USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=18 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 148 LYS NZ :NH3+ 176:sc= 0.805 (180deg=0) USER MOD Set 1.2: A 149 THR OG1 : rot 180:sc= 0.715 USER MOD Set 2.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 164 GLN : amide:sc= 0 X(o=0,f=0.011) USER MOD Single : A 89 LYS NZ :NH3+ 135:sc= 0.0694 (180deg=-0.307) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 80:sc= 1.04 USER MOD Single : A 95 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.179) USER MOD Single : A 96 ASN : amide:sc= -1.49 K(o=-1.5,f=-5.6!) USER MOD Single : A 97 MET CE :methyl -112:sc= -0.401 (180deg=-1.86) USER MOD Single : A 98 SER OG : rot 180:sc= -0.529 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= -0.499 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= -0.155 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= -0.724 USER MOD Single : A 142 ASN : amide:sc= -2.13 K(o=-2.1,f=-4.9!) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 LYS NZ :NH3+ -162:sc=-0.00936 (180deg=-0.129) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 159:sc= 0.217 USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.268 -6.748 4.654 1.00 0.00 N ATOM 32 CA ARG A 59 -0.679 -7.345 3.713 1.00 0.00 C ATOM 33 C ARG A 59 -1.240 -8.659 4.256 1.00 0.00 C ATOM 34 O ARG A 59 -0.504 -9.631 4.452 1.00 0.00 O ATOM 35 CB ARG A 59 0.001 -7.581 2.359 1.00 0.00 C ATOM 36 CG ARG A 59 -0.984 -7.314 1.222 1.00 0.00 C ATOM 37 CD ARG A 59 -1.991 -8.460 1.136 1.00 0.00 C ATOM 38 NE ARG A 59 -1.295 -9.727 0.955 1.00 0.00 N ATOM 39 CZ ARG A 59 -0.828 -10.103 -0.235 1.00 0.00 C ATOM 40 NH1 ARG A 59 -0.969 -9.333 -1.282 1.00 0.00 N ATOM 41 NH2 ARG A 59 -0.216 -11.248 -0.352 1.00 0.00 N ATOM 0 HA ARG A 59 -1.509 -6.651 3.580 1.00 0.00 H new ATOM 0 HB2 ARG A 59 0.868 -6.928 2.260 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.366 -8.606 2.301 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -1.504 -6.371 1.392 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -0.448 -7.216 0.278 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.593 -8.494 2.044 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.676 -8.291 0.305 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.162 -10.341 1.759 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.441 -8.433 -1.193 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.607 -9.632 -2.188 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.098 -11.849 0.464 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.144 -11.543 -1.259 1.00 0.00 H new ATOM 55 N VAL A 60 -2.548 -8.677 4.493 1.00 0.00 N ATOM 56 CA VAL A 60 -3.214 -9.861 5.013 1.00 0.00 C ATOM 57 C VAL A 60 -4.430 -10.190 4.155 1.00 0.00 C ATOM 58 O VAL A 60 -5.152 -9.304 3.719 1.00 0.00 O ATOM 59 CB VAL A 60 -3.643 -9.639 6.457 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.318 -10.903 6.991 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.413 -9.313 7.309 1.00 0.00 C ATOM 0 H VAL A 60 -3.167 -7.882 4.332 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.515 -10.697 4.982 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.347 -8.808 6.504 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.625 -10.743 8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.194 -11.132 6.384 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.617 -11.737 6.945 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.719 -9.154 8.343 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.708 -10.143 7.263 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.936 -8.410 6.929 1.00 0.00 H new ATOM 71 N VAL A 61 -4.646 -11.465 3.911 1.00 0.00 N ATOM 72 CA VAL A 61 -5.782 -11.896 3.104 1.00 0.00 C ATOM 73 C VAL A 61 -6.725 -12.761 3.935 1.00 0.00 C ATOM 74 O VAL A 61 -6.367 -13.860 4.346 1.00 0.00 O ATOM 75 CB VAL A 61 -5.274 -12.695 1.899 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.462 -13.181 1.071 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.385 -11.802 1.032 1.00 0.00 C ATOM 0 H VAL A 61 -4.057 -12.223 4.255 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.327 -11.018 2.759 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.699 -13.552 2.250 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.100 -13.749 0.214 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -7.098 -13.818 1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -7.037 -12.323 0.721 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.024 -12.370 0.175 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.961 -10.945 0.682 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.536 -11.453 1.620 1.00 0.00 H new ATOM 87 N VAL A 62 -7.942 -12.275 4.153 1.00 0.00 N ATOM 88 CA VAL A 62 -8.932 -13.032 4.920 1.00 0.00 C ATOM 89 C VAL A 62 -9.867 -13.725 3.943 1.00 0.00 C ATOM 90 O VAL A 62 -10.662 -13.078 3.288 1.00 0.00 O ATOM 91 CB VAL A 62 -9.732 -12.088 5.824 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.677 -12.896 6.716 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.767 -11.278 6.693 1.00 0.00 C ATOM 0 H VAL A 62 -8.267 -11.370 3.814 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.431 -13.769 5.548 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.321 -11.411 5.206 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.242 -12.218 7.356 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.366 -13.466 6.093 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.097 -13.580 7.335 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.334 -10.606 7.337 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.175 -11.956 7.308 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.104 -10.695 6.054 1.00 0.00 H new ATOM 103 N TYR A 63 -9.769 -15.038 3.846 1.00 0.00 N ATOM 104 CA TYR A 63 -10.595 -15.798 2.944 1.00 0.00 C ATOM 105 C TYR A 63 -11.973 -16.021 3.533 1.00 0.00 C ATOM 106 O TYR A 63 -12.117 -16.294 4.717 1.00 0.00 O ATOM 107 CB TYR A 63 -9.938 -17.154 2.666 1.00 0.00 C ATOM 108 CG TYR A 63 -8.607 -16.945 1.980 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.425 -17.369 2.603 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.552 -16.331 0.727 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.192 -17.184 1.967 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.321 -16.141 0.092 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.139 -16.567 0.712 1.00 0.00 C ATOM 114 OH TYR A 63 -4.924 -16.386 0.080 1.00 0.00 O ATOM 0 H TYR A 63 -9.115 -15.600 4.391 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.698 -15.236 2.016 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.795 -17.698 3.600 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.589 -17.763 2.039 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.466 -17.839 3.575 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.462 -16.002 0.248 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.282 -17.517 2.444 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.281 -15.666 -0.877 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.067 -15.944 -0.783 1.00 0.00 H new ATOM 124 N ILE A 64 -12.968 -15.901 2.681 1.00 0.00 N ATOM 125 CA ILE A 64 -14.357 -16.077 3.078 1.00 0.00 C ATOM 126 C ILE A 64 -14.914 -17.348 2.448 1.00 0.00 C ATOM 127 O ILE A 64 -14.366 -17.845 1.467 1.00 0.00 O ATOM 128 CB ILE A 64 -15.185 -14.862 2.627 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.569 -13.585 3.215 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.628 -14.991 3.123 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.257 -12.334 2.646 1.00 0.00 C ATOM 0 H ILE A 64 -12.842 -15.679 1.693 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.413 -16.162 4.163 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.182 -14.816 1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.665 -13.596 4.301 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.503 -13.553 2.990 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.204 -14.125 2.797 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.074 -15.898 2.714 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.635 -15.043 4.212 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.804 -11.442 3.077 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.138 -12.314 1.563 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.318 -12.358 2.894 1.00 0.00 H new ATOM 143 N ARG A 65 -15.993 -17.868 3.031 1.00 0.00 N ATOM 144 CA ARG A 65 -16.635 -19.082 2.526 1.00 0.00 C ATOM 145 C ARG A 65 -16.684 -19.067 1.004 1.00 0.00 C ATOM 146 O ARG A 65 -16.624 -17.998 0.396 1.00 0.00 O ATOM 147 CB ARG A 65 -18.068 -19.160 3.047 1.00 0.00 C ATOM 148 CG ARG A 65 -18.075 -19.265 4.570 1.00 0.00 C ATOM 149 CD ARG A 65 -17.751 -20.699 4.965 1.00 0.00 C ATOM 150 NE ARG A 65 -17.691 -20.832 6.414 1.00 0.00 N ATOM 151 CZ ARG A 65 -17.509 -22.016 6.999 1.00 0.00 C ATOM 152 NH1 ARG A 65 -17.393 -23.106 6.283 1.00 0.00 N ATOM 153 NH2 ARG A 65 -17.444 -22.089 8.299 1.00 0.00 N ATOM 0 H ARG A 65 -16.442 -17.467 3.855 1.00 0.00 H new ATOM 0 HA ARG A 65 -16.056 -19.940 2.867 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.624 -18.276 2.734 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.573 -20.024 2.614 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -17.343 -18.581 4.999 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -19.050 -18.976 4.964 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -18.509 -21.372 4.564 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -16.798 -20.996 4.528 1.00 0.00 H new ATOM 0 HE ARG A 65 -17.791 -20.000 6.995 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.442 -23.055 5.265 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.254 -24.006 6.743 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -17.532 -21.243 8.862 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.305 -22.992 8.753 1.00 0.00 H new ATOM 517 N LYS A 89 -20.969 -7.262 6.303 1.00 0.00 N ATOM 518 CA LYS A 89 -20.814 -7.587 7.712 1.00 0.00 C ATOM 519 C LYS A 89 -19.366 -7.923 8.030 1.00 0.00 C ATOM 520 O LYS A 89 -18.812 -7.463 9.025 1.00 0.00 O ATOM 521 CB LYS A 89 -21.716 -8.770 8.066 1.00 0.00 C ATOM 522 CG LYS A 89 -21.822 -8.914 9.584 1.00 0.00 C ATOM 523 CD LYS A 89 -20.852 -9.994 10.069 1.00 0.00 C ATOM 524 CE LYS A 89 -20.866 -10.037 11.599 1.00 0.00 C ATOM 525 NZ LYS A 89 -20.019 -11.165 12.076 1.00 0.00 N ATOM 0 HA LYS A 89 -21.102 -6.720 8.306 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.707 -8.623 7.637 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.314 -9.686 7.633 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.593 -7.963 10.066 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -22.842 -9.176 9.864 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -21.138 -10.965 9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.845 -9.783 9.709 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.495 -9.095 12.003 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.887 -10.158 11.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -19.418 -10.840 12.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -20.628 -11.942 12.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -19.418 -11.502 11.297 1.00 0.00 H new ATOM 539 N VAL A 90 -18.755 -8.717 7.168 1.00 0.00 N ATOM 540 CA VAL A 90 -17.365 -9.108 7.354 1.00 0.00 C ATOM 541 C VAL A 90 -16.457 -7.903 7.149 1.00 0.00 C ATOM 542 O VAL A 90 -15.494 -7.697 7.882 1.00 0.00 O ATOM 543 CB VAL A 90 -16.988 -10.227 6.384 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.482 -10.490 6.466 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.743 -11.499 6.770 1.00 0.00 C ATOM 0 H VAL A 90 -19.197 -9.104 6.334 1.00 0.00 H new ATOM 0 HA VAL A 90 -17.238 -9.479 8.371 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.251 -9.934 5.368 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -15.214 -11.288 5.774 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.939 -9.583 6.201 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -15.219 -10.787 7.481 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -17.479 -12.302 6.082 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.473 -11.788 7.786 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.816 -11.315 6.718 1.00 0.00 H new ATOM 555 N TYR A 91 -16.788 -7.102 6.146 1.00 0.00 N ATOM 556 CA TYR A 91 -16.019 -5.907 5.835 1.00 0.00 C ATOM 557 C TYR A 91 -16.072 -4.925 6.991 1.00 0.00 C ATOM 558 O TYR A 91 -15.062 -4.340 7.377 1.00 0.00 O ATOM 559 CB TYR A 91 -16.554 -5.243 4.565 1.00 0.00 C ATOM 560 CG TYR A 91 -15.824 -3.943 4.321 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.502 -3.953 3.859 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.473 -2.725 4.552 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.831 -2.746 3.630 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.802 -1.517 4.324 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.481 -1.529 3.864 1.00 0.00 C ATOM 566 OH TYR A 91 -13.819 -0.338 3.641 1.00 0.00 O ATOM 0 H TYR A 91 -17.587 -7.260 5.532 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.983 -6.202 5.670 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.424 -5.910 3.712 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.624 -5.057 4.664 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -14.000 -4.892 3.679 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.493 -2.716 4.907 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.812 -2.754 3.273 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.304 -0.578 4.503 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.414 0.412 3.852 1.00 0.00 H new ATOM 576 N ASP A 92 -17.267 -4.738 7.528 1.00 0.00 N ATOM 577 CA ASP A 92 -17.452 -3.804 8.631 1.00 0.00 C ATOM 578 C ASP A 92 -16.691 -4.270 9.861 1.00 0.00 C ATOM 579 O ASP A 92 -16.086 -3.470 10.573 1.00 0.00 O ATOM 580 CB ASP A 92 -18.938 -3.666 8.965 1.00 0.00 C ATOM 581 CG ASP A 92 -19.137 -2.580 10.017 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.900 -1.426 9.701 1.00 0.00 O ATOM 583 OD2 ASP A 92 -19.523 -2.920 11.124 1.00 0.00 O ATOM 0 H ASP A 92 -18.116 -5.214 7.223 1.00 0.00 H new ATOM 0 HA ASP A 92 -17.063 -2.833 8.324 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.500 -3.419 8.064 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -19.326 -4.616 9.333 1.00 0.00 H new ATOM 588 N SER A 93 -16.734 -5.569 10.100 1.00 0.00 N ATOM 589 CA SER A 93 -16.048 -6.145 11.251 1.00 0.00 C ATOM 590 C SER A 93 -14.540 -5.996 11.095 1.00 0.00 C ATOM 591 O SER A 93 -13.821 -5.738 12.056 1.00 0.00 O ATOM 592 CB SER A 93 -16.420 -7.614 11.406 1.00 0.00 C ATOM 593 OG SER A 93 -17.818 -7.721 11.631 1.00 0.00 O ATOM 0 H SER A 93 -17.232 -6.244 9.519 1.00 0.00 H new ATOM 0 HA SER A 93 -16.361 -5.610 12.148 1.00 0.00 H new ATOM 0 HB2 SER A 93 -16.140 -8.169 10.510 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.871 -8.055 12.238 1.00 0.00 H new ATOM 0 HG SER A 93 -18.294 -7.643 10.778 1.00 0.00 H new ATOM 599 N LEU A 94 -14.066 -6.172 9.871 1.00 0.00 N ATOM 600 CA LEU A 94 -12.638 -6.055 9.601 1.00 0.00 C ATOM 601 C LEU A 94 -12.226 -4.585 9.463 1.00 0.00 C ATOM 602 O LEU A 94 -11.037 -4.267 9.442 1.00 0.00 O ATOM 603 CB LEU A 94 -12.285 -6.812 8.317 1.00 0.00 C ATOM 604 CG LEU A 94 -12.529 -8.313 8.509 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.362 -9.026 7.166 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.519 -8.874 9.516 1.00 0.00 C ATOM 0 H LEU A 94 -14.639 -6.394 9.057 