USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 475 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 98 SER OG : rot -73:sc= 0.406 USER MOD Set 1.2: A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -149:sc=-0.00459 (180deg=-0.415) USER MOD Single : A 91 TYR OH : rot -17:sc= -0.243 USER MOD Single : A 93 SER OG : rot 81:sc= 0.213 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.0596 K(o=-0.06,f=-2!) USER MOD Single : A 97 MET CE :methyl -156:sc= -1.94 (180deg=-2.85!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.227) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= -0.854 USER MOD Single : A 142 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.4!) USER MOD Single : A 145 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.6!) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot -168:sc= 0.0224 USER MOD Single : A 164 GLN : amide:sc= -1.93 K(o=-1.9,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.393 -7.774 5.223 1.00 0.00 N ATOM 32 CA ARG A 59 -0.312 -8.542 4.194 1.00 0.00 C ATOM 33 C ARG A 59 -1.153 -9.648 4.817 1.00 0.00 C ATOM 34 O ARG A 59 -0.650 -10.735 5.103 1.00 0.00 O ATOM 35 CB ARG A 59 0.670 -9.183 3.211 1.00 0.00 C ATOM 36 CG ARG A 59 0.418 -8.638 1.809 1.00 0.00 C ATOM 37 CD ARG A 59 -0.865 -9.259 1.267 1.00 0.00 C ATOM 38 NE ARG A 59 -0.566 -10.129 0.136 1.00 0.00 N ATOM 39 CZ ARG A 59 -0.331 -9.645 -1.081 1.00 0.00 C ATOM 40 NH1 ARG A 59 -0.357 -8.358 -1.309 1.00 0.00 N ATOM 41 NH2 ARG A 59 -0.073 -10.468 -2.059 1.00 0.00 N ATOM 0 HA ARG A 59 -0.957 -7.841 3.664 1.00 0.00 H new ATOM 0 HB2 ARG A 59 1.695 -8.972 3.515 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.552 -10.267 3.218 1.00 0.00 H new ATOM 0 HG2 ARG A 59 0.330 -7.552 1.836 1.00 0.00 H new ATOM 0 HG3 ARG A 59 1.258 -8.874 1.155 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.361 -9.829 2.052 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -1.555 -8.474 0.958 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.536 -11.138 0.282 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -0.560 -7.709 -0.548 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.175 -8.003 -2.248 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.053 -11.473 -1.888 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.108 -10.106 -2.995 1.00 0.00 H new ATOM 55 N VAL A 60 -2.434 -9.376 5.018 1.00 0.00 N ATOM 56 CA VAL A 60 -3.328 -10.369 5.594 1.00 0.00 C ATOM 57 C VAL A 60 -4.457 -10.666 4.628 1.00 0.00 C ATOM 58 O VAL A 60 -5.139 -9.759 4.178 1.00 0.00 O ATOM 59 CB VAL A 60 -3.921 -9.842 6.887 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.853 -10.890 7.496 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.794 -9.522 7.861 1.00 0.00 C ATOM 0 H VAL A 60 -2.875 -8.484 4.793 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.760 -11.278 5.791 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.494 -8.937 6.683 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.276 -10.506 8.424 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.658 -11.112 6.795 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.291 -11.801 7.703 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.215 -9.143 8.792 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.220 -10.426 8.064 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.139 -8.767 7.425 1.00 0.00 H new ATOM 71 N VAL A 61 -4.650 -11.929 4.313 1.00 0.00 N ATOM 72 CA VAL A 61 -5.710 -12.316 3.388 1.00 0.00 C ATOM 73 C VAL A 61 -6.768 -13.137 4.114 1.00 0.00 C ATOM 74 O VAL A 61 -6.474 -14.201 4.648 1.00 0.00 O ATOM 75 CB VAL A 61 -5.116 -13.137 2.240 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.227 -13.561 1.276 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.085 -12.295 1.485 1.00 0.00 C ATOM 0 H VAL A 61 -4.096 -12.704 4.677 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.176 -11.416 2.987 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.634 -14.025 2.649 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.799 -14.145 0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.960 -14.166 1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.714 -12.675 0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.664 -12.882 0.669 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.568 -11.405 1.081 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.288 -11.998 2.167 1.00 0.00 H new ATOM 87 N VAL A 62 -8.000 -12.651 4.123 1.00 0.00 N ATOM 88 CA VAL A 62 -9.082 -13.371 4.786 1.00 0.00 C ATOM 89 C VAL A 62 -10.030 -13.948 3.736 1.00 0.00 C ATOM 90 O VAL A 62 -10.712 -13.214 3.020 1.00 0.00 O ATOM 91 CB VAL A 62 -9.847 -12.423 5.723 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.966 -13.178 6.437 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.883 -11.842 6.760 1.00 0.00 C ATOM 0 H VAL A 62 -8.276 -11.772 3.685 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.663 -14.185 5.377 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.282 -11.617 5.133 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.501 -12.496 7.098 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.658 -13.586 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.539 -13.992 7.023 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.426 -11.170 7.425 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.444 -12.652 7.343 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.092 -11.290 6.252 1.00 0.00 H new ATOM 103 N TYR A 63 -10.065 -15.271 3.655 1.00 0.00 N ATOM 104 CA TYR A 63 -10.916 -15.961 2.707 1.00 0.00 C ATOM 105 C TYR A 63 -12.298 -16.150 3.310 1.00 0.00 C ATOM 106 O TYR A 63 -12.435 -16.559 4.466 1.00 0.00 O ATOM 107 CB TYR A 63 -10.318 -17.327 2.366 1.00 0.00 C ATOM 108 CG TYR A 63 -9.035 -17.144 1.589 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.833 -16.922 2.273 1.00 0.00 C ATOM 110 CD2 TYR A 63 -9.044 -17.211 0.190 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.641 -16.763 1.558 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.850 -17.049 -0.524 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.650 -16.827 0.160 1.00 0.00 C ATOM 114 OH TYR A 63 -5.474 -16.671 -0.544 1.00 0.00 O ATOM 0 H TYR A 63 -9.506 -15.889 4.243 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.992 -15.366 1.797 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -10.123 -17.888 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -11.029 -17.910 1.780 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.826 -16.874 3.352 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.970 -17.387 -0.337 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.714 -16.591 2.085 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.856 -17.095 -1.603 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.655 -16.744 -1.504 1.00 0.00 H new ATOM 124 N ILE A 64 -13.301 -15.850 2.508 1.00 0.00 N ATOM 125 CA ILE A 64 -14.696 -15.966 2.929 1.00 0.00 C ATOM 126 C ILE A 64 -15.385 -17.116 2.204 1.00 0.00 C ATOM 127 O ILE A 64 -15.155 -17.340 1.023 1.00 0.00 O ATOM 128 CB ILE A 64 -15.434 -14.659 2.630 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.792 -13.515 3.420 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.897 -14.781 3.040 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.370 -12.165 2.972 1.00 0.00 C ATOM 0 H ILE A 64 -13.180 -15.520 1.550 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.718 -16.166 4.000 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.370 -14.455 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.968 -13.657 4.486 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.712 -13.523 3.271 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.415 -13.846 2.824 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.365 -15.592 2.482 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.959 -14.992 4.108 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.904 -11.362 3.543 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.171 -12.018 1.910 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.446 -12.155 3.144 1.00 0.00 H new ATOM 143 N ARG A 65 -16.227 -17.842 2.923 1.00 0.00 N ATOM 144 CA ARG A 65 -16.945 -18.966 2.336 1.00 0.00 C ATOM 145 C ARG A 65 -17.565 -18.585 0.996 1.00 0.00 C ATOM 146 O ARG A 65 -17.688 -17.404 0.669 1.00 0.00 O ATOM 147 CB ARG A 65 -18.052 -19.420 3.290 1.00 0.00 C ATOM 148 CG ARG A 65 -17.770 -20.835 3.806 1.00 0.00 C ATOM 149 CD ARG A 65 -17.800 -20.831 5.335 1.00 0.00 C ATOM 150 NE ARG A 65 -19.179 -20.806 5.818 1.00 0.00 N ATOM 151 CZ ARG A 65 -19.468 -20.656 7.113 1.00 0.00 C ATOM 152 NH1 ARG A 65 -18.517 -20.519 7.999 1.00 0.00 N ATOM 153 NH2 ARG A 65 -20.713 -20.650 7.499 1.00 0.00 N ATOM 0 H ARG A 65 -16.430 -17.676 3.909 1.00 0.00 H new ATOM 0 HA ARG A 65 -16.233 -19.775 2.171 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.123 -18.728 4.129 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -19.013 -19.399 2.777 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -18.514 -21.531 3.418 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -16.798 -21.177 3.451 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -17.290 -21.715 5.717 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.260 -19.963 5.713 1.00 0.00 H new ATOM 0 HE ARG A 65 -19.941 -20.906 5.148 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.541 -20.526 7.704 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -18.751 -20.405 8.985 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -21.460 -20.760 6.813 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -20.940 -20.536 8.487 1.00 0.00 H new ATOM 517 N LYS A 89 -20.429 -7.443 6.084 1.00 0.00 N ATOM 518 CA LYS A 89 -20.328 -7.961 7.437 1.00 0.00 C ATOM 519 C LYS A 89 -18.874 -8.185 7.807 1.00 0.00 C ATOM 520 O LYS A 89 -18.411 -7.741 8.856 1.00 0.00 O ATOM 521 CB LYS A 89 -21.120 -9.269 7.568 1.00 0.00 C ATOM 522 CG LYS A 89 -20.965 -10.126 6.300 1.00 0.00 C ATOM 523 CD LYS A 89 -21.653 -11.482 6.492 1.00 0.00 C ATOM 524 CE LYS A 89 -20.852 -12.327 7.484 1.00 0.00 C ATOM 525 NZ LYS A 89 -21.410 -13.709 7.522 1.00 0.00 N ATOM 0 HA LYS A 89 -20.753 -7.228 8.123 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.769 -9.827 8.436 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -22.174 -9.047 7.737 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.400 -9.607 5.446 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -19.908 -10.274 6.079 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -22.669 -11.337 6.859 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -21.731 -12.001 5.536 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -19.803 -12.355 7.190 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.894 -11.879 8.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -21.277 -14.111 8.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -22.425 -13.680 7.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -20.918 -14.301 6.823 1.00 0.00 H new ATOM 539 N VAL A 90 -18.156 -8.860 6.931 1.00 0.00 N ATOM 540 CA VAL A 90 -16.752 -9.130 7.152 1.00 0.00 C ATOM 541 C VAL A 90 -15.958 -7.844 6.997 1.00 0.00 C ATOM 542 O VAL A 90 -14.993 -7.602 7.717 1.00 0.00 O ATOM 543 CB VAL A 90 -16.258 -10.176 6.154 1.00 0.00 C ATOM 544 CG1 VAL A 90 -14.754 -10.391 6.339 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.003 -11.494 6.385 1.00 0.00 C ATOM 0 H VAL A 90 -18.525 -9.232 6.056 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.614 -9.517 8.161 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.448 -9.829 5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.403 -11.137 5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.228 -9.451 6.169 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.558 -10.738 7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -16.651 -12.241 5.673 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -16.817 -11.844 7.400 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.073 -11.337 6.246 1.00 0.00 H new ATOM 555 N TYR A 91 -16.369 -7.026 6.038 1.00 0.00 N ATOM 556 CA TYR A 91 -15.685 -5.772 5.775 1.00 0.00 C ATOM 557 C TYR A 91 -15.826 -4.847 6.970 1.00 0.00 C ATOM 558 O TYR A 91 -14.886 -4.147 7.343 1.00 0.00 O ATOM 559 CB TYR A 91 -16.259 -5.092 4.529 1.00 0.00 C ATOM 560 CG TYR A 91 -15.332 -3.982 4.069 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.293 -4.266 3.173 1.00 0.00 C ATOM 562 CD2 TYR A 91 -15.512 -2.670 4.523 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.442 -3.250 2.731 1.00 0.00 C ATOM 564 CE2 TYR A 91 -14.657 -1.651 4.079 1.00 0.00 C ATOM 565 CZ TYR A 91 -13.623 -1.942 3.183 1.00 0.00 C ATOM 566 OH TYR A 91 -12.780 -0.938 2.747 1.00 0.00 O ATOM 0 H TYR A 91 -17.169 -7.209 5.433 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.630 -5.986 5.601 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.387 -5.824 3.732 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.246 -4.685 4.749 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -14.149 -5.277 2.822 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -16.309 -2.443 5.215 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.644 -3.477 2.039 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -14.797 -0.639 4.430 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.971 -1.335 2.361 1.00 0.00 H new ATOM 576 N ASP A 92 -17.011 -4.842 7.563 1.00 0.00 N ATOM 577 CA ASP A 92 -17.259 -3.985 8.710 1.00 0.00 C ATOM 578 C ASP A 92 -16.414 -4.424 9.892 1.00 0.00 C ATOM 579 O ASP A 92 -15.855 -3.597 10.611 1.00 0.00 O ATOM 580 CB ASP A 92 -18.742 -4.026 9.085 1.00 0.00 C ATOM 581 CG ASP A 92 -19.067 -2.911 10.073 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.383 -1.902 10.046 1.00 0.00 O ATOM 583 OD2 ASP A 92 -19.999 -3.082 10.845 1.00 0.00 O ATOM 0 H ASP A 92 -17.805 -5.413 7.273 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.986 -2.963 8.446 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.354 -3.918 8.190 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.987 -4.993 9.524 1.00 0.00 H new ATOM 588 N SER A 93 -16.319 -5.728 10.082 1.00 0.00 N ATOM 589 CA SER A 93 -15.530 -6.260 11.185 1.00 0.00 C ATOM 590 C SER A 93 -14.053 -5.964 10.966 1.00 0.00 C ATOM 591 O SER A 93 -13.332 -5.578 11.890 1.00 0.00 O ATOM 592 CB SER A 93 -15.745 -7.766 11.295 1.00 0.00 C ATOM 593 OG SER A 93 -17.096 -8.019 11.654 1.00 0.00 O ATOM 0 H SER A 93 -16.770 -6.432 9.498 1.00 0.00 H new ATOM 0 HA SER A 93 -15.851 -5.782 12.111 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.512 -8.249 10.346 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.072 -8.188 12.042 1.00 0.00 H new ATOM 0 HG SER A 93 -17.662 -7.965 10.856 1.00 0.00 H new ATOM 599 N LEU A 94 -13.615 -6.141 9.728 1.00 0.00 N ATOM 600 CA LEU A 94 -12.220 -5.897 9.386 1.00 0.00 C ATOM 601 C LEU A 94 -11.908 -4.407 9.453 1.00 0.00 C ATOM 602 O LEU A 94 -10.755 -4.022 9.611 1.00 0.00 O ATOM 603 CB LEU A 94 -11.900 -6.442 7.986 1.00 0.00 C ATOM 604 CG LEU A 94 -11.971 -7.977 7.982 1.00 0.00 C ATOM 605 CD1 LEU A 94 -11.843 -8.482 6.545 1.00 0.00 C ATOM 606 CD2 LEU A 94 -10.830 -8.555 8.829 1.00 0.00 C ATOM 0 H LEU A 94 -14.198 -6.450 8.950 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.596 -6.419 10.111 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.605 -6.037 7.261 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.906 -6.116 7.680 1.00 0.00 H new ATOM 0 HG LEU A 94 -12.925 -8.295 8.403 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -11.893 -9.571 6.536 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.656 -8.077 5.943 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.888 -8.159 6.130 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -10.887 -9.643 8.822 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.873 -8.239 8.414 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -10.919 -8.194 9.854 1.00 0.00 H new ATOM 618 N LYS A 95 -12.944 -3.578 9.330 1.00 0.00 N ATOM 619 CA LYS A 95 -12.769 -2.132 9.383 1.00 0.00 C ATOM 620 C LYS A 95 -12.813 -1.616 10.815 1.00 0.00 C ATOM 621 O LYS A 95 -12.167 -0.623 11.150 1.00 0.00 O ATOM 622 CB LYS A 95 -13.857 -1.443 8.577 1.00 0.00 C ATOM 623 CG LYS A 95 -13.355 -1.249 7.154 1.00 0.00 C ATOM 624 CD LYS A 95 -12.423 -0.032 7.097 1.00 0.00 C ATOM 625 CE LYS A 95 -11.642 -0.041 5.781 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.943 1.266 5.612 1.00 0.00 N ATOM 0 H LYS A 95 -13.908 -3.883 9.194 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.790 -1.906 8.960 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.767 -2.043 8.579 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.108 -0.481 9.024 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.825 -2.141 6.820 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.197 -1.106 6.477 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.004 0.887 7.180 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -11.733 -0.051 7.941 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.918 -0.856 5.780 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -12.319 -0.215 4.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.411 1.262 4.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.643 2.035 5.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.286 1.413 6.405 1.00 0.00 H new ATOM 640 N ASN A 96 -13.587 -2.294 11.655 1.00 0.00 N ATOM 641 CA ASN A 96 -13.713 -1.892 13.048 1.00 0.00 C ATOM 642 C ASN A 96 -12.642 -2.555 13.907 1.00 0.00 C ATOM 643 O ASN A 96 -12.527 -2.266 15.096 1.00 0.00 O ATOM 644 CB ASN A 96 -15.101 -2.262 13.576 1.00 0.00 C ATOM 645 CG ASN A 96 -16.150 -1.371 12.920 1.00 0.00 C ATOM 646 OD1 ASN A 96 -15.823 -0.294 12.422 1.00 0.00 O ATOM 647 ND2 ASN A 96 -17.394 -1.758 12.890 1.00 0.00 N ATOM 0 H ASN A 96 -14.132 -3.117 11.398 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.579 -0.812 13.103 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.315 -3.310 13.364 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.133 -2.143 14.659 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -18.101 -1.168 12.452 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -17.660 -2.651 13.304 1.00 0.00 H new ATOM 654 N MET A 97 -11.855 -3.447 13.307 1.00 0.00 N ATOM 655 CA MET A 97 -10.801 -4.127 14.047 1.00 0.00 C ATOM 656 C MET A 97 -9.911 -3.143 14.816 1.00 0.00 C ATOM 657 O MET A 97 -9.210 -3.547 15.746 1.00 0.00 O ATOM 658 CB MET A 97 -9.927 -4.947 13.102 1.00 0.00 C ATOM 659 CG MET A 97 -9.869 -6.385 13.613 1.00 0.00 C ATOM 660 SD MET A 97 -8.359 -7.180 13.021 1.00 0.00 S ATOM 661 CE MET A 97 -9.077 -7.958 11.556 1.00 0.00 C ATOM 0 H MET A 97 -11.927 -3.711 12.324 1.00 0.00 H new ATOM 0 HA MET A 97 -11.294 -4.783 14.765 1.00 0.00 H new ATOM 0 HB2 MET A 97 -10.335 -4.921 12.092 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.924 -4.523 13.051 1.00 0.00 H new ATOM 0 HG2 MET A 97 -9.894 -6.395 14.703 1.00 0.00 H new ATOM 0 HG3 MET A 97 -10.742 -6.939 13.269 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.475 -8.821 11.271 1.00 0.00 H new ATOM 0 HE2 MET A 97 -10.094 -8.282 11.777 1.00 0.00 H new ATOM 0 HE3 MET A 97 -9.095 -7.241 10.735 1.00 0.00 H new ATOM 671 N SER A 98 -9.925 -1.866 14.412 1.00 0.00 N ATOM 672 CA SER A 98 -9.111 -0.823 15.051 1.00 0.00 C ATOM 673 C SER A 98 -7.660 -0.893 14.582 1.00 0.00 C ATOM 674 O SER A 98 -7.079 0.118 14.184 1.00 0.00 O ATOM 675 CB SER A 98 -9.171 -0.919 16.579 1.00 0.00 C ATOM 676 OG SER A 98 -7.988 -1.541 17.065 1.00 0.00 O ATOM 0 H SER A 98 -10.497 -1.528 13.638 1.00 0.00 H new ATOM 0 HA SER A 98 -9.530 0.137 14.752 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.275 0.076 17.012 1.00 0.00 H new ATOM 0 HB3 SER A 98 -10.047 -1.492 16.883 1.00 0.00 H new ATOM 0 HG SER A 98 -8.011 -2.498 16.854 1.00 0.00 H new ATOM 682 N THR A 99 -7.080 -2.083 14.625 1.00 0.00 N ATOM 683 CA THR A 99 -5.700 -2.266 14.198 1.00 0.00 C ATOM 684 C THR A 99 -5.605 -2.410 12.673 1.00 0.00 C ATOM 685 O THR A 99 -4.566 -2.795 12.137 1.00 0.00 O ATOM 686 CB THR A 99 -5.133 -3.513 14.880 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.420 -3.452 16.266 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.618 -3.584 14.678 1.00 0.00 C ATOM 0 H THR A 99 -7.540 -2.933 14.950 1.00 0.00 H new ATOM 0 HA THR A 99 -5.122 -1.387 14.484 1.00 0.00 H new ATOM 0 HB THR A 99 -5.589 -4.401 14.442 1.00 0.00 H new ATOM 0 HG1 THR A 99 -5.061 -4.249 16.710 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.227 -4.476 15.168 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.395 -3.628 13.612 1.00 0.00 H new ATOM 0 HG23 THR A 99 -3.151 -2.699 15.110 1.00 0.00 H new ATOM 696 N VAL A 100 -6.698 -2.101 11.980 1.00 0.00 N ATOM 697 CA VAL A 100 -6.733 -2.203 10.528 1.00 0.00 C ATOM 698 C VAL A 100 -6.484 -0.848 9.871 1.00 0.00 C ATOM 699 O VAL A 100 -6.955 0.188 10.341 1.00 0.00 O ATOM 700 CB VAL A 100 -8.103 -2.724 10.080 1.00 0.00 C ATOM 701 CG1 VAL A 100 -9.216 -1.867 10.713 1.00 0.00 C ATOM 702 CG2 VAL A 100 -8.196 -2.655 8.549 1.00 0.00 C ATOM 0 H VAL A 100 -7.569 -1.779 12.402 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.945 -2.892 10.222 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.225 -3.758 10.403 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -10.189 -2.240 10.393 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -9.145 -1.924 11.799 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -9.102 -0.830 10.396 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -9.169 -3.025 8.227 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.074 -1.622 8.223 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.410 -3.269 8.109 1.00 0.00 H new ATOM 712 N LYS A 101 -5.743 -0.868 8.774 1.00 0.00 N ATOM 713 CA LYS A 101 -5.446 0.356 8.049 1.00 0.00 C ATOM 714 C LYS A 101 -6.295 0.450 6.785 1.00 0.00 C ATOM 715 O LYS A 101 -6.779 1.523 6.429 1.00 0.00 O ATOM 716 CB LYS A 101 -3.961 0.402 7.690 1.00 0.00 C ATOM 717 CG LYS A 101 -3.669 1.671 6.891 1.00 0.00 C ATOM 718 CD LYS A 101 -2.176 1.748 6.577 1.00 0.00 C ATOM 719 CE LYS A 101 -1.890 3.011 5.756 1.00 0.00 C ATOM 720 NZ LYS A 101 -0.429 3.106 5.453 1.00 0.00 N ATOM 0 H LYS A 101 -5.339 -1.712 8.369 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.685 1.206 8.688 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.356 0.383 8.597 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.689 -0.478 7.107 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.246 1.671 5.966 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.977 2.549 7.459 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.600 1.764 7.502 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.864 0.863 6.023 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.461 2.988 4.828 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.213 3.894 6.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.245 3.965 4.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.108 3.148 6.