.00 0.00 H new ATOM 0 HD3 PRO A 707 -12.269 6.391 9.329 1.00 0.00 H new ATOM 1299 N PRO A 708 -9.369 10.879 7.822 1.00 0.00 N ATOM 1300 CA PRO A 708 -9.603 11.118 6.397 1.00 0.00 C ATOM 1301 C PRO A 708 -8.865 10.099 5.517 1.00 0.00 C ATOM 1302 O PRO A 708 -7.713 9.751 5.780 1.00 0.00 O ATOM 1303 CB PRO A 708 -9.067 12.532 6.186 1.00 0.00 C ATOM 1304 CG PRO A 708 -8.027 12.700 7.230 1.00 0.00 C ATOM 1305 CD PRO A 708 -8.476 11.891 8.410 1.00 0.00 C ATOM 0 HA PRO A 708 -10.652 11.013 6.120 1.00 0.00 H new ATOM 0 HB2 PRO A 708 -8.648 12.652 5.187 1.00 0.00 H new ATOM 0 HB3 PRO A 708 -9.858 13.275 6.291 1.00 0.00 H new ATOM 0 HG2 PRO A 708 -7.057 12.357 6.870 1.00 0.00 H new ATOM 0 HG3 PRO A 708 -7.914 13.750 7.500 1.00 0.00 H new ATOM 0 HD2 PRO A 708 -7.632 11.430 8.924 1.00 0.00 H new ATOM 0 HD3 PRO A 708 -8.997 12.507 9.143 1.00 0.00 H new ATOM 1313 N TYR A 709 -9.553 9.613 4.508 1.00 0.00 N ATOM 1314 CA TYR A 709 -9.017 8.596 3.613 1.00 0.00 C ATOM 1315 C TYR A 709 -8.142 9.270 2.570 1.00 0.00 C ATOM 1316 O TYR A 709 -8.659 9.782 1.562 1.00 0.00 O ATOM 1317 CB TYR A 709 -10.163 7.852 2.897 1.00 0.00 C ATOM 1318 CG TYR A 709 -11.246 7.318 3.804 1.00 0.00 C ATOM 1319 CD1 TYR A 709 -11.170 6.057 4.398 1.00 0.00 C ATOM 1320 CD2 TYR A 709 -12.365 8.077 4.039 1.00 0.00 C ATOM 1321 CE1 TYR A 709 -12.213 5.594 5.197 1.00 0.00 C ATOM 1322 CE2 TYR A 709 -13.383 7.634 4.824 1.00 0.00 C ATOM 1323 CZ TYR A 709 -13.315 6.402 5.399 1.00 0.00 C ATOM 1324 OH TYR A 709 -14.364 5.966 6.166 1.00 0.00 O ATOM 0 H TYR A 709 -10.502 9.908 4.279 1.00 0.00 H new ATOM 0 HA TYR A 709 -8.437 7.880 4.195 1.00 0.00 H new ATOM 0 HB2 TYR A 709 -10.618 8.528 2.173 1.00 0.00 H new ATOM 0 HB3 TYR A 709 -9.739 7.020 2.334 1.00 0.00 H new ATOM 0 HD1 TYR A 709 -10.300 5.438 4.238 1.00 0.00 H new ATOM 0 HD2 TYR A 709 -12.439 9.055 3.587 1.00 0.00 H new ATOM 0 HE1 TYR A 709 -12.161 4.616 5.653 1.00 0.00 H new ATOM 0 HE2 TYR A 709 -14.247 8.260 4.992 1.00 0.00 H new ATOM 0 HH TYR A 709 -15.053 6.662 6.203 1.00 0.00 H new ATOM 1334 N TYR A 710 -6.861 9.331 2.838 1.00 0.00 N ATOM 1335 CA TYR A 710 -5.896 9.961 1.939 1.00 0.00 C ATOM 1336 C TYR A 710 -5.556 9.065 0.778 1.00 0.00 C ATOM 1337 O TYR A 710 -5.860 7.856 0.797 1.00 0.00 O ATOM 1338 CB TYR A 710 -4.611 10.348 2.675 1.00 0.00 C ATOM 1339 CG TYR A 710 -4.642 11.683 3.384 1.00 0.00 C ATOM 1340 CD1 TYR A 710 -5.757 12.123 4.067 1.00 0.00 C ATOM 1341 CD2 TYR A 710 -3.523 12.498 3.382 1.00 0.00 C ATOM 1342 CE1 TYR A 710 -5.757 13.333 4.722 1.00 0.00 C ATOM 1343 CE2 TYR A 710 -3.516 13.708 4.031 1.00 0.00 C ATOM 1344 CZ TYR A 710 -4.636 14.118 4.700 1.00 0.00 C ATOM 1345 OH TYR A 710 -4.640 15.328 5.355 1.00 0.00 O ATOM 0 H TYR A 710 -6.446 8.947 3.687 1.00 0.00 H new ATOM 0 HA TYR A 710 -6.370 10.866 1.559 1.00 0.00 H new ATOM 0 HB2 TYR A 710 -4.385 9.573 3.407 1.00 0.00 H new ATOM 0 HB3 TYR A 710 -3.791 10.357 1.957 1.00 0.00 H new ATOM 0 HD1 TYR A 710 -6.644 11.508 4.088 1.00 0.00 H new ATOM 0 HD2 TYR A 710 -2.636 12.175 2.858 1.00 0.00 H new ATOM 0 HE1 TYR A 710 -6.639 13.662 5.252 1.00 0.00 H new ATOM 0 HE2 TYR A 710 -2.634 14.331 4.013 1.00 0.00 H new ATOM 0 HH TYR A 710 -3.769 15.763 5.244 1.00 0.00 H new ATOM 1355 N TYR A 711 -4.925 9.637 -0.230 1.00 0.00 N ATOM 1356 CA TYR A 711 -4.497 8.871 -1.380 1.00 0.00 C ATOM 1357 C TYR A 711 -3.411 7.932 -0.901 1.00 0.00 C ATOM 1358 O TYR A 711 -2.565 8.297 -0.093 1.00 0.00 O ATOM 1359 CB TYR A 711 -3.968 9.806 -2.498 1.00 0.00 C ATOM 1360 CG TYR A 711 -3.525 9.157 -3.840 1.00 0.00 C ATOM 1361 CD1 TYR A 711 -2.561 8.158 -3.896 1.00 0.00 C ATOM 1362 CD2 TYR A 711 -4.053 9.581 -5.038 1.00 0.00 C ATOM 1363 CE1 TYR A 711 -2.145 7.605 -5.071 1.00 0.00 C ATOM 1364 CE2 TYR A 711 -3.635 9.029 -6.235 1.00 0.00 C ATOM 1365 CZ TYR A 711 -2.681 8.041 -6.242 1.00 0.00 C ATOM 1366 OH TYR A 711 -2.262 7.495 -7.436 1.00 0.00 O ATOM 0 H TYR A 711 -4.698 10.631 -0.274 1.00 0.00 H new ATOM 0 HA TYR A 711 -5.330 8.312 -1.806 1.00 0.00 H new ATOM 0 HB2 TYR A 711 -4.747 10.535 -2.720 1.00 0.00 H new ATOM 0 HB3 TYR A 711 -3.118 10.359 -2.097 1.00 0.00 H new ATOM 0 HD1 TYR A 711 -2.124 7.806 -2.973 1.00 0.00 H new ATOM 0 HD2 TYR A 711 -4.805 10.356 -5.043 1.00 0.00 H new ATOM 0 HE1 TYR A 711 -1.396 6.827 -5.071 1.00 0.00 H new ATOM 0 HE2 TYR A 711 -4.059 9.375 -7.166 1.00 0.00 H new ATOM 0 HH TYR A 711 -1.987 6.565 -7.292 1.00 0.00 H new ATOM 1376 N GLY A 712 -3.458 6.724 -1.353 1.00 0.00 N ATOM 1377 CA GLY A 