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.095 -6.489 10.441 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.888 -6.440 7.489 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.242 -6.635 8.056 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.539 -8.473 8.886 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.535 -10.094 7.297 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -13.081 -8.627 6.451 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.351 -8.865 6.792 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.694 -9.941 9.651 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.507 -8.717 9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.636 -8.363 10.472 1.00 0.00 H new ATOM 618 N LYS A 95 -13.213 -3.696 9.360 1.00 0.00 N ATOM 619 CA LYS A 95 -12.941 -2.271 9.219 1.00 0.00 C ATOM 620 C LYS A 95 -12.753 -1.598 10.571 1.00 0.00 C ATOM 621 O LYS A 95 -11.893 -0.732 10.730 1.00 0.00 O ATOM 622 CB LYS A 95 -14.104 -1.592 8.498 1.00 0.00 C ATOM 623 CG LYS A 95 -13.651 -1.159 7.110 1.00 0.00 C ATOM 624 CD LYS A 95 -12.737 0.062 7.236 1.00 0.00 C ATOM 625 CE LYS A 95 -11.470 -0.163 6.409 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.785 1.143 6.191 1.00 0.00 N ATOM 0 H LYS A 95 -14.204 -3.939 9.372 1.00 0.00 H new ATOM 0 HA LYS A 95 -12.020 -2.169 8.646 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.949 -2.277 8.420 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.446 -0.728 9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -13.122 -1.974 6.616 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.515 -0.919 6.491 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.256 0.956 6.890 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.477 0.229 8.281 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.804 -0.855 6.924 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.723 -0.618 5.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.092 1.047 5.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.488 1.866 5.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.296 1.429 7.063 1.00 0.00 H new ATOM 640 N ASN A 96 -13.564 -2.000 11.541 1.00 0.00 N ATOM 641 CA ASN A 96 -13.477 -1.421 12.877 1.00 0.00 C ATOM 642 C ASN A 96 -12.421 -2.150 13.704 1.00 0.00 C ATOM 643 O ASN A 96 -12.292 -1.913 14.903 1.00 0.00 O ATOM 644 CB ASN A 96 -14.828 -1.492 13.596 1.00 0.00 C ATOM 645 CG ASN A 96 -15.118 -2.923 14.034 1.00 0.00 C ATOM 646 OD1 ASN A 96 -14.672 -3.866 13.394 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.833 -3.136 15.102 1.00 0.00 N ATOM 0 H ASN A 96 -14.282 -2.716 11.431 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.193 -0.374 12.769 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -14.821 -0.833 14.464 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.619 -1.139 12.934 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.022 -4.091 15.407 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -16.203 -2.348 15.633 1.00 0.00 H new ATOM 654 N MET A 97 -11.674 -3.052 13.062 1.00 0.00 N ATOM 655 CA MET A 97 -10.644 -3.815 13.758 1.00 0.00 C ATOM 656 C MET A 97 -9.696 -2.895 14.527 1.00 0.00 C ATOM 657 O MET A 97 -9.006 -3.351 15.442 1.00 0.00 O ATOM 658 CB MET A 97 -9.845 -4.643 12.750 1.00 0.00 C ATOM 659 CG MET A 97 -10.509 -6.007 12.567 1.00 0.00 C ATOM 660 SD MET A 97 -9.901 -7.147 13.831 1.00 0.00 S ATOM 661 CE MET A 97 -9.523 -8.514 12.710 1.00 0.00 C ATOM 0 H MET A 97 -11.764 -3.268 12.069 1.00 0.00 H new ATOM 0 HA MET A 97 -11.137 -4.474 14.473 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.794 -4.121 11.795 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.820 -4.770 13.099 1.00 0.00 H new ATOM 0 HG2 MET A 97 -11.592 -5.909 12.641 1.00 0.00 H new ATOM 0 HG3 MET A 97 -10.291 -6.399 11.573 1.00 0.00 H new ATOM 0 HE1 MET A 97 -10.208 -9.340 12.900 1.00 0.00 H new ATOM 0 HE2 MET A 97 -9.635 -8.180 11.678 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.498 -8.847 12.875 1.00 0.00 H new ATOM 671 N SER A 98 -9.660 -1.608 14.152 1.00 0.00 N ATOM 672 CA SER A 98 -8.799 -0.620 14.809 1.00 0.00 C ATOM 673 C SER A 98 -7.353 -0.773 14.350 1.00 0.00 C ATOM 674 O SER A 98 -6.789 0.134 13.738 1.00 0.00 O ATOM 675 CB SER A 98 -8.887 -0.751 16.332 1.00 0.00 C ATOM 676 OG SER A 98 -10.191 -1.198 16.684 1.00 0.00 O ATOM 0 H SER A 98 -10.223 -1.227 13.391 1.00 0.00 H new ATOM 0 HA SER A 98 -9.149 0.372 14.526 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.137 -1.455 16.693 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.677 0.208 16.805 1.00 0.00 H new ATOM 0 HG SER A 98 -10.255 -1.286 17.658 1.00 0.00 H new ATOM 682 N THR A 99 -6.772 -1.924 14.629 1.00 0.00 N ATOM 683 CA THR A 99 -5.398 -2.196 14.224 1.00 0.00 C ATOM 684 C THR A 99 -5.284 -2.248 12.695 1.00 0.00 C ATOM 685 O THR A 99 -4.187 -2.271 12.143 1.00 0.00 O ATOM 686 CB THR A 99 -4.945 -3.524 14.823 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.072 -3.471 16.236 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.486 -3.787 14.445 1.00 0.00 C ATOM 0 H THR A 99 -7.225 -2.687 15.133 1.00 0.00 H new ATOM 0 HA THR A 99 -4.759 -1.392 14.589 1.00 0.00 H new ATOM 0 HB THR A 99 -5.566 -4.330 14.433 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.783 -4.324 16.623 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.164 -4.736 14.874 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.393 -3.829 13.360 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.859 -2.983 14.832 1.00 0.00 H new ATOM 696 N VAL A 100 -6.432 -2.291 12.022 1.00 0.00 N ATOM 697 CA VAL A 100 -6.470 -2.351 10.565 1.00 0.00 C ATOM 698 C VAL A 100 -6.246 -0.979 9.940 1.00 0.00 C ATOM 699 O VAL A 100 -6.766 0.027 10.417 1.00 0.00 O ATOM 700 CB VAL A 100 -7.832 -2.885 10.092 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.960 -1.984 10.615 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.869 -2.909 8.555 1.00 0.00 C ATOM 0 H VAL A 100 -7.350 -2.285 12.466 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.669 -3.019 10.249 1.00 0.00 H new ATOM 0 HB VAL A 100 -7.972 -3.895 10.478 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.921 -2.370 10.275 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.939 -1.971 11.705 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.821 -0.971 10.237 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.835 -3.288 8.220 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.722 -1.899 8.172 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.076 -3.557 8.182 1.00 0.00 H new ATOM 712 N LYS A 101 -5.475 -0.957 8.861 1.00 0.00 N ATOM 713 CA LYS A 101 -5.193 0.289 8.162 1.00 0.00 C ATOM 714 C LYS A 101 -6.157 0.469 6.990 1.00 0.00 C ATOM 715 O LYS A 101 -6.688 1.557 6.772 1.00 0.00 O ATOM 716 CB LYS A 101 -3.751 0.297 7.665 1.00 0.00 C ATOM 717 CG LYS A 101 -3.501 1.567 6.851 1.00 0.00 C ATOM 718 CD LYS A 101 -1.995 1.756 6.662 1.00 0.00 C ATOM 719 CE LYS A 101 -1.452 0.667 5.731 1.00 0.00 C ATOM 720 NZ LYS A 101 0.030 0.802 5.607 1.00 0.00 N ATOM 0 H LYS A 101 -5.036 -1.782 8.453 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.330 1.118 8.856 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.063 0.252 8.510 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.561 -0.584 7.052 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.995 1.495 5.882 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.926 2.430 7.362 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.792 2.741 6.243 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.489 1.710 7.626 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.705 -0.318 6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.918 0.750 4.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.394 0.061 4.