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.132 2.271 4.909 1.00 0.00 H new ATOM 734 N SER A 102 -6.463 -0.682 6.110 1.00 0.00 N ATOM 735 CA SER A 102 -7.247 -0.721 4.883 1.00 0.00 C ATOM 736 C SER A 102 -7.672 -2.149 4.566 1.00 0.00 C ATOM 737 O SER A 102 -6.957 -3.103 4.870 1.00 0.00 O ATOM 738 CB SER A 102 -6.418 -0.165 3.725 1.00 0.00 C ATOM 739 OG SER A 102 -7.189 -0.203 2.531 1.00 0.00 O ATOM 0 H SER A 102 -6.069 -1.580 6.391 1.00 0.00 H new ATOM 0 HA SER A 102 -8.140 -0.111 5.020 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.112 0.859 3.941 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.507 -0.751 3.601 1.00 0.00 H new ATOM 0 HG SER A 102 -6.659 0.155 1.788 1.00 0.00 H new ATOM 745 N VAL A 103 -8.836 -2.286 3.945 1.00 0.00 N ATOM 746 CA VAL A 103 -9.344 -3.602 3.576 1.00 0.00 C ATOM 747 C VAL A 103 -9.718 -3.625 2.094 1.00 0.00 C ATOM 748 O VAL A 103 -10.479 -2.781 1.621 1.00 0.00 O ATOM 749 CB VAL A 103 -10.567 -3.950 4.424 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.096 -5.331 4.022 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.187 -3.949 5.912 1.00 0.00 C ATOM 0 H VAL A 103 -9.443 -1.508 3.687 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.564 -4.341 3.757 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.345 -3.205 4.256 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.968 -5.577 4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.377 -5.321 2.969 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.320 -6.079 4.183 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.063 -4.198 6.511 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.405 -4.688 6.088 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.823 -2.961 6.194 1.00 0.00 H new ATOM 761 N THR A 104 -9.166 -4.591 1.367 1.00 0.00 N ATOM 762 CA THR A 104 -9.424 -4.724 -0.061 1.00 0.00 C ATOM 763 C THR A 104 -10.136 -6.036 -0.343 1.00 0.00 C ATOM 764 O THR A 104 -9.724 -7.091 0.127 1.00 0.00 O ATOM 765 CB THR A 104 -8.105 -4.707 -0.833 1.00 0.00 C ATOM 766 OG1 THR A 104 -7.409 -3.500 -0.569 1.00 0.00 O ATOM 767 CG2 THR A 104 -8.373 -4.834 -2.332 1.00 0.00 C ATOM 0 H THR A 104 -8.534 -5.296 1.746 1.00 0.00 H new ATOM 0 HA THR A 104 -10.050 -3.890 -0.378 1.00 0.00 H new ATOM 0 HB THR A 104 -7.495 -5.551 -0.510 1.00 0.00 H new ATOM 0 HG1 THR A 104 -6.564 -3.495 -1.065 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.427 -4.821 -2.873 1.00 0.00 H new ATOM 0 HG22 THR A 104 -8.892 -5.772 -2.531 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.992 -4.000 -2.663 1.00 0.00 H new ATOM 775 N PHE A 105 -11.206 -5.955 -1.106 1.00 0.00 N ATOM 776 CA PHE A 105 -11.989 -7.122 -1.459 1.00 0.00 C ATOM 777 C PHE A 105 -11.429 -7.736 -2.734 1.00 0.00 C ATOM 778 O PHE A 105 -11.309 -7.057 -3.754 1.00 0.00 O ATOM 779 CB PHE A 105 -13.433 -6.673 -1.717 1.00 0.00 C ATOM 780 CG PHE A 105 -14.318 -7.865 -1.978 1.00 0.00 C ATOM 781 CD1 PHE A 105 -15.085 -8.377 -0.939 1.00 0.00 C ATOM 782 CD2 PHE A 105 -14.356 -8.467 -3.245 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.901 -9.488 -1.148 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.176 -9.586 -3.460 1.00 0.00 C ATOM 785 CZ PHE A 105 -15.946 -10.099 -2.403 1.00 0.00 C ATOM 0 H PHE A 105 -11.557 -5.081 -1.498 1.00 0.00 H new ATOM 0 HA PHE A 105 -11.954 -7.856 -0.654 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -13.806 -6.117 -0.857 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -13.463 -5.997 -2.571 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -15.049 -7.912 0.035 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.757 -8.071 -4.052 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -16.500 -9.877 -0.338 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -15.215 -10.051 -4.434 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.572 -10.965 -2.561 1.00 0.00 H new ATOM 795 N SER A 106 -11.087 -9.013 -2.684 1.00 0.00 N ATOM 796 CA SER A 106 -10.536 -9.680 -3.858 1.00 0.00 C ATOM 797 C SER A 106 -11.501 -10.754 -4.360 1.00 0.00 C ATOM 798 O SER A 106 -11.429 -11.908 -3.941 1.00 0.00 O ATOM 799 CB SER A 106 -9.198 -10.317 -3.485 1.00 0.00 C ATOM 800 OG SER A 106 -8.196 -9.879 -4.393 1.00 0.00 O ATOM 0 H SER A 106 -11.178 -9.604 -1.857 1.00 0.00 H new ATOM 0 HA SER A 106 -10.389 -8.949 -4.653 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.925 -10.044 -2.466 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.280 -11.404 -3.513 1.00 0.00 H new ATOM 0 HG SER A 106 -7.337 -10.286 -4.153 1.00 0.00 H new ATOM 806 N SER A 107 -12.400 -10.377 -5.265 1.00 0.00 N ATOM 807 CA SER A 107 -13.375 -11.327 -5.797 1.00 0.00 C ATOM 808 C SER A 107 -12.694 -12.621 -6.216 1.00 0.00 C ATOM 809 O SER A 107 -11.582 -12.609 -6.721 1.00 0.00 O ATOM 810 CB SER A 107 -14.106 -10.719 -6.994 1.00 0.00 C ATOM 811 OG SER A 107 -14.935 -11.708 -7.590 1.00 0.00 O ATOM 0 H SER A 107 -12.475 -9.432 -5.642 1.00 0.00 H new ATOM 0 HA SER A 107 -14.096 -11.550 -5.011 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.708 -9.869 -6.674 1.00 0.00 H new ATOM 0 HB3 SER A 107 -13.387 -10.344 -7.722 1.00 0.00 H new ATOM 0 HG SER A 107 -15.407 -11.321 -8.357 1.00 0.00 H new ATOM 817 N LYS A 108 -13.376 -13.732 -5.976 1.00 0.00 N ATOM 818 CA LYS A 108 -12.847 -15.045 -6.308 1.00 0.00 C ATOM 819 C LYS A 108 -12.591 -15.157 -7.796 1.00 0.00 C ATOM 820 O LYS A 108 -11.593 -15.732 -8.226 1.00 0.00 O ATOM 821 CB LYS A 108 -13.845 -16.122 -5.857 1.00 0.00 C ATOM 822 CG LYS A 108 -15.207 -15.888 -6.529 1.00 0.00 C ATOM 823 CD LYS A 108 -16.254 -16.840 -5.939 1.00 0.00 C ATOM 824 CE LYS A 108 -17.654 -16.377 -6.353 1.00 0.00 C ATOM 825 NZ LYS A 108 -17.771 -16.391 -7.838 1.00 0.00 N ATOM 0 H LYS A 108 -14.303 -13.748 -5.550 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.899 -15.189 -5.790 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -13.467 -17.111 -6.116 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -13.956 -16.097 -4.773 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.521 -14.854 -6.384 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.123 -16.047 -7.604 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.076 -17.856 -6.291 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.172 -16.860 -4.852 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -18.408 -17.030 -5.913 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.842 -15.373 -5.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.772 -16.310 -8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -17.239 -15.591 -8.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -17.384 -17.282 -8.208 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.830 -17.392 -3.160 1.00 0.00 N ATOM 1238 CA TYR A 134 -12.950 -16.798 -2.449 1.00 0.00 C ATOM 1239 C TYR A 134 -12.906 -15.278 -2.542 1.00 0.00 C ATOM 1240 O TYR A 134 -12.083 -14.709 -3.260 1.00 0.00 O ATOM 1241 CB TYR A 134 -12.928 -17.232 -0.981 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.257 -18.709 -0.864 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.440 -19.546 -0.096 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -14.375 -19.240 -1.524 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -12.739 -20.911 0.014 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -14.672 -20.603 -1.416 1.00 0.00 C ATOM 1247 CZ TYR A 134 -13.854 -21.439 -0.648 1.00 0.00 C ATOM 1248 OH TYR A 134 -14.145 -22.786 -0.547 1.00 0.00 O ATOM 0 HA TYR A 134 -13.873 -17.145 -2.913 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.946 -17.036 -0.551 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.648 -16.646 -0.410 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.578 -19.140 0.413 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -15.008 -18.596 -2.117 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -12.109 -21.555 0.609 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -15.533 -21.010 -1.926 1.00 0.00 H new ATOM 0 HH TYR A 134 -14.952 -22.986 -1.066 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.814 -14.625 -1.824 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.906 -13.171 -1.832 1.00 0.00 C ATOM 1260 C ASP A 135 -12.590 -12.512 -1.466 1.00 0.00 C ATOM 1261 O ASP A 135 -12.369 -11.361 -1.820 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.934 -12.737 -0.804 1.00 0.00 C ATOM 1263 CG ASP A 135 -16.341 -12.991 -1.321 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -16.471 -13.303 -2.492 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -17.269 -12.865 -0.539 1.00 0.00 O ATOM 0 H ASP A 135 -14.501 -15.084 -1.226 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.183 -12.868 -2.842 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.778 -13.281 0.127 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.808 -11.678 -0.579 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.754 -13.260 -0.755 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.437 -12.819 -0.296 1.00 0.00 C ATOM 1272 C ALA A 136 -10.455 -11.389 0.228 1.00 0.00 C ATOM 1273 O ALA A 136 -10.841 -10.464 -0.460 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.439 -12.952 -1.449 1.00 0.00 C ATOM 0 H ALA A 136 -11.977 -14.215 -0.473 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.137 -13.454 0.538 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.454 -12.625 -1.117 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.388 -13.993 -1.768 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.764 -12.332 -2.285 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.009 -11.201 1.447 1.00 0.00 N ATOM 1281 CA TYR A 137 -9.984 -9.863 2.017 1.00 0.00 C ATOM 1282 C TYR A 137 -8.559 -9.490 2.385 1.00 0.00 C ATOM 1283 O TYR A 137 -8.004 -9.998 3.360 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.872 -9.824 3.261 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.184 -9.148 2.961 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.372 -9.734 3.395 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.215 -7.949 2.243 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.593 -9.121 3.118 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.430 -7.339 1.964 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.622 -7.921 2.399 1.00 0.00 C ATOM 1291 OH TYR A 137 -15.827 -7.313 2.117 1.00 0.00 O ATOM 0 H TYR A 137 -9.663 -11.939 2.059 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.359 -9.148 1.285 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.053 -10.839 3.616 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.359 -9.293 4.063 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.346 -10.663 3.946 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.294 -7.497 1.906 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.514 -9.571 3.457 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.453 -6.413 1.409 1.00 0.00 H new ATOM 0 HH TYR A 137 -15.667 -6.489 1.612 1.00 0.00 H new ATOM 1301 N ILE A 138 -7.973 -8.604 1.606 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.612 -8.184 1.862 1.00 0.00 C ATOM 1303 C ILE A 138 -6.630 -7.021 2.858 1.00 0.00 C ATOM 1304 O ILE A 138 -7.032 -5.910 2.517 1.00 0.00 O ATOM 1305 CB ILE A 138 -5.947 -7.739 0.554 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.171 -8.799 -0.553 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.446 -7.548 0.789 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -5.709 -8.272 -1.928 1.00 0.00 C ATOM 0 H ILE A 138 -8.413 -8.165 0.798 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.044 -9.016 2.278 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.392 -6.798 0.231 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -5.624 -9.709 -0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.227 -9.065 -0.598 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -3.970 -7.232 -0.139 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.291 -6.787 1.554 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.007 -8.489 1.120 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -5.878 -9.037 -2.686 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.275 -7.376 -2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -4.647 -8.030 -1.887 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.205 -7.288 4.083 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.184 -6.279 5.124 1.00 0.00 C ATOM 1322 C VAL A 139 -4.763 -5.816 5.393 1.00 0.00 C ATOM 1323 O VAL A 139 -3.833 -6.619 5.436 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.795 -6.838 6.413 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.589 -5.826 7.550 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.301 -7.101 6.195 1.00 0.00 C ATOM 0 H VAL A 139 -5.868 -8.204 4.380 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.773 -5.427 4.785 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.309 -7.776 6.679 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -7.022 -6.219 8.470 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.522 -5.654 7.696 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.076 -4.885 7.293 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.737 -7.499 7.111 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.799 -6.168 5.931 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.431 -7.822 5.388 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.619 -4.517 5.584 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.318 -3.936 5.867 1.00 0.00 C ATOM 1338 C GLU A 140 -3.203 -3.611 7.348 1.00 0.00 C ATOM 1339 O GLU A 140 -3.860 -2.702 7.853 1.00 0.00 O ATOM 1340 CB GLU A 140 -3.113 -2.667 5.040 1.00 0.00 C ATOM 1341 CG GLU A 140 -2.772 -3.048 3.598 1.00 0.00 C ATOM 1342 CD GLU A 140 -4.002 -3.623 2.901 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -5.091 -3.152 3.179 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -3.836 -4.530 2.101 1.00 0.00 O ATOM 0 H GLU A 140 -5.385 -3.845 5.548 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.548 -4.659 5.600 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -4.015 -2.056 5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.310 -2.067 5.468 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.415 -2.172 3.057 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -1.964 -3.780 3.589 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.356 -4.362 8.040 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.154 -4.153 9.462 1.00 0.00 C ATOM 1353 C ALA A 141 -1.453 -2.822 9.703 1.00 0.00 C ATOM 1354 O ALA A 141 -0.663 -2.369 8.873 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.318 -5.297 10.042 1.00 0.00 C ATOM 0 H ALA A 141 -1.801 -5.118 7.639 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.125 -4.133 9.958 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.170 -5.134 11.110 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.838 -6.242 9.888 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.350 -5.330 9.542 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.752 -2.195 10.835 1.00 0.00 N ATOM 1362 CA ASN A 142 -1.149 -0.907 11.162 1.00 0.00 C ATOM 1363 C ASN A 142 0.367 -1.030 11.177 1.00 0.00 C ATOM 1364 O ASN A 142 1.074 -0.140 10.704 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.638 -0.433 12.535 1.00 0.00 C ATOM 1366 CG ASN A 142 -1.140 0.982 12.822 1.00 0.00 C ATOM 1367 OD1 ASN A 142 -0.017 1.336 12.465 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -1.920 1.821 13.450 