712 -2.460 5.796 -0.948 1.00 0.00 C ATOM 1378 C GLY A 712 -2.916 4.944 0.221 1.00 0.00 C ATOM 1379 O GLY A 712 -2.315 3.905 0.508 1.00 0.00 O ATOM 0 H GLY A 712 -4.165 6.361 -1.993 1.00 0.00 H new ATOM 0 HA2 GLY A 712 -2.203 5.151 -1.788 1.00 0.00 H new ATOM 0 HA3 GLY A 712 -1.554 6.336 -0.672 1.00 0.00 H new ATOM 1383 N ASP A 713 -3.978 5.374 0.906 1.00 0.00 N ATOM 1384 CA ASP A 713 -4.555 4.584 2.002 1.00 0.00 C ATOM 1385 C ASP A 713 -5.391 3.455 1.431 1.00 0.00 C ATOM 1386 O ASP A 713 -5.760 3.480 0.243 1.00 0.00 O ATOM 1387 CB ASP A 713 -5.394 5.450 2.967 1.00 0.00 C ATOM 1388 CG ASP A 713 -5.979 4.666 4.140 1.00 0.00 C ATOM 1389 OD1 ASP A 713 -5.291 3.760 4.682 1.00 0.00 O ATOM 1390 OD2 ASP A 713 -7.117 4.942 4.545 1.00 0.00 O ATOM 0 H ASP A 713 -4.455 6.257 0.725 1.00 0.00 H new ATOM 0 HA ASP A 713 -3.733 4.169 2.585 1.00 0.00 H new ATOM 0 HB2 ASP A 713 -4.770 6.256 3.354 1.00 0.00 H new ATOM 0 HB3 ASP A 713 -6.207 5.916 2.410 1.00 0.00 H new ATOM 1395 N SER A 714 -5.712 2.502 2.247 1.00 0.00 N ATOM 1396 CA SER A 714 -6.388 1.329 1.814 1.00 0.00 C ATOM 1397 C SER A 714 -7.595 1.097 2.661 1.00 0.00 C ATOM 1398 O SER A 714 -7.666 1.544 3.812 1.00 0.00 O ATOM 1399 CB SER A 714 -5.491 0.134 1.974 1.00 0.00 C ATOM 1400 OG SER A 714 -4.147 0.452 1.615 1.00 0.00 O ATOM 0 H SER A 714 -5.507 2.521 3.246 1.00 0.00 H new ATOM 0 HA SER A 714 -6.670 1.463 0.770 1.00 0.00 H new ATOM 0 HB2 SER A 714 -5.523 -0.213 3.007 1.00 0.00 H new ATOM 0 HB3 SER A 714 -5.854 -0.684 1.351 1.00 0.00 H new ATOM 0 HG SER A 714 -3.582 -0.340 1.729 1.00 0.00 H new ATOM 1406 N VAL A 715 -8.521 0.398 2.107 1.00 0.00 N ATOM 1407 CA VAL A 715 -9.693 0.011 2.789 1.00 0.00 C ATOM 1408 C VAL A 715 -10.002 -1.417 2.455 1.00 0.00 C ATOM 1409 O VAL A 715 -9.837 -1.839 1.326 1.00 0.00 O ATOM 1410 CB VAL A 715 -10.911 0.935 2.498 1.00 0.00 C ATOM 1411 CG1 VAL A 715 -12.163 0.284 2.967 1.00 0.00 C ATOM 1412 CG2 VAL A 715 -10.769 2.239 3.232 1.00 0.00 C ATOM 0 H VAL A 715 -8.478 0.073 1.141 1.00 0.00 H new ATOM 0 HA VAL A 715 -9.504 0.112 3.858 1.00 0.00 H new ATOM 0 HB VAL A 715 -10.949 1.113 1.423 1.00 0.00 H new ATOM 0 HG11 VAL A 715 -13.012 0.936 2.760 1.00 0.00 H new ATOM 0 HG12 VAL A 715 -12.298 -0.664 2.445 1.00 0.00 H new ATOM 0 HG13 VAL A 715 -12.098 0.102 4.040 1.00 0.00 H new ATOM 0 HG21 VAL A 715 -11.629 2.873 3.017 1.00 0.00 H new ATOM 0 HG22 VAL A 715 -10.717 2.049 4.304 1.00 0.00 H new ATOM 0 HG23 VAL A 715 -9.858 2.742 2.908 1.00 0.00 H new ATOM 1422 N GLU A 716 -10.380 -2.154 3.443 1.00 0.00 N ATOM 1423 CA GLU A 716 -10.746 -3.516 3.264 1.00 0.00 C ATOM 1424 C GLU A 716 -12.252 -3.660 3.382 1.00 0.00 C ATOM 1425 O GLU A 716 -12.857 -3.323 4.428 1.00 0.00 O ATOM 1426 CB GLU A 716 -10.006 -4.382 4.261 1.00 0.00 C ATOM 1427 CG GLU A 716 -8.500 -4.296 4.067 1.00 0.00 C ATOM 1428 CD GLU A 716 -7.694 -5.088 5.049 1.00 0.00 C ATOM 1429 OE1 GLU A 716 -7.625 -6.336 4.925 1.00 0.00 O ATOM 1430 OE2 GLU A 716 -7.038 -4.475 5.912 1.00 0.00 O ATOM 0 H GLU A 716 -10.444 -1.825 4.406 1.00 0.00 H new ATOM 0 HA GLU A 716 -10.461 -3.853 2.267 1.00 0.00 H new ATOM 0 HB2 GLU A 716 -10.261 -4.071 5.274 1.00 0.00 H new ATOM 0 HB3 GLU A 716 -10.329 -5.418 4.154 1.00 0.00 H new ATOM 0 HG2 GLU A 716 -8.257 -4.637 3.061 1.00 0.00 H new ATOM 0 HG3 GLU A 716 -8.199 -3.250 4.131 1.00 0.00 H new ATOM 1437 N PHE A 717 -12.838 -4.141 2.327 1.00 0.00 N ATOM 1438 CA PHE A 717 -14.266 -4.316 2.191 1.00 0.00 C ATOM 1439 C PHE A 717 -14.711 -5.704 2.616 1.00 0.00 C ATOM 1440 O PHE A 717 -13.954 -6.668 2.515 1.00 0.00 O ATOM 1441 CB PHE A 717 -14.708 -4.023 0.744 1.00 0.00 C ATOM 1442 CG PHE A 717 -15.242 -2.641 0.537 1.00 0.00 C ATOM 1443 CD1 PHE A 717 -14.553 -1.529 0.984 1.00 0.00 C ATOM 1444 CD2 PHE A 717 -16.461 -2.463 -0.085 1.00 0.00 C ATOM 1445 CE1 PHE A 717 -15.084 -0.263 0.802 1.00 0.00 C ATOM 1446 CE2 PHE A 717 -16.989 -1.215 -0.265 1.00 0.00 C ATOM 1447 CZ PHE A 717 -16.304 -0.121 0.175 1.00 0.00 C ATOM 0 H PHE A 717 -12.319 -4.436 1.500 1.00 0.00 H new ATOM 0 HA PHE A 717 -14.749 -3.603 2.859 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -13.859 -4.177 0.078 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -15.473 -4.744 0.456 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -13.599 -1.648 1.476 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -17.008 -3.326 -0.436 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -14.546 0.607 1.149 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -17.945 -1.096 -0.754 1.00 0.00 H new ATOM 0 HZ PHE A 717 -16.721 0.865 0.031 1.00 0.00 H new ATOM 1457 N ASN A 718 -15.902 -5.775 3.154 1.00 0.00 N ATOM 1458 CA ASN A 718 -16.512 -7.020 3.590 1.00 0.00 C ATOM 1459 C ASN A 718 -17.752 -7.196 2.791 1.00 0.00 C ATOM 1460 O ASN A 718 -18.482 -6.218 2.533 1.00 0.00 O ATOM 1461 CB ASN A 718 -16.905 -7.000 5.091 1.00 0.00 C ATOM 1462 CG ASN A 718 -17.391 -8.379 5.609 1.00 0.00 C ATOM 1463 OD1 ASN A 718 -16.953 -9.428 5.141 1.00 0.00 O ATOM 1464 ND2 ASN A 718 -18.281 -8.382 6.575 1.00 0.00 N ATOM 0 H ASN A 718 -16.492 -4.957 3.307 1.00 0.00 H new ATOM 0 HA ASN A 718 -15.793 -7.828 3.451 1.00 0.00 H new ATOM 0 HB2 ASN A 718 -16.047 -6.678 5.681 1.00 0.00 H new ATOM 0 HB3 ASN A 718 -17.692 -6.262 5.245 1.00 0.00 H new ATOM 0 HD21 ASN A 718 -18.622 -9.267 6.951 1.00 0.00 H new ATOM 0 HD22 ASN A 718 -18.631 -7.500 6.949 1.00 0.00 H new ATOM 1471 N CYS A 719 -17.985 -8.376 2.372 1.00 0.00 N ATOM 1472 CA CYS A 719 -19.151 -8.682 1.627 1.00 0.00 C ATOM 1473 C CYS A 719 -20.298 -8.914 2.603 1.00 0.00 C ATOM 1474 O CYS A 719 -20.062 -9.249 3.775 1.00 0.00 O ATOM 1475 CB CYS A 719 -18.890 -9.932 0.803 1.00 0.00 C ATOM 1476 SG CYS A 719 -20.189 -10.337 -0.376 1.00 0.00 S ATOM 0 H CYS A 719 -17.368 -9.171 2.535 1.00 0.00 H new ATOM 0 HA CYS A 719 -19.412 -7.865 0.955 1.00 0.00 H new ATOM 0 HB2 CYS A 719 -17.953 -9.805 0.261 1.00 0.00 H new ATOM 0 HB3 CYS A 719 -18.756 -10.776 1.480 1.00 0.00 H new ATOM 1481 N SER A 720 -21.519 -8.711 2.147 1.00 0.00 N ATOM 1482 CA SER A 720 -22.684 -8.944 2.956 1.00 0.00 C ATOM 1483 C SER A 720 -22.717 -10.415 3.288 1.00 0.00 C ATOM 1484 O SER A 720 -22.273 -11.257 2.488 1.00 0.00 O ATOM 1485 CB SER A 720 -23.946 -8.579 2.168 1.00 0.00 C ATOM 1486 OG SER A 720 -25.118 -8.557 2.977 1.00 0.00 O ATOM 0 H SER A 720 -21.724 -8.380 1.204 1.00 0.00 H new ATOM 0 HA SER A 720 -22.647 -8.337 3.861 1.00 0.00 H new ATOM 0 HB2 SER A 720 -23.810 -7.600 1.707 1.00 0.00 H new ATOM 0 HB3 SER A 720 -24.083 -9.296 1.359 1.00 0.00 H new ATOM 0 HG SER A 720 -25.892 -8.318 2.425 1.00 0.00 H new ATOM 1492 N GLU A 721 -23.210 -10.738 4.431 1.00 0.00 N ATOM 1493 CA GLU A 721 -23.279 -12.088 4.822 1.00 0.00 C ATOM 1494 C GLU A 721 -24.379 -12.743 4.015 1.00 0.00 C ATOM 1495 O GLU A 721 -25.437 -12.127 3.790 1.00 0.00 O ATOM 1496 CB GLU A 721 -23.522 -12.181 6.298 1.00 0.00 C ATOM 1497 CG GLU A 721 -23.355 -13.556 6.875 1.00 0.00 C ATOM 1498 CD GLU A 721 -23.363 -13.507 8.357 1.00 0.00 C ATOM 1499 OE1 GLU A 721 -24.443 -13.515 8.948 1.00 0.00 O ATOM 1500 OE2 GLU A 721 -22.275 -13.419 8.957 1.00 0.00 O ATOM 0 H GLU A 721 -23.573 -10.073 5.113 1.00 0.00 H new ATOM 0 HA GLU A 721 -22.340 -12.607 4.628 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -22.839 -11.502 6.808 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -24.533 -11.834 6.509 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -24.158 -14.203 6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -22.419 -13.991 6.526 1.00 0.00 H new ATOM 1507 N SER A 722 -24.087 -13.941 3.561 1.00 0.00 N ATOM 1508 CA SER A 722 -24.904 -14.745 2.656 1.00 0.00 C ATOM 1509 C SER A 722 -24.596 -14.395 1.192 1.00 0.00 C ATOM 1510 O SER A 722 -25.247 -14.881 0.253 1.00 0.00 O ATOM 1511 CB SER A 722 -26.404 -14.695 2.990 1.00 0.00 C ATOM 1512 OG SER A 722 -26.645 -15.206 4.310 1.00 0.00 O ATOM 0 H SER A 722 -23.223 -14.416 3.824 1.00 0.00 H new ATOM 0 HA SER A 722 -24.626 -15.788 2.805 1.00 0.00 H new ATOM 0 HB2 SER A 722 -26.764 -13.668 2.920 1.00 0.00 H new ATOM 0 HB3 SER A 722 -26.964 -15.279 2.260 1.00 0.00 H new ATOM 0 HG SER A 722 -27.604 -15.165 4.507 1.00 0.00 H new ATOM 1518 N PHE A 723 -23.596 -13.548 1.008 1.00 0.00 N ATOM 1519 CA PHE A 723 -23.076 -13.237 -0.285 1.00 0.00 C ATOM 1520 C PHE A 723 -21.606 -13.568 -0.287 1.00 0.00 C ATOM 1521 O PHE A 723 -20.970 -13.564 0.762 1.00 0.00 O ATOM 1522 CB PHE A 723 -23.271 -11.758 -0.626 1.00 0.00 C ATOM 1523 CG PHE A 723 -24.695 -11.338 -0.817 1.00 0.00 C ATOM 1524 CD1 PHE A 723 -25.521 -11.094 0.263 1.00 0.00 C ATOM 1525 CD2 PHE A 723 -25.199 -11.181 -2.087 1.00 0.00 C ATOM 1526 CE1 PHE A 723 -26.828 -10.703 0.069 1.00 0.00 C ATOM 1527 CE2 PHE A 723 -26.498 -10.794 -2.289 1.00 0.00 C ATOM 1528 CZ PHE A 723 -27.319 -10.554 -1.211 1.00 0.00 C ATOM 0 H PHE A 723 -23.127 -13.059 1.770 1.00 0.00 H new ATOM 0 HA PHE A 723 -23.609 -13.820 -1.036 1.00 0.00 H new ATOM 0 HB2 PHE A 723 -22.833 -11.156 0.170 