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.262 1.737 5.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.467 0.702 6.545 1.00 0.00 H new ATOM 734 N SER A 102 -6.386 -0.610 6.241 1.00 0.00 N ATOM 735 CA SER A 102 -7.294 -0.560 5.100 1.00 0.00 C ATOM 736 C SER A 102 -7.788 -1.959 4.753 1.00 0.00 C ATOM 737 O SER A 102 -7.116 -2.951 5.031 1.00 0.00 O ATOM 738 CB SER A 102 -6.575 0.045 3.895 1.00 0.00 C ATOM 739 OG SER A 102 -5.531 -0.829 3.484 1.00 0.00 O ATOM 0 H SER A 102 -5.958 -1.521 6.404 1.00 0.00 H new ATOM 0 HA SER A 102 -8.151 0.061 5.361 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.279 0.200 3.077 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.167 1.022 4.153 1.00 0.00 H new ATOM 0 HG SER A 102 -5.069 -0.445 2.710 1.00 0.00 H new ATOM 745 N VAL A 103 -8.962 -2.029 4.137 1.00 0.00 N ATOM 746 CA VAL A 103 -9.533 -3.316 3.749 1.00 0.00 C ATOM 747 C VAL A 103 -10.089 -3.255 2.327 1.00 0.00 C ATOM 748 O VAL A 103 -10.873 -2.365 1.998 1.00 0.00 O ATOM 749 CB VAL A 103 -10.651 -3.707 4.716 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.208 -5.078 4.325 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.108 -3.744 6.147 1.00 0.00 C ATOM 0 H VAL A 103 -9.534 -1.219 3.897 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.741 -4.064 3.786 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.452 -2.970 4.664 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -12.005 -5.357 5.014 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.604 -5.034 3.311 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.412 -5.821 4.371 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.908 -4.023 6.833 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.303 -4.476 6.212 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.726 -2.759 6.417 1.00 0.00 H new ATOM 761 N THR A 104 -9.675 -4.200 1.492 1.00 0.00 N ATOM 762 CA THR A 104 -10.126 -4.248 0.108 1.00 0.00 C ATOM 763 C THR A 104 -10.685 -5.620 -0.236 1.00 0.00 C ATOM 764 O THR A 104 -10.089 -6.632 0.079 1.00 0.00 O ATOM 765 CB THR A 104 -8.961 -3.937 -0.826 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.494 -2.618 -0.580 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.423 -4.067 -2.276 1.00 0.00 C ATOM 0 H THR A 104 -9.027 -4.944 1.750 1.00 0.00 H new ATOM 0 HA THR A 104 -10.914 -3.505 -0.017 1.00 0.00 H new ATOM 0 HB THR A 104 -8.149 -4.641 -0.646 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.744 -2.419 -1.179 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.591 -3.845 -2.944 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.772 -5.084 -2.457 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.236 -3.365 -2.463 1.00 0.00 H new ATOM 775 N PHE A 105 -11.826 -5.646 -0.893 1.00 0.00 N ATOM 776 CA PHE A 105 -12.443 -6.906 -1.277 1.00 0.00 C ATOM 777 C PHE A 105 -11.760 -7.460 -2.521 1.00 0.00 C ATOM 778 O PHE A 105 -11.721 -6.814 -3.569 1.00 0.00 O ATOM 779 CB PHE A 105 -13.922 -6.676 -1.591 1.00 0.00 C ATOM 780 CG PHE A 105 -14.602 -8.001 -1.850 1.00 0.00 C ATOM 781 CD1 PHE A 105 -15.311 -8.626 -0.824 1.00 0.00 C ATOM 782 CD2 PHE A 105 -14.519 -8.604 -3.113 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.950 -9.844 -1.054 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.156 -9.829 -3.345 1.00 0.00 C ATOM 785 CZ PHE A 105 -15.870 -10.449 -2.311 1.00 0.00 C ATOM 0 H PHE A 105 -12.346 -4.814 -1.173 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.340 -7.614 -0.455 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.405 -6.166 -0.758 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.022 -6.029 -2.462 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -15.365 -8.165 0.151 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.964 -8.124 -3.906 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -16.507 -10.320 -0.260 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -15.097 -10.295 -4.318 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.359 -11.396 -2.486 1.00 0.00 H new ATOM 795 N SER A 106 -11.230 -8.661 -2.398 1.00 0.00 N ATOM 796 CA SER A 106 -10.550 -9.309 -3.514 1.00 0.00 C ATOM 797 C SER A 106 -11.289 -10.573 -3.951 1.00 0.00 C ATOM 798 O SER A 106 -11.501 -11.483 -3.157 1.00 0.00 O ATOM 799 CB SER A 106 -9.126 -9.678 -3.106 1.00 0.00 C ATOM 800 OG SER A 106 -8.501 -10.385 -4.170 1.00 0.00 O ATOM 0 H SER A 106 -11.254 -9.211 -1.540 1.00 0.00 H new ATOM 0 HA SER A 106 -10.531 -8.609 -4.350 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.558 -8.778 -2.869 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.141 -10.292 -2.205 1.00 0.00 H new ATOM 0 HG SER A 106 -7.586 -10.622 -3.912 1.00 0.00 H new ATOM 806 N SER A 107 -11.670 -10.622 -5.223 1.00 0.00 N ATOM 807 CA SER A 107 -12.382 -11.780 -5.760 1.00 0.00 C ATOM 808 C SER A 107 -11.461 -13.000 -5.799 1.00 0.00 C ATOM 809 O SER A 107 -10.240 -12.873 -5.698 1.00 0.00 O ATOM 810 CB SER A 107 -12.906 -11.478 -7.163 1.00 0.00 C ATOM 811 OG SER A 107 -13.636 -12.600 -7.642 1.00 0.00 O ATOM 0 H SER A 107 -11.500 -9.878 -5.900 1.00 0.00 H new ATOM 0 HA SER A 107 -13.227 -11.998 -5.107 1.00 0.00 H new ATOM 0 HB2 SER A 107 -13.545 -10.595 -7.143 1.00 0.00 H new ATOM 0 HB3 SER A 107 -12.076 -11.256 -7.834 1.00 0.00 H new ATOM 0 HG SER A 107 -13.975 -12.410 -8.541 1.00 0.00 H new ATOM 817 N LYS A 108 -12.054 -14.180 -5.931 1.00 0.00 N ATOM 818 CA LYS A 108 -11.289 -15.420 -5.974 1.00 0.00 C ATOM 819 C LYS A 108 -10.405 -15.465 -7.214 1.00 0.00 C ATOM 820 O LYS A 108 -9.305 -16.012 -7.189 1.00 0.00 O ATOM 821 CB LYS A 108 -12.249 -16.618 -5.975 1.00 0.00 C ATOM 822 CG LYS A 108 -13.082 -16.617 -7.264 1.00 0.00 C ATOM 823 CD LYS A 108 -14.077 -17.780 -7.236 1.00 0.00 C ATOM 824 CE LYS A 108 -14.925 -17.755 -8.511 1.00 0.00 C ATOM 825 NZ LYS A 108 -15.893 -18.890 -8.490 1.00 0.00 N ATOM 0 H LYS A 108 -13.063 -14.305 -6.010 1.00 0.00 H new ATOM 0 HA LYS A 108 -10.649 -15.466 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -11.685 -17.547 -5.897 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -12.906 -16.570 -5.107 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -13.615 -15.672 -7.363 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -12.428 -16.706 -8.131 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -13.544 -18.728 -7.159 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -14.718 -17.703 -6.358 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -15.460 -16.808 -8.585 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -14.283 -17.828 -9.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -16.468 -18.872 -9.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -15.373 -19.789 -8.