1.00 0.00 N ATOM 0 H ASN A 142 -2.401 -2.552 11.536 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.443 -0.180 10.405 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.727 -0.455 12.567 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -1.283 -1.114 13.309 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -1.598 2.769 13.644 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.851 1.528 13.746 1.00 0.00 H new ATOM 1375 N ALA A 143 0.864 -2.137 11.713 1.00 0.00 N ATOM 1376 CA ALA A 143 2.301 -2.358 11.772 1.00 0.00 C ATOM 1377 C ALA A 143 2.657 -3.763 11.284 1.00 0.00 C ATOM 1378 O ALA A 143 1.816 -4.663 11.293 1.00 0.00 O ATOM 1379 CB ALA A 143 2.798 -2.175 13.208 1.00 0.00 C ATOM 0 H ALA A 143 0.299 -2.888 12.109 1.00 0.00 H new ATOM 0 HA ALA A 143 2.785 -1.630 11.121 1.00 0.00 H new ATOM 0 HB1 ALA A 143 3.875 -2.342 13.245 1.00 0.00 H new ATOM 0 HB2 ALA A 143 2.576 -1.162 13.543 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.298 -2.891 13.860 1.00 0.00 H new ATOM 1385 N PRO A 144 3.883 -3.965 10.866 1.00 0.00 N ATOM 1386 CA PRO A 144 4.361 -5.293 10.378 1.00 0.00 C ATOM 1387 C PRO A 144 4.314 -6.356 11.472 1.00 0.00 C ATOM 1388 O PRO A 144 4.460 -7.545 11.203 1.00 0.00 O ATOM 1389 CB PRO A 144 5.800 -5.023 9.919 1.00 0.00 C ATOM 1390 CG PRO A 144 6.216 -3.789 10.646 1.00 0.00 C ATOM 1391 CD PRO A 144 4.950 -2.955 10.811 1.00 0.00 C ATOM 0 HA PRO A 144 3.732 -5.688 9.580 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.454 -5.861 10.159 1.00 0.00 H new ATOM 0 HB3 PRO A 144 5.849 -4.880 8.840 1.00 0.00 H new ATOM 0 HG2 PRO A 144 6.651 -4.034 11.615 1.00 0.00 H new ATOM 0 HG3 PRO A 144 6.974 -3.242 10.085 1.00 0.00 H new ATOM 0 HD2 PRO A 144 4.981 -2.353 11.719 1.00 0.00 H new ATOM 0 HD3 PRO A 144 4.810 -2.267 9.977 1.00 0.00 H new ATOM 1399 N ASN A 145 4.114 -5.922 12.710 1.00 0.00 N ATOM 1400 CA ASN A 145 4.031 -6.851 13.830 1.00 0.00 C ATOM 1401 C ASN A 145 2.565 -7.124 14.212 1.00 0.00 C ATOM 1402 O ASN A 145 2.288 -7.933 15.100 1.00 0.00 O ATOM 1403 CB ASN A 145 4.785 -6.288 15.033 1.00 0.00 C ATOM 1404 CG ASN A 145 5.126 -7.415 15.999 1.00 0.00 C ATOM 1405 OD1 ASN A 145 5.390 -8.540 15.570 1.00 0.00 O ATOM 1406 ND2 ASN A 145 5.137 -7.185 17.282 1.00 0.00 N ATOM 0 H ASN A 145 4.007 -4.940 12.963 1.00 0.00 H new ATOM 0 HA ASN A 145 4.488 -7.793 13.526 1.00 0.00 H new ATOM 0 HB2 ASN A 145 5.697 -5.791 14.703 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.177 -5.536 15.536 1.00 0.00 H new ATOM 0 HD21 ASN A 145 5.364 -7.937 17.933 1.00 0.00 H new ATOM 0 HD22 ASN A 145 4.918 -6.253 17.635 1.00 0.00 H new ATOM 1413 N ASP A 146 1.632 -6.433 13.545 1.00 0.00 N ATOM 1414 CA ASP A 146 0.205 -6.581 13.813 1.00 0.00 C ATOM 1415 C ASP A 146 -0.439 -7.554 12.834 1.00 0.00 C ATOM 1416 O ASP A 146 -1.545 -8.025 13.064 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.477 -5.218 13.667 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.011 -4.284 14.778 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.532 -4.781 15.750 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.194 -3.088 14.635 1.00 0.00 O ATOM 0 H ASP A 146 1.848 -5.760 12.809 1.00 0.00 H new ATOM 0 HA ASP A 146 0.085 -6.968 14.825 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.242 -4.786 12.694 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.560 -5.337 13.710 1.00 0.00 H new ATOM 1425 N VAL A 147 0.261 -7.845 11.746 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.256 -8.767 10.735 1.00 0.00 C ATOM 1427 C VAL A 147 -0.667 -10.052 11.403 1.00 0.00 C ATOM 1428 O VAL A 147 -1.640 -10.695 11.012 1.00 0.00 O ATOM 1429 CB VAL A 147 0.796 -9.062 9.648 1.00 0.00 C ATOM 1430 CG1 VAL A 147 2.213 -8.910 10.211 1.00 0.00 C ATOM 1431 CG2 VAL A 147 0.623 -10.496 9.127 1.00 0.00 C ATOM 0 H VAL A 147 1.183 -7.461 11.538 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.114 -8.301 10.252 1.00 0.00 H new ATOM 0 HB VAL A 147 0.653 -8.349 8.836 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.940 -9.123 9.428 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.354 -7.891 10.571 1.00 0.00 H new ATOM 0 HG13 VAL A 147 2.354 -9.608 11.036 1.00 0.00 H new ATOM 0 HG21 VAL A 147 1.370 -10.697 8.359 1.00 0.00 H new ATOM 0 HG22 VAL A 147 0.750 -11.200 9.950 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -0.374 -10.611 8.702 1.00 0.00 H new ATOM 1441 N LYS A 148 0.080 -10.414 12.425 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.224 -11.637 13.157 1.00 0.00 C ATOM 1443 C LYS A 148 -1.479 -11.466 13.991 1.00 0.00 C ATOM 1444 O LYS A 148 -2.254 -12.404 14.163 1.00 0.00 O ATOM 1445 CB LYS A 148 0.948 -12.016 14.063 1.00 0.00 C ATOM 1446 CG LYS A 148 1.127 -10.960 15.160 1.00 0.00 C ATOM 1447 CD LYS A 148 2.433 -11.225 15.919 1.00 0.00 C ATOM 1448 CE LYS A 148 2.271 -12.439 16.838 1.00 0.00 C ATOM 1449 NZ LYS A 148 3.538 -12.661 17.594 1.00 0.00 N ATOM 0 H LYS A 148 0.888 -9.894 12.767 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.391 -12.434 12.432 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.769 -12.993 14.513 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.861 -12.099 13.474 1.00 0.00 H new ATOM 0 HG2 LYS A 148 1.146 -9.963 14.720 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.282 -10.989 15.848 1.00 0.00 H new ATOM 0 HD2 LYS A 148 3.244 -11.400 15.212 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.706 -10.348 16.507 1.00 0.00 H new ATOM 0 HE2 LYS A 148 1.445 -12.277 17.531 1.00 0.00 H new ATOM 0 HE3 LYS A 148 2.025 -13.324 16.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 3.430 -13.485 18.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 4.316 -12.833 16.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 3.753 -11.819 18.166 1.00 0.00 H new ATOM 1463 N THR A 149 -1.670 -10.264 14.507 1.00 0.00 N ATOM 1464 CA THR A 149 -2.835 -9.972 15.328 1.00 0.00 C ATOM 1465 C THR A 149 -4.087 -9.875 14.465 1.00 0.00 C ATOM 1466 O THR A 149 -5.166 -10.304 14.851 1.00 0.00 O ATOM 1467 CB THR A 149 -2.619 -8.671 16.101 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.434 -8.780 16.874 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.802 -8.435 17.038 1.00 0.00 C ATOM 0 H THR A 149 -1.036 -9.476 14.373 1.00 0.00 H new ATOM 0 HA THR A 149 -2.972 -10.786 16.040 1.00 0.00 H new ATOM 0 HB THR A 149 -2.532 -7.841 15.400 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.290 -7.948 17.371 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.650 -7.508 17.590 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.720 -8.363 16.454 1.00 0.00 H new ATOM 0 HG23 THR A 149 -3.882 -9.266 17.739 1.00 0.00 H new ATOM 1477 N ILE A 150 -3.934 -9.287 13.295 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.044 -9.117 12.377 1.00 0.00 C ATOM 1479 C ILE A 150 -5.514 -10.466 11.856 1.00 0.00 C ATOM 1480 O ILE A 150 -6.712 -10.720 11.738 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.599 -8.239 11.211 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.210 -6.837 11.711 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -5.721 -8.133 10.185 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.400 -6.113 12.362 1.00 0.00 C ATOM 0 H ILE A 150 -3.046 -8.917 12.956 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.873 -8.642 12.902 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.727 -8.695 10.743 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.397 -6.921 12.432 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.836 -6.244 10.876 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.397 -7.505 9.355 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -5.969 -9.127 9.813 