1.00 0.00 H new ATOM 0 HB3 PHE A 723 -22.716 -11.534 -1.537 1.00 0.00 H new ATOM 0 HD1 PHE A 723 -25.140 -11.211 1.267 1.00 0.00 H new ATOM 0 HD2 PHE A 723 -24.561 -11.366 -2.939 1.00 0.00 H new ATOM 0 HE1 PHE A 723 -27.467 -10.513 0.919 1.00 0.00 H new ATOM 0 HE2 PHE A 723 -26.877 -10.677 -3.294 1.00 0.00 H new ATOM 0 HZ PHE A 723 -28.344 -10.250 -1.367 1.00 0.00 H new ATOM 1538 N THR A 724 -21.084 -13.890 -1.416 1.00 0.00 N ATOM 1539 CA THR A 724 -19.689 -14.172 -1.534 1.00 0.00 C ATOM 1540 C THR A 724 -19.061 -13.096 -2.413 1.00 0.00 C ATOM 1541 O THR A 724 -19.679 -12.651 -3.406 1.00 0.00 O ATOM 1542 CB THR A 724 -19.450 -15.615 -2.083 1.00 0.00 C ATOM 1543 OG1 THR A 724 -18.050 -15.917 -2.188 1.00 0.00 O ATOM 1544 CG2 THR A 724 -20.134 -15.834 -3.417 1.00 0.00 C ATOM 0 H THR A 724 -21.608 -13.967 -2.288 1.00 0.00 H new ATOM 0 HA THR A 724 -19.212 -14.148 -0.554 1.00 0.00 H new ATOM 0 HB THR A 724 -19.895 -16.298 -1.360 1.00 0.00 H new ATOM 0 HG1 THR A 724 -17.937 -16.827 -2.533 1.00 0.00 H new ATOM 0 HG21 THR A 724 -19.942 -16.850 -3.762 1.00 0.00 H new ATOM 0 HG22 THR A 724 -21.208 -15.686 -3.304 1.00 0.00 H new ATOM 0 HG23 THR A 724 -19.745 -15.123 -4.146 1.00 0.00 H new ATOM 1552 N MET A 725 -17.898 -12.618 -2.016 1.00 0.00 N ATOM 1553 CA MET A 725 -17.248 -11.553 -2.723 1.00 0.00 C ATOM 1554 C MET A 725 -16.314 -12.118 -3.787 1.00 0.00 C ATOM 1555 O MET A 725 -15.652 -13.147 -3.587 1.00 0.00 O ATOM 1556 CB MET A 725 -16.489 -10.647 -1.739 1.00 0.00 C ATOM 1557 CG MET A 725 -15.050 -11.070 -1.426 1.00 0.00 C ATOM 1558 SD MET A 725 -14.390 -10.351 0.103 1.00 0.00 S ATOM 1559 CE MET A 725 -14.840 -8.632 -0.073 1.00 0.00 C ATOM 0 H MET A 725 -17.388 -12.959 -1.201 1.00 0.00 H new ATOM 0 HA MET A 725 -18.002 -10.947 -3.225 1.00 0.00 H new ATOM 0 HB2 MET A 725 -16.471 -9.635 -2.144 1.00 0.00 H new ATOM 0 HB3 MET A 725 -17.048 -10.607 -0.804 1.00 0.00 H new ATOM 0 HG2 MET A 725 -15.009 -12.157 -1.352 1.00 0.00 H new ATOM 0 HG3 MET A 725 -14.408 -10.782 -2.258 1.00 0.00 H new ATOM 0 HE1 MET A 725 -14.016 -8.004 0.265 1.00 0.00 H new ATOM 0 HE2 MET A 725 -15.054 -8.417 -1.120 1.00 0.00 H new ATOM 0 HE3 MET A 725 -15.725 -8.424 0.528 1.00 0.00 H new ATOM 1569 N ILE A 726 -16.314 -11.494 -4.912 1.00 0.00 N ATOM 1570 CA ILE A 726 -15.464 -11.870 -6.001 1.00 0.00 C ATOM 1571 C ILE A 726 -14.608 -10.678 -6.350 1.00 0.00 C ATOM 1572 O ILE A 726 -15.140 -9.612 -6.673 1.00 0.00 O ATOM 1573 CB ILE A 726 -16.282 -12.263 -7.250 1.00 0.00 C ATOM 1574 CG1 ILE A 726 -17.401 -13.239 -6.872 1.00 0.00 C ATOM 1575 CG2 ILE A 726 -15.356 -12.888 -8.289 1.00 0.00 C ATOM 1576 CD1 ILE A 726 -18.307 -13.613 -8.014 1.00 0.00 C ATOM 0 H ILE A 726 -16.913 -10.693 -5.111 1.00 0.00 H new ATOM 0 HA ILE A 726 -14.865 -12.730 -5.700 1.00 0.00 H new ATOM 0 HB ILE A 726 -16.741 -11.369 -7.673 1.00 0.00 H new ATOM 0 HG12 ILE A 726 -16.954 -14.146 -6.466 1.00 0.00 H new ATOM 0 HG13 ILE A 726 -18.001 -12.796 -6.077 1.00 0.00 H new ATOM 0 HG21 ILE A 726 -15.933 -13.166 -9.171 1.00 0.00 H new ATOM 0 HG22 ILE A 726 -14.587 -12.169 -8.570 1.00 0.00 H new ATOM 0 HG23 ILE A 726 -14.885 -13.777 -7.869 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -19.070 -14.306 -7.661 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -18.785 -12.716 -8.408 1.00 0.00 H new ATOM 0 HD13 ILE A 726 -17.722 -14.088 -8.802 1.00 0.00 H new ATOM 1588 N GLY A 727 -13.327 -10.829 -6.240 1.00 0.00 N ATOM 1589 CA GLY A 727 -12.420 -9.761 -6.564 1.00 0.00 C ATOM 1590 C GLY A 727 -11.528 -9.449 -5.431 1.00 0.00 C ATOM 1591 O GLY A 727 -11.290 -10.305 -4.569 1.00 0.00 O ATOM 0 H GLY A 727 -12.876 -11.688 -5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 727 -11.823 -10.039 -7.433 1.00 0.00 H new ATOM 0 HA3 GLY A 727 -12.987 -8.871 -6.838 1.00 0.00 H new ATOM 1595 N HIS A 728 -11.044 -8.233 -5.387 1.00 0.00 N ATOM 1596 CA HIS A 728 -10.131 -7.884 -4.355 1.00 0.00 C ATOM 1597 C HIS A 728 -10.836 -7.169 -3.252 1.00 0.00 C ATOM 1598 O HIS A 728 -11.401 -6.098 -3.446 1.00 0.00 O ATOM 1599 CB HIS A 728 -8.945 -7.077 -4.864 1.00 0.00 C ATOM 1600 CG HIS A 728 -7.798 -7.072 -3.912 1.00 0.00 C ATOM 1601 ND1 HIS A 728 -6.898 -6.046 -3.789 1.00 0.00 N ATOM 1602 CD2 HIS A 728 -7.398 -8.025 -3.063 1.00 0.00 C ATOM 1603 CE1 HIS A 728 -5.984 -6.374 -2.896 1.00 0.00 C ATOM 1604 NE2 HIS A 728 -6.268 -7.577 -2.439 1.00 0.00 N ATOM 0 H HIS A 728 -11.268 -7.487 -6.046 1.00 0.00 H new ATOM 0 HA HIS A 728 -9.722 -8.815 -3.964 