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -16.514 -18.801 -7.660 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.449 -18.586 -2.813 1.00 0.00 N ATOM 1238 CA TYR A 134 -12.709 -17.865 -2.676 1.00 0.00 C ATOM 1239 C TYR A 134 -12.450 -16.395 -2.377 1.00 0.00 C ATOM 1240 O TYR A 134 -11.310 -15.996 -2.148 1.00 0.00 O ATOM 1241 CB TYR A 134 -13.561 -18.474 -1.562 1.00 0.00 C ATOM 1242 CG TYR A 134 -12.879 -19.706 -1.029 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.146 -19.637 0.160 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -12.979 -20.915 -1.724 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -11.510 -20.779 0.655 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -12.345 -22.057 -1.229 1.00 0.00 C ATOM 1247 CZ TYR A 134 -11.609 -21.990 -0.039 1.00 0.00 C ATOM 1248 OH TYR A 134 -10.980 -23.118 0.449 1.00 0.00 O ATOM 0 HA TYR A 134 -13.250 -17.948 -3.619 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.705 -17.749 -0.761 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.550 -18.728 -1.943 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.071 -18.702 0.695 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -13.546 -20.966 -2.642 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -10.943 -20.727 1.572 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -12.422 -22.992 -1.764 1.00 0.00 H new ATOM 0 HH TYR A 134 -11.150 -23.873 -0.152 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.516 -15.607 -2.358 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.396 -14.187 -2.070 1.00 0.00 C ATOM 1260 C ASP A 135 -12.616 -13.984 -0.778 1.00 0.00 C ATOM 1261 O ASP A 135 -12.782 -14.731 0.181 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.791 -13.562 -1.960 1.00 0.00 C ATOM 1263 CG ASP A 135 -14.955 -12.813 -0.648 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -14.184 -11.895 -0.392 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -15.870 -13.158 0.071 1.00 0.00 O ATOM 0 H ASP A 135 -14.468 -15.926 -2.538 1.00 0.00 H new ATOM 0 HA ASP A 135 -12.856 -13.698 -2.881 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.954 -12.880 -2.794 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -15.549 -14.342 -2.034 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.758 -12.971 -0.764 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.958 -12.687 0.409 1.00 0.00 C ATOM 1272 C ALA A 136 -10.807 -11.183 0.608 1.00 0.00 C ATOM 1273 O ALA A 136 -10.826 -10.415 -0.346 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.571 -13.329 0.267 1.00 0.00 C ATOM 0 H ALA A 136 -11.603 -12.339 -1.549 1.00 0.00 H new ATOM 0 HA ALA A 136 -11.465 -13.106 1.278 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.976 -13.110 1.154 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.679 -14.408 0.160 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.072 -12.925 -0.614 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.644 -10.780 1.855 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.472 -9.371 2.185 1.00 0.00 C ATOM 1282 C TYR A 137 -8.998 -9.049 2.383 1.00 0.00 C ATOM 1283 O TYR A 137 -8.348 -9.594 3.273 1.00 0.00 O ATOM 1284 CB TYR A 137 -11.217 -9.022 3.483 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.647 -8.668 3.179 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.685 -9.436 3.703 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.930 -7.564 2.368 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -15.008 -9.104 3.421 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -14.253 -7.231 2.081 1.00 0.00 C ATOM 1290 CZ TYR A 137 -15.296 -8.002 2.606 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.606 -7.682 2.318 1.00 0.00 O ATOM 0 H TYR A 137 -10.627 -11.407 2.659 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.876 -8.787 1.358 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.182 -9.867 4.170 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.725 -8.186 3.980 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.464 -10.289 4.328 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -12.124 -6.970 1.964 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.812 -9.697 3.831 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -14.473 -6.379 1.454 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.630 -6.890 1.741 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.493 -8.131 1.580 1.00 0.00 N ATOM 1302 CA ILE A 138 -7.110 -7.712 1.691 1.00 0.00 C ATOM 1303 C ILE A 138 -7.014 -6.663 2.804 1.00 0.00 C ATOM 1304 O ILE A 138 -7.343 -5.493 2.606 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.635 -7.100 0.367 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.843 -8.108 -0.772 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -5.159 -6.721 0.469 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.398 -7.494 -2.104 1.00 0.00 C ATOM 0 H ILE A 138 -9.021 -7.662 0.844 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.480 -8.571 1.922 1.00 0.00 H new ATOM 0 HB ILE A 138 -7.215 -6.201 0.158 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -6.274 -9.016 -0.573 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.893 -8.395 -0.827 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.829 -6.287 -0.475 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -5.025 -5.994 1.270 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.569 -7.612 0.685 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.549 -8.216 -2.906 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.986 -6.599 -2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.342 -7.230 -2.048 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.576 -7.098 3.973 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.448 -6.223 5.115 1.00 0.00 C ATOM 1322 C VAL A 139 -5.002 -5.814 5.314 1.00 0.00 C ATOM 1323 O VAL A 139 -4.103 -6.650 5.321 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.955 -6.930 6.375 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.654 -6.061 7.593 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.470 -7.155 6.262 1.00 0.00 C ATOM 0 H VAL A 139 -6.301 -8.064 4.152 1.00 0.00 H new ATOM 0 HA VAL A 139 -7.046 -5.330 4.932 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.456 -7.893 6.482 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -7.013 -6.560 8.493 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.578 -5.903 7.670 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.155 -5.099 7.487 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.831 -7.658 7.159 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.974 -6.194 6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.682 -7.773 5.389 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.792 -4.523 5.481 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.451 -4.006 5.688 1.00 0.00 C ATOM 1338 C GLU A 140 -3.213 -3.757 7.168 1.00 0.00 C ATOM 1339 O GLU A 140 -3.754 -2.817 7.747 1.00 0.00 O ATOM 1340 CB GLU A 140 -3.260 -2.705 4.909 1.00 0.00 C ATOM 1341 CG GLU A 140 -3.535 -2.950 3.423 1.00 0.00 C ATOM 1342 CD GLU A 140 -2.524 -3.942 2.861 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -1.447 -4.047 3.423 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -2.844 -4.584 1.875 1.00 0.00 O ATOM 0 H GLU A 140 -5.527 -3.816 5.478 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.733 -4.743 5.328 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.933 -1.938 5.292 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.244 -2.334 5.045 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.546 -3.335 3.291 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.477 -2.010 2.874 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.396 -4.602 7.778 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.094 -4.461 9.193 1.00 0.00 C ATOM 1353 C ALA A 141 -1.296 -3.189 9.442 1.00 0.00 C ATOM 1354 O ALA A 141 -0.486 -2.778 8.611 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.295 -5.673 9.679 1.00 0.00 C ATOM 0 H ALA A 141 -1.934 -5.387 7.319 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.033 -4.402 9.744 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.072 -5.560 10.740 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.880 -6.580 9.525 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.363 -5.743 9.118 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.526 -2.570 10.593 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.814 -1.347 10.935 1.00 0.00 C ATOM 1363 C ASN A 142 0.689 -1.596 10.923 1.00 0.00 C ATOM 1364 O ASN A 142 1.462 -0.734 10.502 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.252 -0.854 12.317 1.00 0.00 C ATOM 1366 CG ASN A 142 -2.571 -0.102 12.221 1.00 0.00 C ATOM 1367 OD1 ASN A 142 -3.018 0.239 11.126 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -3.224 