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.601 -7.691 10.652 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.084 -5.127 12.702 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.203 -6.006 11.633 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.757 -6.693 13.213 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.563 -11.332 11.540 1.00 0.00 N ATOM 1497 CA ALA A 151 -4.900 -12.651 11.032 1.00 0.00 C ATOM 1498 C ALA A 151 -5.629 -13.466 12.089 1.00 0.00 C ATOM 1499 O ALA A 151 -6.574 -14.199 11.789 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.634 -13.388 10.592 1.00 0.00 C ATOM 0 H ALA A 151 -3.563 -11.148 11.625 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.559 -12.526 10.173 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -3.900 -14.375 10.213 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.137 -12.820 9.806 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -2.961 -13.495 11.443 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.179 -13.336 13.330 1.00 0.00 N ATOM 1507 CA GLU A 152 -5.789 -14.088 14.423 1.00 0.00 C ATOM 1508 C GLU A 152 -7.182 -13.550 14.728 1.00 0.00 C ATOM 1509 O GLU A 152 -8.065 -14.290 15.155 1.00 0.00 O ATOM 1510 CB GLU A 152 -4.907 -14.029 15.682 1.00 0.00 C ATOM 1511 CG GLU A 152 -5.421 -12.960 16.652 1.00 0.00 C ATOM 1512 CD GLU A 152 -4.374 -12.671 17.725 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -3.326 -13.294 17.686 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -4.635 -11.828 18.569 1.00 0.00 O ATOM 0 H GLU A 152 -4.407 -12.728 13.604 1.00 0.00 H new ATOM 0 HA GLU A 152 -5.878 -15.129 14.113 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -4.901 -15.002 16.174 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -3.877 -13.808 15.401 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -5.654 -12.046 16.106 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -6.346 -13.297 17.119 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.371 -12.257 14.492 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.660 -11.625 14.727 1.00 0.00 C ATOM 1523 C ASP A 153 -9.656 -12.007 13.637 1.00 0.00 C ATOM 1524 O ASP A 153 -10.838 -12.223 13.902 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.492 -10.110 14.774 1.00 0.00 C ATOM 1526 CG ASP A 153 -7.723 -9.719 16.029 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.659 -10.531 16.937 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -7.200 -8.616 16.063 1.00 0.00 O ATOM 0 H ASP A 153 -6.649 -11.629 14.139 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.048 -11.974 15.684 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.960 -9.766 13.887 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.468 -9.626 14.768 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.167 -12.085 12.401 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.024 -12.434 11.272 1.00 0.00 C ATOM 1535 C ALA A 154 -10.467 -13.891 11.355 1.00 0.00 C ATOM 1536 O ALA A 154 -11.519 -14.260 10.839 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.291 -12.186 9.952 1.00 0.00 C ATOM 0 H ALA A 154 -8.191 -11.913 12.158 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.910 -11.801 11.312 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -9.942 -12.451 9.119 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -9.019 -11.133 9.879 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.389 -12.797 9.916 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.660 -14.712 12.016 1.00 0.00 N ATOM 1544 CA LYS A 155 -9.979 -16.127 12.167 1.00 0.00 C ATOM 1545 C LYS A 155 -11.272 -16.304 12.957 1.00 0.00 C ATOM 1546 O LYS A 155 -11.946 -17.329 12.845 1.00 0.00 O ATOM 1547 CB LYS A 155 -8.837 -16.840 12.889 1.00 0.00 C ATOM 1548 CG LYS A 155 -7.705 -17.118 11.899 1.00 0.00 C ATOM 1549 CD LYS A 155 -6.388 -17.245 12.664 1.00 0.00 C ATOM 1550 CE LYS A 155 -5.690 -18.544 12.265 1.00 0.00 C ATOM 1551 NZ LYS A 155 -6.190 -19.654 13.123 1.00 0.00 N ATOM 0 H LYS A 155 -8.785 -14.425 12.454 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.112 -16.560 11.176 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.472 -16.225 13.712 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.193 -17.774 13.323 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.907 -18.035 11.345 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.639 -16.312 11.168 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -5.745 -16.392 12.446 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -6.576 -17.236 13.738 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -5.881 -18.766 11.215 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -4.611 -18.440 12.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -5.717 -20.540 12.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -5.986 -19.441 14.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -7.217 -19.757 12.994 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.614 -15.294 13.749 1.00 0.00 N ATOM 1566 CA LYS A 156 -12.835 -15.342 14.547 1.00 0.00 C ATOM 1567 C LYS A 156 -13.923 -14.436 13.967 1.00 0.00 C ATOM 1568 O LYS A 156 -14.976 -14.254 14.578 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.531 -14.940 15.990 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.752 -16.068 16.666 1.00 0.00 C ATOM 1571 CD LYS A 156 -11.489 -15.709 18.128 1.00 0.00 C ATOM 1572 CE LYS A 156 -10.181 -14.927 18.232 1.00 0.00 C ATOM 1573 NZ LYS A 156 -9.852 -14.708 19.669 1.00 0.00 N ATOM 0 H LYS A 156 -11.069 -14.439 13.856 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.209 -16.366 14.526 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -11.951 -14.017 16.010 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.458 -14.746 16.530 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -12.316 -16.999 16.606 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -10.808 -16.233 16.147 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -12.313 -15.114 18.522 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -11.433 -16.615 18.732 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -9.376 -15.475 17.742 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -10.274 -13.970 17.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -8.962 -14.176 19.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -10.617 -14.169 20.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -9.747 -15.627 20.145 1.00 0.00 H new ATOM 1587 N ILE A 157 -13.670 -13.875 12.784 1.00 0.00 N ATOM 1588 CA ILE A 157 -14.640 -12.999 12.136 1.00 0.00 C ATOM 1589 C ILE A 157 -15.677 -13.814 11.374 1.00 0.00 C ATOM 1590 O ILE A 157 -15.324 -14.722 10.620 1.00 0.00 O ATOM 1591 CB ILE A 157 -13.917 -12.043 11.177 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.964 -10.625 11.749 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -14.567 -12.056 9.793 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -13.004 -9.733 10.964 1.00 0.00 C ATOM 0 H ILE A 157 -12.806 -14.012 12.259 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.153 -12.421 12.904 1.00 0.00 H new ATOM 0 HB ILE A 157 -12.883 -12.373 11.073 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.978 -10.229 11.689 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -13.688 -10.636 12.804 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -14.034 -11.370 9.134 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -14.523 -13.064 9.380 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -15.608 -11.744 9.877 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -13.034 -8.721 11.368 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -11.991 -10.127 11.047 