1.00 0.00 H new ATOM 0 HB2 HIS A 728 -8.616 -7.486 -5.819 1.00 0.00 H new ATOM 0 HB3 HIS A 728 -9.262 -6.051 -5.049 1.00 0.00 H new ATOM 0 HD2 HIS A 728 -7.881 -8.977 -2.900 1.00 0.00 H new ATOM 0 HE1 HIS A 728 -5.147 -5.762 -2.592 1.00 0.00 H new ATOM 0 HE2 HIS A 728 -5.733 -8.088 -1.737 1.00 0.00 H new ATOM 1613 N ARG A 729 -10.779 -7.787 -2.106 1.00 0.00 N ATOM 1614 CA ARG A 729 -11.380 -7.304 -0.865 1.00 0.00 C ATOM 1615 C ARG A 729 -10.860 -5.949 -0.444 1.00 0.00 C ATOM 1616 O ARG A 729 -11.544 -5.212 0.246 1.00 0.00 O ATOM 1617 CB ARG A 729 -11.127 -8.294 0.276 1.00 0.00 C ATOM 1618 CG ARG A 729 -9.667 -8.683 0.466 1.00 0.00 C ATOM 1619 CD ARG A 729 -9.471 -9.598 1.662 1.00 0.00 C ATOM 1620 NE ARG A 729 -10.326 -10.790 1.605 1.00 0.00 N ATOM 1621 CZ ARG A 729 -9.913 -12.037 1.323 1.00 0.00 C ATOM 1622 NH1 ARG A 729 -8.646 -12.276 0.972 1.00 0.00 N ATOM 1623 NH2 ARG A 729 -10.770 -13.047 1.388 1.00 0.00 N ATOM 0 H ARG A 729 -10.296 -8.678 -1.992 1.00 0.00 H new ATOM 0 HA ARG A 729 -12.447 -7.211 -1.067 1.00 0.00 H new ATOM 0 HB2 ARG A 729 -11.498 -7.860 1.205 1.00 0.00 H new ATOM 0 HB3 ARG A 729 -11.709 -9.197 0.092 1.00 0.00 H new ATOM 0 HG2 ARG A 729 -9.305 -9.180 -0.434 1.00 0.00 H new ATOM 0 HG3 ARG A 729 -9.066 -7.783 0.596 1.00 0.00 H new ATOM 0 HD2 ARG A 729 -8.427 -9.906 1.712 1.00 0.00 H new ATOM 0 HD3 ARG A 729 -9.684 -9.045 2.577 1.00 0.00 H new ATOM 0 HE ARG A 729 -11.320 -10.660 1.796 1.00 0.00 H new ATOM 0 HH11 ARG A 729 -7.979 -11.507 0.915 1.00 0.00 H new ATOM 0 HH12 ARG A 729 -8.346 -13.228 0.761 1.00 0.00 H new ATOM 0 HH21 ARG A 729 -11.740 -12.876 1.652 1.00 0.00 H new ATOM 0 HH22 ARG A 729 -10.459 -13.995 1.174 1.00 0.00 H new ATOM 1637 N SER A 730 -9.691 -5.606 -0.866 1.00 0.00 N ATOM 1638 CA SER A 730 -9.112 -4.407 -0.388 1.00 0.00 C ATOM 1639 C SER A 730 -8.902 -3.443 -1.519 1.00 0.00 C ATOM 1640 O SER A 730 -8.710 -3.856 -2.674 1.00 0.00 O ATOM 1641 CB SER A 730 -7.824 -4.716 0.322 1.00 0.00 C ATOM 1642 OG SER A 730 -7.992 -5.806 1.226 1.00 0.00 O ATOM 0 H SER A 730 -9.127 -6.134 -1.532 1.00 0.00 H new ATOM 0 HA SER A 730 -9.788 -3.934 0.324 1.00 0.00 H new ATOM 0 HB2 SER A 730 -7.051 -4.958 -0.407 1.00 0.00 H new ATOM 0 HB3 SER A 730 -7.484 -3.835 0.867 1.00 0.00 H new ATOM 0 HG SER A 730 -7.390 -6.537 0.973 1.00 0.00 H new ATOM 1648 N ILE A 731 -8.981 -2.182 -1.204 1.00 0.00 N ATOM 1649 CA ILE A 731 -8.860 -1.131 -2.170 1.00 0.00 C ATOM 1650 C ILE A 731 -7.849 -0.127 -1.731 1.00 0.00 C ATOM 1651 O ILE A 731 -7.348 -0.187 -0.618 1.00 0.00 O ATOM 1652 CB ILE A 731 -10.203 -0.423 -2.389 1.00 0.00 C ATOM 1653 CG1 ILE A 731 -10.768 0.068 -1.035 1.00 0.00 C ATOM 1654 CG2 ILE A 731 -11.153 -1.327 -3.135 1.00 0.00 C ATOM 1655 CD1 ILE A 731 -12.179 0.538 -1.064 1.00 0.00 C ATOM 0 H ILE A 731 -9.134 -1.851 -0.251 1.00 0.00 H new ATOM 0 HA ILE A 731 -8.540 -1.586 -3.107 1.00 0.00 H new ATOM 0 HB ILE A 731 -10.061 0.461 -3.011 1.00 0.00 H new ATOM 0 HG12 ILE A 731 -10.688 -0.744 -0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 731 -10.140 0.881 -0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 731 -12.103 -0.813 -3.284 1.00 0.00 H new ATOM 0 HG22 ILE A 731 -10.724 -1.586 -4.103 1.00 0.00 H new ATOM 0 HG23 ILE A 731 -11.319 -2.236 -2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 731 -12.476 0.860 -0.066 1.00 0.00 H new ATOM 0 HD12 ILE A 731 -12.270 1.375 -1.757 1.00 0.00 H new ATOM 0 HD13 ILE A 731 -12.827 -0.275 -1.391 1.00 0.00 H new ATOM 1667 N THR A 732 -7.573 0.795 -2.588 1.00 0.00 N ATOM 1668 CA THR A 732 -6.643 1.840 -2.326 1.00 0.00 C ATOM 1669 C THR A 732 -7.195 3.133 -2.920 1.00 0.00 C ATOM 1670 O THR A 732 -7.802 3.110 -3.991 1.00 0.00 O ATOM 1671 CB THR A 732 -5.260 1.500 -2.933 1.00 0.00 C ATOM 1672 OG1 THR A 732 -4.772 0.265 -2.362 1.00 0.00 O ATOM 1673 CG2 THR A 732 -4.267 2.610 -2.660 1.00 0.00 C ATOM 0 H THR A 732 -7.998 0.845 -3.514 1.00 0.00 H new ATOM 0 HA THR A 732 -6.507 1.959 -1.251 1.00 0.00 H new ATOM 0 HB THR A 732 -5.372 1.390 -4.012 1.00 0.00 H new ATOM 0 HG1 THR A 732 -3.897 0.049 -2.748 1.00 0.00 H new ATOM 0 HG21 THR A 732 -3.302 2.350 -3.095 1.00 0.00 H new ATOM 0 HG22 THR A 732 -4.627 3.538 -3.104 1.00 0.00 H new ATOM 0 HG23 THR A 732 -4.156 2.742 -1.584 1.00 0.00 H new ATOM 1681 N CYS A 733 -7.082 4.206 -2.170 1.00 0.00 N ATOM 1682 CA CYS A 733 -7.545 5.526 -2.579 1.00 0.00 C ATOM 1683 C CYS A 733 -6.682 6.055 -3.704 1.00 0.00 C ATOM 1684 O CYS A 733 -5.497 6.362 -3.493 1.00 