0.179 13.314 1.00 0.00 N ATOM 0 H ASN A 142 -2.191 -2.890 11.297 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.051 -0.583 10.195 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -1.358 -1.701 12.995 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -0.485 -0.203 12.737 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -4.109 0.683 13.264 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.850 -0.106 14.219 1.00 0.00 H new ATOM 1375 N ALA A 143 1.101 -2.778 11.368 1.00 0.00 N ATOM 1376 CA ALA A 143 2.517 -3.118 11.380 1.00 0.00 C ATOM 1377 C ALA A 143 2.732 -4.569 10.950 1.00 0.00 C ATOM 1378 O ALA A 143 1.813 -5.384 11.026 1.00 0.00 O ATOM 1379 CB ALA A 143 3.098 -2.910 12.774 1.00 0.00 C ATOM 0 H ALA A 143 0.482 -3.508 11.721 1.00 0.00 H new ATOM 0 HA ALA A 143 3.027 -2.463 10.673 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.157 -3.168 12.769 1.00 0.00 H new ATOM 0 HB2 ALA A 143 2.980 -1.866 13.065 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.573 -3.547 13.486 1.00 0.00 H new ATOM 1385 N PRO A 144 3.921 -4.908 10.511 1.00 0.00 N ATOM 1386 CA PRO A 144 4.249 -6.300 10.072 1.00 0.00 C ATOM 1387 C PRO A 144 4.006 -7.324 11.182 1.00 0.00 C ATOM 1388 O PRO A 144 3.729 -8.487 10.910 1.00 0.00 O ATOM 1389 CB PRO A 144 5.741 -6.235 9.722 1.00 0.00 C ATOM 1390 CG PRO A 144 6.024 -4.794 9.461 1.00 0.00 C ATOM 1391 CD PRO A 144 5.085 -4.011 10.377 1.00 0.00 C ATOM 0 HA PRO A 144 3.623 -6.620 9.239 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.353 -6.614 10.540 1.00 0.00 H new ATOM 0 HB3 PRO A 144 5.966 -6.844 8.847 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.066 -4.556 9.674 1.00 0.00 H new ATOM 0 HG3 PRO A 144 5.847 -4.544 8.415 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.546 -3.802 11.342 1.00 0.00 H new ATOM 0 HD3 PRO A 144 4.806 -3.051 9.942 1.00 0.00 H new ATOM 1399 N ASN A 145 4.124 -6.880 12.430 1.00 0.00 N ATOM 1400 CA ASN A 145 3.913 -7.766 13.574 1.00 0.00 C ATOM 1401 C ASN A 145 2.434 -7.833 13.957 1.00 0.00 C ATOM 1402 O ASN A 145 2.046 -8.606 14.833 1.00 0.00 O ATOM 1403 CB ASN A 145 4.728 -7.268 14.765 1.00 0.00 C ATOM 1404 CG ASN A 145 6.086 -7.958 14.791 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.353 -8.775 15.674 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.960 -7.694 13.858 1.00 0.00 N ATOM 0 H ASN A 145 4.363 -5.919 12.676 1.00 0.00 H new ATOM 0 HA ASN A 145 4.239 -8.768 13.294 1.00 0.00 H new ATOM 0 HB2 ASN A 145 4.861 -6.188 14.700 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.191 -7.468 15.693 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.865 -8.164 13.859 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.738 -7.018 13.128 1.00 0.00 H new ATOM 1413 N ASP A 146 1.614 -7.023 13.299 1.00 0.00 N ATOM 1414 CA ASP A 146 0.185 -6.988 13.557 1.00 0.00 C ATOM 1415 C ASP A 146 -0.554 -7.879 12.570 1.00 0.00 C ATOM 1416 O ASP A 146 -1.713 -8.195 12.768 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.329 -5.555 13.403 1.00 0.00 C ATOM 1418 CG ASP A 146 0.210 -4.675 14.525 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.724 -5.222 15.488 1.00 0.00 O ATOM 1420 OD2 ASP A 146 0.103 -3.468 14.402 1.00 0.00 O ATOM 0 H ASP A 146 1.922 -6.375 12.574 1.00 0.00 H new ATOM 0 HA ASP A 146 0.008 -7.345 14.571 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.022 -5.153 12.437 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.419 -5.549 13.419 1.00 0.00 H new ATOM 1425 N VAL A 147 0.123 -8.274 11.504 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.497 -9.117 10.491 1.00 0.00 C ATOM 1427 C VAL A 147 -0.885 -10.443 11.119 1.00 0.00 C ATOM 1428 O VAL A 147 -1.887 -11.050 10.750 1.00 0.00 O ATOM 1429 CB VAL A 147 0.476 -9.362 9.336 1.00 0.00 C ATOM 1430 CG1 VAL A 147 0.976 -8.027 8.785 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.667 -10.206 9.822 1.00 0.00 C ATOM 0 H VAL A 147 1.095 -8.027 11.317 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.383 -8.617 10.101 1.00 0.00 H new ATOM 0 HB VAL A 147 -0.043 -9.903 8.544 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.668 -8.209 7.963 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.130 -7.443 8.424 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.487 -7.476 9.575 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.355 -10.376 8.994 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.186 -9.677 10.622 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.306 -11.164 10.196 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.090 -10.874 12.092 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.360 -12.127 12.790 1.00 0.00 C ATOM 1443 C LYS A 148 -1.513 -11.943 13.767 1.00 0.00 C ATOM 1444 O LYS A 148 -2.349 -12.833 13.929 1.00 0.00 O ATOM 1445 CB LYS A 148 0.909 -12.595 13.523 1.00 0.00 C ATOM 1446 CG LYS A 148 0.559 -13.434 14.764 1.00 0.00 C ATOM 1447 CD LYS A 148 0.527 -12.524 15.998 1.00 0.00 C ATOM 1448 CE LYS A 148 -0.578 -12.989 16.956 1.00 0.00 C ATOM 1449 NZ LYS A 148 -0.662 -12.048 18.112 1.00 0.00 N ATOM 0 H LYS A 148 0.741 -10.379 12.414 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.646 -12.890 12.066 1.00 0.00 H new ATOM 0 HB2 LYS A 148 1.527 -13.184 12.845 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.500 -11.729 13.821 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -0.409 -13.918 14.629 1.00 0.00 H new ATOM 0 HG3 LYS A 148 1.295 -14.226 14.901 1.00 0.00 H new ATOM 0 HD2 LYS A 148 1.493 -12.546 16.503 1.00 0.00 H new ATOM 0 HD3 LYS A 148 0.349 -11.492 15.696 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -1.534 -13.027 16.434 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -0.367 -13.998 17.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -1.454 -12.323 18.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 0.225 -12.084 18.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -0.815 -11.081 17.762 1.00 0.00 H new ATOM 1463 N THR A 149 -1.558 -10.785 14.406 1.00 0.00 N ATOM 1464 CA THR A 149 -2.612 -10.494 15.367 1.00 0.00 C ATOM 1465 C THR A 149 -3.946 -10.322 14.657 1.00 0.00 C ATOM 1466 O THR A 149 -4.980 -10.786 15.127 1.00 0.00 O ATOM 1467 CB THR A 149 -2.264 -9.232 16.154 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.036 -9.430 16.841 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.368 -8.942 17.169 1.00 0.00 C ATOM 0 H THR A 149 -0.880 -10.033 14.278 1.00 0.00 H new ATOM 0 HA THR A 149 -2.697 -11.331 16.060 1.00 0.00 H new ATOM 0 HB THR A 149 -2.170 -8.390 15.468 1.00 0.00 H new ATOM 0 HG1 THR A 149 -0.809 -8.621 17.346 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.119 -8.041 17.730 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.313 -8.794 16.646 1.00 0.00 H new ATOM 0 HG23 THR A 149 -3.461 -9.783 17.856 1.00 0.00 H new ATOM 1477 N ILE A 150 -3.910 -9.654 13.517 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.113 -9.423 12.737 1.00 0.00 C ATOM 1479 C ILE A 150 -5.638 -10.728 12.174 1.00 0.00 C ATOM 1480 O ILE A 150 -6.843 -10.957 12.128 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.819 -8.441 11.608 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.504 -7.057 12.202 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -6.024 -8.348 10.674 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.723 -6.462 12.931 1.00 0.00 C ATOM 0 H ILE A 150 -3.060 -9.262 13.111 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.877 -8.997 13.388 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.959 -8.791 11.038 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.669 -7.140 12.897 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -4.190 -6.382 11.406 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.808 -7.645 9.870 