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.301 -9.714 9.915 1.00 0.00 H new ATOM 1606 N GLU A 158 -16.948 -13.456 11.575 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.072 -14.117 10.907 1.00 0.00 C ATOM 1608 C GLU A 158 -17.794 -15.619 10.687 1.00 0.00 C ATOM 1609 O GLU A 158 -17.398 -16.320 11.620 1.00 0.00 O ATOM 1610 CB GLU A 158 -18.330 -13.409 9.575 1.00 0.00 C ATOM 1611 CG GLU A 158 -18.502 -11.906 9.808 1.00 0.00 C ATOM 1612 CD GLU A 158 -19.718 -11.642 10.691 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -20.590 -12.494 10.735 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -19.760 -10.591 11.309 1.00 0.00 O ATOM 0 H GLU A 158 -17.226 -12.702 12.203 1.00 0.00 H new ATOM 0 HA GLU A 158 -18.957 -14.049 11.540 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -17.500 -13.587 8.892 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -19.224 -13.817 9.103 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -17.607 -11.500 10.279 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.620 -11.394 8.853 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.985 -16.106 9.454 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.729 -17.506 9.151 1.00 0.00 C ATOM 1623 C GLY A 159 -16.544 -17.637 8.197 1.00 0.00 C ATOM 1624 O GLY A 159 -16.587 -18.428 7.257 1.00 0.00 O ATOM 0 H GLY A 159 -18.313 -15.552 8.663 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -17.525 -18.052 10.072 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.615 -17.956 8.704 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.495 -16.838 8.439 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.300 -16.859 7.591 1.00 0.00 C ATOM 1630 C VAL A 160 -13.901 -18.289 7.256 1.00 0.00 C ATOM 1631 O VAL A 160 -13.890 -19.163 8.122 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.128 -16.160 8.297 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -12.776 -16.911 9.584 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -11.903 -16.149 7.374 1.00 0.00 C ATOM 0 H VAL A 160 -15.452 -16.173 9.211 1.00 0.00 H new ATOM 0 HA VAL A 160 -14.536 -16.329 6.669 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.418 -15.137 8.538 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -11.944 -16.411 10.081 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -13.641 -16.922 10.247 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -12.492 -17.935 9.342 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -11.073 -15.653 7.877 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -11.620 -17.174 7.132 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -12.144 -15.613 6.456 1.00 0.00 H new ATOM 1644 N SER A 161 -13.579 -18.527 5.990 1.00 0.00 N ATOM 1645 CA SER A 161 -13.174 -19.854 5.556 1.00 0.00 C ATOM 1646 C SER A 161 -11.732 -20.148 5.968 1.00 0.00 C ATOM 1647 O SER A 161 -11.427 -21.226 6.478 1.00 0.00 O ATOM 1648 CB SER A 161 -13.328 -19.971 4.044 1.00 0.00 C ATOM 1649 OG SER A 161 -12.958 -21.282 3.635 1.00 0.00 O ATOM 0 H SER A 161 -13.591 -17.823 5.252 1.00 0.00 H new ATOM 0 HA SER A 161 -13.818 -20.589 6.040 1.00 0.00 H new ATOM 0 HB2 SER A 161 -14.358 -19.764 3.755 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.702 -19.231 3.545 1.00 0.00 H new ATOM 0 HG SER A 161 -12.868 -21.307 2.659 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.844 -19.177 5.733 1.00 0.00 N ATOM 1656 CA GLU A 162 -9.428 -19.350 6.076 1.00 0.00 C ATOM 1657 C GLU A 162 -8.677 -18.027 5.983 1.00 0.00 C ATOM 1658 O GLU A 162 -9.005 -17.176 5.168 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.785 -20.374 5.138 1.00 0.00 C ATOM 1660 CG GLU A 162 -7.299 -20.522 5.475 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.664 -21.585 4.583 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -7.087 -21.705 3.446 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.767 -22.265 5.053 1.00 0.00 O ATOM 0 H GLU A 162 -11.075 -18.276 5.313 1.00 0.00 H new ATOM 0 HA GLU A 162 -9.369 -19.709 7.104 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.287 -21.336 5.236 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.903 -20.057 4.102 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.790 -19.568 5.337 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -7.181 -20.797 6.523 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.662 -17.865 6.821 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.865 -16.638 6.817 1.00 0.00 C ATOM 1672 C VAL A 163 -5.402 -16.947 6.523 1.00 0.00 C ATOM 1673 O VAL A 163 -4.794 -17.807 7.157 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.979 -15.932 8.165 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -6.139 -14.654 8.148 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -8.441 -15.581 8.443 1.00 0.00 C ATOM 0 H VAL A 163 -7.370 -18.560 7.508 1.00 0.00 H new ATOM 0 HA VAL A 163 -7.250 -15.984 6.034 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.613 -16.595 8.949 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.222 -14.151 9.112 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -5.096 -14.907 7.959 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.500 -13.992 7.361 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.517 -15.077 9.407 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.812 -14.922 7.658 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -9.037 -16.493 8.463 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.851 -16.230 5.554 1.00 0.00 N ATOM 1687 CA GLN A 164 -3.464 -16.409 5.161 1.00 0.00 C ATOM 1688 C GLN A 164 -2.666 -15.139 5.436 1.00 0.00 C ATOM 1689 O GLN A 164 -2.952 -14.084 4.875 1.00 0.00 O ATOM 1690 CB GLN A 164 -3.409 -16.759 3.665 1.00 0.00 C ATOM 1691 CG GLN A 164 -1.999 -16.546 3.100 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.001 -17.467 3.794 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -0.800 -17.373 5.003 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -0.351 -18.356 3.093 1.00 0.00 N ATOM 0 H GLN A 164 -5.349 -15.515 5.024 1.00 0.00 H new ATOM 0 HA GLN A 164 -3.024 -17.219 5.742 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -3.709 -17.797 3.520 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -4.121 -16.141 3.117 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -1.997 -16.740 2.027 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -1.699 -15.507 3.236 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -0.517 -18.435 2.090 1.00 0.00 H new ATOM 0 HE22 GLN A 164 0.323 -18.972 3.549 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.657 -15.254 6.286 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.816 -14.112 6.608 1.00 0.00 C ATOM 1705 C ASP A 165 0.455 -14.152 5.763 1.00 0.00 C ATOM 1706 O ASP A 165 0.868 -15.219 5.309 1.00 0.00 O ATOM 1707 CB ASP A 165 -0.460 -14.134 8.095 1.00 0.00 C ATOM 1708 CG ASP A 165 0.617 -15.181 8.355 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.783 -14.832 8.286 1.00 0.00 O ATOM 1710 OD2 ASP A 165 0.259 -16.318 8.612 1.00 0.00 O ATOM 0 H ASP A 165 -1.402 -16.119 6.762 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.358 -13.192 6.388 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -0.107 -13.151 8.408 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -1.347 -14.358 8.687 1.00 0.00 H new ATOM 1715 N GLY A 166 1.066 -12.991 5.557 1.00 0.00 N ATOM 1716 CA GLY A 166 2.288 -12.914 4.762 1.00 0.00 C ATOM 1717 C GLY A 166 3.413 -13.729 5.400 1.00 0.00 C ATOM 1718 O GLY A 166 4.147 -14.436 4.709 1.00 0.00 O ATOM 0 H GLY A 166 0.740 -12.097 5.925 1.00 0.00 H new ATOM 0 HA2 GLY A 166 2.094 -13.283 3.755 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.598 -11.873 4.666 1.00 0.00 H new