0.00 O ATOM 1685 CB CYS A 733 -7.507 6.476 -1.378 1.00 0.00 C ATOM 1686 SG CYS A 733 -7.923 8.203 -1.756 1.00 0.00 S ATOM 0 H CYS A 733 -6.660 4.193 -1.242 1.00 0.00 H new ATOM 0 HA CYS A 733 -8.571 5.454 -2.940 1.00 0.00 H new ATOM 0 HB2 CYS A 733 -8.199 6.108 -0.620 1.00 0.00 H new ATOM 0 HB3 CYS A 733 -6.509 6.445 -0.940 1.00 0.00 H new ATOM 1691 N ILE A 734 -7.245 6.111 -4.900 1.00 0.00 N ATOM 1692 CA ILE A 734 -6.518 6.526 -6.081 1.00 0.00 C ATOM 1693 C ILE A 734 -7.254 7.655 -6.834 1.00 0.00 C ATOM 1694 O ILE A 734 -8.280 7.430 -7.459 1.00 0.00 O ATOM 1695 CB ILE A 734 -6.300 5.315 -7.050 1.00 0.00 C ATOM 1696 CG1 ILE A 734 -5.564 4.167 -6.347 1.00 0.00 C ATOM 1697 CG2 ILE A 734 -5.539 5.738 -8.292 1.00 0.00 C ATOM 1698 CD1 ILE A 734 -4.213 4.556 -5.815 1.00 0.00 C ATOM 0 H ILE A 734 -8.220 5.869 -5.076 1.00 0.00 H new ATOM 0 HA ILE A 734 -5.552 6.904 -5.747 1.00 0.00 H new ATOM 0 HB ILE A 734 -7.285 4.960 -7.352 1.00 0.00 H new ATOM 0 HG12 ILE A 734 -6.178 3.803 -5.524 1.00 0.00 H new ATOM 0 HG13 ILE A 734 -5.445 3.340 -7.047 1.00 0.00 H new ATOM 0 HG21 ILE A 734 -5.403 4.877 -8.946 1.00 0.00 H new ATOM 0 HG22 ILE A 734 -6.102 6.508 -8.819 1.00 0.00 H new ATOM 0 HG23 ILE A 734 -4.565 6.133 -8.005 1.00 0.00 H new ATOM 0 HD11 ILE A 734 -3.751 3.695 -5.331 1.00 0.00 H new ATOM 0 HD12 ILE A 734 -3.581 4.893 -6.637 1.00 0.00 H new ATOM 0 HD13 ILE A 734 -4.326 5.362 -5.090 1.00 0.00 H new ATOM 1710 N HIS A 735 -6.752 8.880 -6.695 1.00 0.00 N ATOM 1711 CA HIS A 735 -7.241 10.068 -7.438 1.00 0.00 C ATOM 1712 C HIS A 735 -8.669 10.432 -7.051 1.00 0.00 C ATOM 1713 O HIS A 735 -9.403 11.063 -7.820 1.00 0.00 O ATOM 1714 CB HIS A 735 -7.097 9.908 -8.979 1.00 0.00 C ATOM 1715 CG HIS A 735 -5.672 9.892 -9.479 1.00 0.00 C ATOM 1716 ND1 HIS A 735 -4.725 8.938 -9.413 1.00 0.00 N flip ATOM 1717 CD2 HIS A 735 -5.089 10.940 -10.150 1.00 0.00 C flip ATOM 1718 CE1 HIS A 735 -3.610 9.413 -10.029 1.00 0.00 C flip ATOM 1719 NE2 HIS A 735 -3.851 10.621 -10.467 1.00 0.00 N flip ATOM 0 H HIS A 735 -5.984 9.092 -6.058 1.00 0.00 H new ATOM 0 HA HIS A 735 -6.598 10.897 -7.144 1.00 0.00 H new ATOM 0 HB2 HIS A 735 -7.585 8.982 -9.282 1.00 0.00 H new ATOM 0 HB3 HIS A 735 -7.630 10.724 -9.467 1.00 0.00 H new ATOM 0 HD2 HIS A 735 -5.571 11.879 -10.381 1.00 0.00 H new ATOM 0 HE1 HIS A 735 -2.677 8.880 -10.139 1.00 0.00 H new ATOM 0 HE2 HIS A 735 -3.192 11.216 -10.969 1.00 0.00 H new ATOM 1728 N GLY A 736 -9.027 10.091 -5.838 1.00 0.00 N ATOM 1729 CA GLY A 736 -10.337 10.386 -5.332 1.00 0.00 C ATOM 1730 C GLY A 736 -11.300 9.241 -5.512 1.00 0.00 C ATOM 1731 O GLY A 736 -12.495 9.378 -5.222 1.00 0.00 O ATOM 0 H GLY A 736 -8.419 9.604 -5.179 1.00 0.00 H new ATOM 0 HA2 GLY A 736 -10.266 10.633 -4.273 1.00 0.00 H new ATOM 0 HA3 GLY A 736 -10.728 11.268 -5.839 1.00 0.00 H new ATOM 1735 N VAL A 737 -10.806 8.114 -5.997 1.00 0.00 N ATOM 1736 CA VAL A 737 -11.642 6.952 -6.225 1.00 0.00 C ATOM 1737 C VAL A 737 -10.908 5.742 -5.697 1.00 0.00 C ATOM 1738 O VAL A 737 -9.705 5.665 -5.803 1.00 0.00 O ATOM 1739 CB VAL A 737 -11.940 6.745 -7.755 1.00 0.00 C ATOM 1740 CG1 VAL A 737 -12.890 5.576 -7.990 1.00 0.00 C ATOM 1741 CG2 VAL A 737 -12.503 8.006 -8.390 1.00 0.00 C ATOM 0 H VAL A 737 -9.825 7.981 -6.241 1.00 0.00 H new ATOM 0 HA VAL A 737 -12.595 7.095 -5.716 1.00 0.00 H new ATOM 0 HB VAL A 737 -10.987 6.514 -8.231 1.00 0.00 H new ATOM 0 HG11 VAL A 737 -13.072 5.464 -9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 737 -12.444 4.661 -7.600 1.00 0.00 H new ATOM 0 HG13 VAL A 737 -13.834 5.766 -7.479 1.00 0.00 H new ATOM 0 HG21 VAL A 737 -12.697 7.826 -9.447 1.00 0.00 H new ATOM 0 HG22 VAL A 737 -13.433 8.280 -7.892 1.00 0.00 H new ATOM 0 HG23 VAL A 737 -11.783 8.818 -8.286 1.00 0.00 H new ATOM 1751 N TRP A 738 -11.595 4.836 -5.087 1.00 0.00 N ATOM 1752 CA TRP A 738 -10.950 3.628 -4.640 1.00 0.00 C ATOM 1753 C TRP A 738 -10.806 2.692 -5.823 1.00 0.00 C ATOM 1754 O TRP A 738 -11.672 2.685 -6.709 1.00 0.00 O ATOM 1755 CB TRP A 738 -11.746 2.967 -3.555 1.00 0.00 C ATOM 1756 CG TRP A 738 -11.913 3.806 -2.331 1.00 0.00 C ATOM 1757 CD1 TRP A 738 -12.944 4.609 -2.042 1.00 0.00 C ATOM 1758 CD2 TRP A 738 -11.009 3.916 -1.250 1.00 0.00 C ATOM 1759 NE1 TRP A 738 -12.766 5.196 -0.822 1.00 0.00 N ATOM 1760 CE2 TRP A 738 -11.565 4.800 -0.325 1.00 0.00 C ATOM 1761 CE3 TRP A 738 -9.793 3.351 -0.980 1.00 0.00 C ATOM 1762 CZ2 TRP A 738 -10.927 5.126 0.858 1.00 0.00 C ATOM 1763 CZ3 TRP A 738 -9.151 3.665 0.178 1.00 0.00 C ATOM 1764 CH2 TRP A 738 -9.711 4.553 1.092 1.00 0.00 C ATOM 0 H TRP A 738 -12.593 4.898 -4.884 1.00 0.00 H new ATOM 0 HA TRP A 738 -9.969 3.872 -4.232 1.00 0.00 H new ATOM 0 HB2 TRP A 738 -12.731 2.711 -3.945 1.00 0.00 H new ATOM 0 HB3 TRP A 738 -11.259 2.032 -3.279 1.00 0.00 H new ATOM 0 HD1 TRP A 738 -13.797 4.770 -2.684 1.00 0.00 H new ATOM 0 HE1 TRP A 738 -13.424 5.825 -0.362 1.00 0.00 H new ATOM 0 HE3 TRP A 738 -9.346 2.661 -1.680 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 -11.373 5.807 1.