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.233 -9.330 10.251 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.893 -8.002 11.234 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.463 -5.485 13.337 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.550 -6.355 12.229 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.020 -7.125 13.743 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.730 -11.578 11.736 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.125 -12.852 11.173 1.00 0.00 C ATOM 1498 C ALA A 151 -5.815 -13.697 12.226 1.00 0.00 C ATOM 1499 O ALA A 151 -6.823 -14.348 11.957 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.903 -13.592 10.632 1.00 0.00 C ATOM 0 H ALA A 151 -3.724 -11.411 11.759 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.820 -12.670 10.353 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.214 -14.548 10.211 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.428 -12.992 9.856 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.194 -13.765 11.442 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.268 -13.675 13.430 1.00 0.00 N ATOM 1507 CA GLU A 152 -5.852 -14.455 14.519 1.00 0.00 C ATOM 1508 C GLU A 152 -7.205 -13.891 14.924 1.00 0.00 C ATOM 1509 O GLU A 152 -8.142 -14.636 15.208 1.00 0.00 O ATOM 1510 CB GLU A 152 -4.913 -14.479 15.725 1.00 0.00 C ATOM 1511 CG GLU A 152 -3.685 -15.330 15.395 1.00 0.00 C ATOM 1512 CD GLU A 152 -2.699 -15.295 16.555 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -2.932 -14.541 17.485 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -1.723 -16.024 16.496 1.00 0.00 O ATOM 0 H GLU A 152 -4.437 -13.139 13.680 1.00 0.00 H new ATOM 0 HA GLU A 152 -5.995 -15.475 14.163 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -4.608 -13.465 15.983 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.429 -14.887 16.594 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -3.988 -16.358 15.195 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -3.207 -14.957 14.489 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.297 -12.569 14.945 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.542 -11.909 15.315 1.00 0.00 C ATOM 1523 C ASP A 153 -9.603 -12.099 14.236 1.00 0.00 C ATOM 1524 O ASP A 153 -10.783 -12.280 14.533 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.291 -10.420 15.545 1.00 0.00 C ATOM 1526 CG ASP A 153 -7.508 -10.218 16.838 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.403 -11.165 17.598 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -7.025 -9.117 17.050 1.00 0.00 O ATOM 0 H ASP A 153 -6.532 -11.936 14.712 1.00 0.00 H new ATOM 0 HA ASP A 153 -8.909 -12.360 16.237 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.736 -10.002 14.705 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.240 -9.886 15.597 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.172 -12.057 12.981 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.090 -12.224 11.860 1.00 0.00 C ATOM 1535 C ALA A 154 -10.643 -13.646 11.824 1.00 0.00 C ATOM 1536 O ALA A 154 -11.752 -13.878 11.352 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.389 -11.897 10.541 1.00 0.00 C ATOM 0 H ALA A 154 -8.199 -11.910 12.714 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.922 -11.532 11.995 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.089 -12.027 9.715 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -9.039 -10.865 10.561 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.539 -12.566 10.405 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.866 -14.590 12.342 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.294 -15.986 12.380 1.00 0.00 C ATOM 1545 C LYS A 155 -11.551 -16.143 13.222 1.00 0.00 C ATOM 1546 O LYS A 155 -12.287 -17.120 13.077 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.183 -16.872 12.946 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.177 -17.209 11.845 1.00 0.00 C ATOM 1549 CD LYS A 155 -6.971 -17.919 12.460 1.00 0.00 C ATOM 1550 CE LYS A 155 -6.283 -18.775 11.396 1.00 0.00 C ATOM 1551 NZ LYS A 155 -7.069 -20.024 11.185 1.00 0.00 N ATOM 0 H LYS A 155 -8.942 -14.418 12.739 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.514 -16.297 11.359 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.680 -16.360 13.767 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.609 -17.788 13.355 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.643 -17.846 11.093 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.857 -16.299 11.338 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -6.270 -17.187 12.861 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -7.290 -18.544 13.294 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.203 -18.220 10.462 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -5.268 -19.019 11.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -6.474 -20.733 10.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -7.384 -20.396 12.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -7.899 -19.816 10.593 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.800 -15.176 14.097 1.00 0.00 N ATOM 1566 CA LYS A 156 -12.986 -15.227 14.947 1.00 0.00 C ATOM 1567 C LYS A 156 -14.191 -14.610 14.232 1.00 0.00 C ATOM 1568 O LYS A 156 -15.319 -14.693 14.719 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.725 -14.480 16.261 1.00 0.00 C ATOM 1570 CG LYS A 156 -13.394 -13.101 16.226 1.00 0.00 C ATOM 1571 CD LYS A 156 -12.933 -12.277 17.430 1.00 0.00 C ATOM 1572 CE LYS A 156 -11.868 -11.272 16.992 1.00 0.00 C ATOM 1573 NZ LYS A 156 -11.663 -10.266 18.075 1.00 0.00 N ATOM 0 H LYS A 156 -11.207 -14.358 14.237 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.207 -16.272 15.165 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -13.111 -15.059 17.100 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -11.652 -14.368 16.418 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -13.139 -12.585 15.300 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -14.478 -13.211 16.241 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -13.781 -11.753 17.870 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -12.530 -12.935 18.200 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -10.932 -11.787 16.777 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -12.177 -10.775 16.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -10.939 -9.581 17.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -12.557 -9.767 18.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -11.350 -10.748 18.942 1.00 0.00 H new ATOM 1587 N ILE A 157 -13.945 -13.981 13.085 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.009 -13.338 12.325 1.00 0.00 C ATOM 1589 C ILE A 157 -15.874 -14.376 11.619 1.00 0.00 C ATOM 1590 O ILE A 157 -15.366 -15.275 10.940 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.401 -12.399 11.285 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.494 -11.364 11.966 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.521 -11.680 10.530 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -14.333 -10.293 12.659 1.00 0.00 C ATOM 0 H ILE A 157 -13.019 -13.904 12.664 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.633 -12.773 13.018 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.804 -12.985 10.586 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -12.851 -11.858 12.694 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -12.841 -10.901 11.226 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.087 -11.010 9.788 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.153 -12.414 10.031 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.122 -11.103 11.233 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -13.675 -9.567 13.137 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -14.957 -9.787 11.923 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -14.967 -10.759 13.413 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.184 -14.252 11.779 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.106 -15.188 11.157 1.00 0.00 C ATOM 1608 C GLU A 158 -18.048 -15.057 9.640 1.00 0.00 C ATOM 1609 O GLU A 158 -17.984 -13.953 9.100 1.00 0.00 O ATOM 1610 CB GLU A 158 -19.525 -14.904 11.649 1.00 0.00 C ATOM 1611 CG GLU A 158 -19.544 -14.986 13.174 1.00 0.00 C ATOM 1612 CD GLU A 158 -20.947 -14.694 13.692 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -21.605 -13.851 13.108 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -21.341 -15.320 14.661 1.00 0.00 O ATOM 0 H GLU A 158 -17.629 -13.518 12.330 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.822 -16.204 11.430 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.848 -13.916 11.320 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -20.223 -15.625 11.224 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -19.227 -15.977 13.497 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.836 -14.272 13.594 1.00 0.00 H new ATOM 1621 N GLY A 159 -18.077 -16.195 8.962 1.00 0.00 N ATOM 1622 CA GLY A 159 -18.027 -16.212 7.507 1.00 0.00 C ATOM 1623 C GLY A 159 -16.601 -16.405 6.999 1.00 0.00 C ATOM 1624 O GLY A 159 -16.391 -16.723 5.833 1.00 0.00 O ATOM 0 H GLY A 159 -18.135 -17.117 9.395 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.661 -17.014 7.129 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.430 -15.277 7.117 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.621 -16.238 7.876 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.231 -16.418 7.480 1.00 0.00 C ATOM 1630 C VAL A 160 -13.895 -17.894 7.334 1.00 0.00 C ATOM 1631 O VAL A 160 -14.129 -18.687 8.248 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.306 -15.781 8.513 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -11.861 -16.199 8.240 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -13.419 -14.261 8.405 1.00 0.00 C ATOM 0 H VAL A 160 -15.759 -15.982 8.854 1.00 0.00 H new ATOM 0 HA VAL A 160 -14.087 -15.932 6.515 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.592 -16.109 9.512 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -11.204 -15.742 8.980 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -11.778 -17.284 8.302 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -11.569 -15.869 7.243 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -12.762 -13.794 9.139 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -13.127 -13.945 7.404 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -14.449 -13.958 8.595 1.00 0.00 H new ATOM 1644 N SER A 161 -13.343 -18.260 6.182 1.00 0.00 N ATOM 1645 CA SER A 161 -12.972 -19.645 5.932 1.00 0.00 C ATOM 1646 C SER A 161 -11.504 -19.885 6.260 1.00 0.00 C ATOM 1647 O SER A 161 -11.126 -20.977 6.690 1.00 0.00 O ATOM 1648 CB SER A 161 -13.226 -19.994 4.463 1.00 0.00 C ATOM 1649 OG SER A 161 -12.421 -19.167 3.637 1.00 0.00 O ATOM 0 H SER A 161 -13.144 -17.621 5.412 1.00 0.00 H new ATOM 0 HA SER A 161 -13.581 -20.280 6.574 1.00 0.00 H new ATOM 0 HB2 SER A 161 -12.995 -21.044 4.282 1.00 0.00 H new ATOM 0 HB3 SER A 161 -14.279 -19.853 4.221 1.00 0.00 H new ATOM 0 HG SER A 161 -12.320 -19.584 2.756 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.673 -18.863 6.055 1.00 0.00 N ATOM 1656 CA GLU A 162 -9.247 -19.001 6.340 1.00 0.00 C ATOM 1657 C GLU A 162 -8.562 -17.654 6.243 1.00 0.00 C ATOM 1658 O GLU A 162 -9.083 -16.742 5.643 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.614 -19.984 5.353 1.00 0.00 C ATOM 1660 CG GLU A 162 -7.199 -20.326 5.815 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.638 -21.481 4.994 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -7.316 -21.914 4.079 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.538 -21.917 5.297 1.00 0.00 O ATOM 0 H GLU A 162 -10.955 -17.949 5.700 1.00 0.00 H new ATOM 0 HA GLU A 162 -9.124 -19.384 7.353 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.216 -20.890 5.288 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.587 -19.547 4.355 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.555 -19.452 5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -7.209 -20.593 6.872 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.397 -17.537 6.844 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.662 -16.278 6.799 1.00 0.00 C ATOM 1672 C VAL A 163 -5.193 -16.533 6.467 1.00 0.00 C ATOM 1673 O VAL A 163 -4.567 -17.431 7.029 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.773 -15.548 8.134 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -6.188 -14.130 8.001 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -8.245 -15.486 8.558 1.00 0.00 C ATOM 0 H VAL A 163 -6.938 -18.284 7.365 1.00 0.00 H new ATOM 0 HA VAL A 163 -7.098 -15.653 6.019 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.208 -16.085 8.896 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.269 -13.612 8.957 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -5.139 -14.195 7.711 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.741 -13.578 7.241 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.327 -14.965 9.512 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.819 -14.951 7.802 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -8.636 -16.498 8.663 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.649 -15.738 5.551 1.00 0.00 N ATOM 1687 CA GLN A 164 -3.256 -15.883 5.151 1.00 0.00 C ATOM 1688 C GLN A 164 -2.550 -14.532 5.154 1.00 0.00 C ATOM 1689 O GLN A 164 -2.984 -13.596 4.489 1.00 0.00 O ATOM 1690 CB GLN A 164 -3.178 -16.503 3.754 1.00 0.00 C ATOM 1691 CG GLN A 164 -1.903 -16.033 3.057 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.607 -16.916 1.850 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -1.151 -18.050 2.005 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -1.840 -16.466 0.646 1.00 0.00 N ATOM 0 H GLN A 164 -5.151 -14.989 5.074 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.758 -16.537 5.867 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -3.185 -17.591 3.827 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -4.052 -16.217 3.168 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -2.014 -14.996 2.740 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -1.066 -16.065 3.754 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -2.218 -15.527 0.517 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -1.644 -17.053 -0.165 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.454 -14.437 5.898 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.703 -13.189 5.971 1.00 0.00 C ATOM 1705 C ASP A 165 0.177 -13.014 4.736 1.00 0.00 C ATOM 1706 O ASP A 165 0.210 -13.874 3.858 1.00 0.00 O ATOM 1707 CB ASP A 165 0.172 -13.183 7.230 1.00 0.00 C ATOM 1708 CG ASP A 165 1.232 -14.278 7.143 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.175 -15.066 6.214 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.091 -14.311 8.009 1.00 0.00 O ATOM 0 H ASP A 165 -1.069 -15.200 6.454 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.412 -12.362 6.014 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.652 -12.211 7.343 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.448 -13.337 8.113 1.00 0.00 H new ATOM 1715 N GLY A 166 0.885 -11.891 4.678 1.00 0.00 N ATOM 1716 CA GLY A 166 1.760 -11.610 3.546 1.00 0.00 C ATOM 1717 C GLY A 166 3.111 -12.291 3.727 1.00 0.00 C ATOM 1718 O GLY A 166 3.276 -13.144 4.601 1.00 0.00 O ATOM 0 H GLY A 166 0.871 -11.166 5.395 1.00 0.00 H new ATOM 0 HA2 GLY A 166 1.293 -11.957 2.624 1.00 0.00 H new ATOM 0 HA3 GLY A 166 1.900 -10.534 3.447 1.00 0.00 H new