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 -8.191 3.218 0.391 1.00 0.00 H new ATOM 0 HH2 TRP A 738 -9.176 4.792 1.999 1.00 0.00 H new ATOM 1775 N THR A 739 -9.746 1.900 -5.799 1.00 0.00 N ATOM 1776 CA THR A 739 -9.333 1.010 -6.904 1.00 0.00 C ATOM 1777 C THR A 739 -10.439 0.396 -7.748 1.00 0.00 C ATOM 1778 O THR A 739 -10.667 0.836 -8.890 1.00 0.00 O ATOM 1779 CB THR A 739 -8.354 -0.080 -6.436 1.00 0.00 C ATOM 1780 OG1 THR A 739 -8.910 -0.810 -5.331 1.00 0.00 O ATOM 1781 CG2 THR A 739 -7.050 0.536 -6.012 1.00 0.00 C ATOM 0 H THR A 739 -9.123 1.848 -4.993 1.00 0.00 H new ATOM 0 HA THR A 739 -8.830 1.703 -7.579 1.00 0.00 H new ATOM 0 HB THR A 739 -8.180 -0.761 -7.269 1.00 0.00 H new ATOM 0 HG1 THR A 739 -9.255 -1.671 -5.648 1.00 0.00 H new ATOM 0 HG21 THR A 739 -6.367 -0.248 -5.683 1.00 0.00 H new ATOM 0 HG22 THR A 739 -6.610 1.071 -6.853 1.00 0.00 H new ATOM 0 HG23 THR A 739 -7.226 1.232 -5.191 1.00 0.00 H new ATOM 1789 N GLN A 740 -11.142 -0.572 -7.211 1.00 0.00 N ATOM 1790 CA GLN A 740 -12.084 -1.313 -8.034 1.00 0.00 C ATOM 1791 C GLN A 740 -13.166 -2.025 -7.278 1.00 0.00 C ATOM 1792 O GLN A 740 -14.271 -2.189 -7.809 1.00 0.00 O ATOM 1793 CB GLN A 740 -11.347 -2.249 -9.021 1.00 0.00 C ATOM 1794 CG GLN A 740 -10.091 -2.982 -8.468 1.00 0.00 C ATOM 1795 CD GLN A 740 -10.346 -3.899 -7.274 1.00 0.00 C ATOM 1796 OE1 GLN A 740 -10.091 -3.406 -6.078 1.00 0.00 O flip ATOM 1797 NE2 GLN A 740 -10.684 -5.067 -7.433 1.00 0.00 N flip ATOM 0 H GLN A 740 -11.088 -0.864 -6.235 1.00 0.00 H new ATOM 0 HA GLN A 740 -12.619 -0.556 -8.608 1.00 0.00 H new ATOM 0 HB2 GLN A 740 -12.054 -3.000 -9.373 1.00 0.00 H new ATOM 0 HB3 GLN A 740 -11.046 -1.662 -9.889 1.00 0.00 H new ATOM 0 HG2 GLN A 740 -9.652 -3.573 -9.272 1.00 0.00 H new ATOM 0 HG3 GLN A 740 -9.351 -2.235 -8.180 1.00 0.00 H new ATOM 0 HE21 GLN A 740 -10.875 -5.420 -8.371 1.00 0.00 H new ATOM 0 HE22 GLN A 740 -10.775 -5.686 -6.627 1.00 0.00 H new ATOM 1806 N LEU A 741 -12.853 -2.431 -6.059 1.00 0.00 N ATOM 1807 CA LEU A 741 -13.769 -3.161 -5.163 1.00 0.00 C ATOM 1808 C LEU A 741 -14.114 -4.549 -5.713 1.00 0.00 C ATOM 1809 O LEU A 741 -13.974 -4.823 -6.903 1.00 0.00 O ATOM 1810 CB LEU A 741 -15.045 -2.369 -4.981 1.00 0.00 C ATOM 1811 CG LEU A 741 -14.857 -0.953 -4.505 1.00 0.00 C ATOM 1812 CD1 LEU A 741 -16.125 -0.207 -4.719 1.00 0.00 C ATOM 1813 CD2 LEU A 741 -14.543 -0.947 -3.039 1.00 0.00 C ATOM 0 H LEU A 741 -11.936 -2.264 -5.644 1.00 0.00 H new ATOM 0 HA LEU A 741 -13.263 -3.288 -4.206 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -15.580 -2.348 -5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -15.681 -2.894 -4.268 1.00 0.00 H new ATOM 0 HG LEU A 741 -14.039 -0.490 -5.056 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -16.004 0.821 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -16.375 -0.211 -5.780 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -16.927 -0.684 -4.156 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -14.408 0.080 -2.700 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -15.365 -1.406 -2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -13.628 -1.511 -2.861 1.00 0.00 H new ATOM 1825 N PRO A 742 -14.510 -5.456 -4.855 1.00 0.00 N ATOM 1826 CA PRO A 742 -15.004 -6.736 -5.281 1.00 0.00 C ATOM 1827 C PRO A 742 -16.513 -6.653 -5.574 1.00 0.00 C ATOM 1828 O PRO A 742 -17.122 -5.588 -5.429 1.00 0.00 O ATOM 1829 CB PRO A 742 -14.742 -7.624 -4.075 1.00 0.00 C ATOM 1830 CG PRO A 742 -14.820 -6.708 -2.905 1.00 0.00 C ATOM 1831 CD PRO A 742 -14.468 -5.332 -3.397 1.00 0.00 C ATOM 0 HA PRO A 742 -14.533 -7.102 -6.193 1.00 0.00 H new ATOM 0 HB2 PRO A 742 -15.481 -8.422 -4.003 1.00 0.00 H new ATOM 0 HB3 PRO A 742 -13.764 -8.101 -4.140 1.00 0.00 H new ATOM 0 HG2 PRO A 742 -15.821 -6.718 -2.474 1.00 0.00 H new ATOM 0 HG3 PRO A 742 -14.132 -7.025 -2.121 1.00 0.00 H new ATOM 0 HD2 PRO A 742 -15.178 -4.586 -3.039 1.00 0.00 H new ATOM 0 HD3 PRO A 742 -13.481 -5.025 -3.051 1.00 0.00 H new ATOM 1839 N GLN A 743 -17.100 -7.747 -5.957 1.00 0.00 N ATOM 1840 CA GLN A 743 -18.511 -7.797 -6.229 1.00 0.00 C ATOM 1841 C GLN A 743 -19.107 -8.913 -5.411 1.00 0.00 C ATOM 1842 O GLN A 743 -18.464 -9.929 -5.196 1.00 0.00 O ATOM 1843 CB GLN A 743 -18.784 -8.028 -7.727 1.00 0.00 C ATOM 1844 CG GLN A 743 -18.238 -9.339 -8.278 1.00 0.00 C ATOM 1845 CD GLN A 743 -18.602 -9.569 -9.726 1.00 0.00 C ATOM 1846 OE1 GLN A 743 -18.741 -10.813 -10.101 1.00 0.00 O flip ATOM 1847 NE2 GLN A 743 -18.759 -8.629 -10.504 1.00 0.00 N flip ATOM 0 H GLN A 743 -16.615 -8.634 -6.091 1.00 0.00 H new ATOM 0 HA GLN A 743 -18.966 -6.843 -5.961 1.00 0.00 H new ATOM 0 HB2 GLN A 743 -19.861 -7.999 -7.895 1.00 0.00 H new ATOM 0 HB3 GLN A 743 -18.351 -7.203 -8.293 1.00 0.00 H new ATOM 0 HG2 GLN A 743 -17.153 -9.345 -8.177 1.00 0.00 H new ATOM 0 HG3 GLN A 743 -18.619 -10.165 -7.678 1.00 0.00 H new ATOM 0 HE21 GLN A 743 -18.642 -7.670 -10.176 1.00 0.00 H new ATOM 0 HE22 GLN A 743 -19.006 -8.808 -11.477 1.00 0.00 H new ATOM 1856 N CYS A 744 -20.271 -8.717 -4.913 1.00 0.00 N ATOM 1857 CA CYS A 744 -20.926 -9.756 -4.149 1.00 0.00 C ATOM 1858 C CYS A 744 -22.044 -10.423 -4.925 1.00 0.00 C ATOM 1859 O CYS A 744 -22.809 -9.754 -5.621 1.00 0.00 O ATOM 1860 CB CYS A 744 -21.463 -9.207 -2.852 1.00 0.00 C ATOM 1861 SG CYS A 744 -20.187 -8.765 -1.657 1.00 0.00 S ATOM 0 H CYS A 744 -20.804 -7.853 -5.011 1.00 0.00 H new ATOM 0 HA CYS A 744 -20.171 -10.513 -3.937 1.00 0.00 H new ATOM 0 HB2 CYS A 744 -22.067 -8.325 -3.065 1.00 0.00 H new ATOM 0 HB3 CYS A 744 -22.126 -9.947 -2.403 1.00 0.00 H new ATOM 1866 N VAL A 745 -22.143 -11.732 -4.788 1.00 0.00 N ATOM 1867 CA VAL A 745 -23.182 -12.523 -5.411 1.00 0.00 C ATOM 1868 C VAL A 745 -23.834 -13.370 -4.343 1.00 0.00 C ATOM 1869 O VAL A 745 -23.169 -13.772 -3.378 1.00 0.00 O ATOM 1870 CB VAL A 745 -22.666 -13.419 -6.585 1.00 0.00 C ATOM 1871 CG1 VAL A 745 -22.254 -12.570 -7.777 1.00 0.00 C ATOM 1872 CG2 VAL A 745 -21.497 -14.280 -6.152 1.00 0.00 C ATOM 0 H VAL A 745 -21.491 -12.283 -4.230 1.00 0.00 H new ATOM 0 HA VAL A 745 -23.901 -11.839 -5.862 1.00 0.00 H new ATOM 0 HB VAL A 745 -23.490 -14.070 -6.877 1.00 0.00 H new ATOM 0 HG11 VAL A 745 -21.899 -13.217 -8.579 1.00 0.00 H new ATOM 0 HG12 VAL A 745 -23.111 -11.994 -8.127 1.00 0.00 H new ATOM 0 HG13 VAL A 745 -21.456 -11.889 -7.480 1.00 0.00 H new ATOM 0 HG21 VAL A 745 -21.164 -14.890 -6.992 1.00 0.00 H new ATOM 0 HG22 VAL A 745 -20.678 -13.642 -5.819 1.00 0.00 H new ATOM 0 HG23 VAL A 745 -21.807 -14.929 -5.333 1.00 0.00 H new ATOM 1882 N ALA A 746 -25.118 -13.578 -4.471 1.00 0.00 N ATOM 1883 CA ALA A 746 -25.892 -14.295 -3.486 1.00 0.00 C ATOM 1884 C ALA A 746 -25.566 -15.770 -3.469 1.00 0.00 C ATOM 1885 O ALA A 746 -25.766 -16.467 -4.461 1.00 0.00 O ATOM 1886 CB ALA A 746 -27.372 -14.080 -3.730 1.00 0.00 C ATOM 0 H ALA A 746 -25.663 -13.252 -5.269 1.00 0.00 H new ATOM 0 HA ALA A 746 -25.627 -13.897 -2.506 1.00 0.00 H new ATOM 0 HB1 ALA A 746 -27.947 -14.625 -2.982 1.00 0.00 H new ATOM 0 HB2 ALA A 746 -27.602 -13.017 -3.660 1.00 0.00 H new ATOM 0 HB3 ALA A 746 -27.633 -14.443 -4.724 1.00 0.00 H new ATOM 1892 N ILE A 747 -25.028 -16.222 -2.361 1.00 0.00 N ATOM 1893 CA ILE A 747 -24.739 -17.626 -2.158 1.00 0.00 C ATOM 1894 C ILE A 747 -26.062 -18.374 -2.044 1.00 0.00 C ATOM 1895 O ILE A 747 -26.761 -18.205 -1.020 1.00 0.00 O ATOM 1896 CB ILE A 747 -23.900 -17.879 -0.870 1.00 0.00 C ATOM 1897 CG1 ILE A 747 -22.595 -17.084 -0.913 1.00 0.00 C ATOM 1898 CG2 ILE A 747 -23.610 -19.377 -0.703 1.00 0.00 C ATOM 1899 CD1 ILE A 747 -21.740 -17.224 0.335 1.00 0.00 C ATOM 1900 OXT ILE A 747 -26.420 -19.116 -2.969 1.00 0.00 O ATOM 0 H ILE A 747 -24.777 -15.627 -1.572 1.00 0.00 H new ATOM 0 HA ILE A 747 -24.150 -17.978 -3.005 1.00 0.00 H new ATOM 0 HB ILE A 747 -24.480 -17.541 -0.011 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -22.014 -17.408 -1.776 1.00 0.00 H new ATOM 0 HG13 ILE A 747 -22.829 -16.030 -1.063 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -23.023 -19.535 0.202 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -24.550 -19.923 -0.626 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -23.051 -19.738 -1.566 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -20.833 -16.629 0.223 1.00 0.00 H new ATOM 0 HD12 ILE A 747 -22.300 -16.872 1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -21.472 -18.271 0.477 1.00 0.00 H new TER 1912 ILE A 747