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 63 TYR OH : rot 180:sc= -0.0901 USER MOD Set 1.2: A 164 GLN : amide:sc= -0.0267 X(o=-0.12,f=-0.59) USER MOD Single : A 89 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.12) USER MOD Single : A 91 TYR OH : rot 180:sc= -0.586 USER MOD Single : A 93 SER OG : rot 78:sc= 0.209 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -2.2 X(o=-2.2,f=-1.8!) USER MOD Single : A 97 MET CE :methyl -104:sc= -0.5 (180deg=-1.44) USER MOD Single : A 98 SER OG : rot 180:sc= 0 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 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -134:sc= -0.58 USER MOD Single : A 107 SER OG : rot 15:sc= 0.175 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 -178:sc= -0.846 USER MOD Single : A 142 ASN : amide:sc= -1.2 X(o=-1.2,f=-0.9) USER MOD Single : A 145 ASN : amide:sc= -0.5 X(o=-0.5,f=-0.92) USER MOD Single : A 148 LYS NZ :NH3+ 162:sc= -0.0107 (180deg=-0.153) 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.714 -7.334 4.717 1.00 0.00 N ATOM 32 CA ARG A 59 -0.413 -7.769 3.915 1.00 0.00 C ATOM 33 C ARG A 59 -1.037 -9.028 4.501 1.00 0.00 C ATOM 34 O ARG A 59 -0.352 -10.024 4.738 1.00 0.00 O ATOM 35 CB ARG A 59 0.070 -8.040 2.491 1.00 0.00 C ATOM 36 CG ARG A 59 -1.121 -8.069 1.537 1.00 0.00 C ATOM 37 CD ARG A 59 -1.295 -9.483 0.986 1.00 0.00 C ATOM 38 NE ARG A 59 -0.123 -9.871 0.209 1.00 0.00 N ATOM 39 CZ ARG A 59 0.101 -11.141 -0.138 1.00 0.00 C ATOM 40 NH1 ARG A 59 -0.731 -12.086 0.216 1.00 0.00 N ATOM 41 NH2 ARG A 59 1.162 -11.442 -0.838 1.00 0.00 N ATOM 0 HA ARG A 59 -1.172 -6.987 3.908 1.00 0.00 H new ATOM 0 HB2 ARG A 59 0.775 -7.268 2.183 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.602 -8.991 2.452 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -2.026 -7.756 2.058 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -0.964 -7.365 0.720 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.444 -10.185 1.807 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.186 -9.530 0.360 1.00 0.00 H new ATOM 0 HE ARG A 59 0.543 -9.153 -0.077 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.561 -11.856 0.763 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.550 -13.053 -0.055 1.00 0.00 H new ATOM 0 HH21 ARG A 59 1.814 -10.709 -1.117 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.338 -12.410 -1.106 1.00 0.00 H new ATOM 55 N VAL A 60 -2.339 -8.970 4.726 1.00 0.00 N ATOM 56 CA VAL A 60 -3.073 -10.096 5.282 1.00 0.00 C ATOM 57 C VAL A 60 -4.241 -10.454 4.371 1.00 0.00 C ATOM 58 O VAL A 60 -4.898 -9.579 3.826 1.00 0.00 O ATOM 59 CB VAL A 60 -3.605 -9.748 6.664 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.331 -10.961 7.251 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.440 -9.352 7.573 1.00 0.00 C ATOM 0 H VAL A 60 -2.913 -8.150 4.531 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.396 -10.946 5.361 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.302 -8.914 6.588 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.713 -10.713 8.241 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.161 -11.238 6.601 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.637 -11.798 7.329 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.820 -9.102 8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.741 -10.184 7.652 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.928 -8.487 7.152 1.00 0.00 H new ATOM 71 N VAL A 61 -4.479 -11.742 4.196 1.00 0.00 N ATOM 72 CA VAL A 61 -5.571 -12.194 3.336 1.00 0.00 C ATOM 73 C VAL A 61 -6.575 -13.036 4.125 1.00 0.00 C ATOM 74 O VAL A 61 -6.215 -14.045 4.735 1.00 0.00 O ATOM 75 CB VAL A 61 -5.007 -13.023 2.180 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.156 -13.518 1.300 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.061 -12.159 1.343 1.00 0.00 C ATOM 0 H VAL A 61 -3.940 -12.491 4.631 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.086 -11.316 2.945 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.460 -13.877 2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.755 -14.109 0.476 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.830 -14.135 1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.703 -12.664 0.901 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.660 -12.751 0.520 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.607 -11.304 0.943 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.241 -11.806 1.969 1.00 0.00 H new ATOM 87 N VAL A 62 -7.838 -12.625 4.091 1.00 0.00 N ATOM 88 CA VAL A 62 -8.901 -13.352 4.783 1.00 0.00 C ATOM 89 C VAL A 62 -9.876 -13.931 3.764 1.00 0.00 C ATOM 90 O VAL A 62 -10.655 -13.202 3.150 1.00 0.00 O ATOM 91 CB VAL A 62 -9.646 -12.416 5.745 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.879 -13.127 6.308 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.714 -12.041 6.898 1.00 0.00 C ATOM 0 H VAL A 62 -8.153 -11.793 3.592 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.457 -14.164 5.358 1.00 0.00 H new ATOM 0 HB VAL A 62 -9.959 -11.520 5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.404 -12.459 6.990 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.543 -13.406 5.490 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.569 -14.023 6.845 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.236 -11.376 7.586 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.409 -12.944 7.427 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.832 -11.536 6.504 1.00 0.00 H new ATOM 103 N TYR A 63 -9.830 -15.244 3.593 1.00 0.00 N ATOM 104 CA TYR A 63 -10.699 -15.923 2.660 1.00 0.00 C ATOM 105 C TYR A 63 -12.055 -16.165 3.294 1.00 0.00 C ATOM 106 O TYR A 63 -12.163 -16.384 4.501 1.00 0.00 O ATOM 107 CB TYR A 63 -10.073 -17.254 2.256 1.00 0.00 C ATOM 108 CG TYR A 63 -8.733 -17.002 1.612 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.566 -17.050 2.385 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.650 -16.729 0.244 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.320 -16.830 1.791 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.404 -16.503 -0.350 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.239 -16.556 0.422 1.00 0.00 C ATOM 114 OH TYR A 63 -5.009 -16.340 -0.166 1.00 0.00 O ATOM 0 H TYR A 63 -9.192 -15.860 4.096 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.829 -15.300 1.775 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.954 -17.893 3.131 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.729 -17.781 1.563 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.629 -17.258 3.443 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.548 -16.693 -0.355 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.421 -16.872 2.388 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.341 -16.287 -1.406 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.130 -16.164 -1.122 1.00 0.00 H new ATOM 124 N ILE A 64 -13.077 -16.107 2.468 1.00 0.00 N ATOM 125 CA ILE A 64 -14.456 -16.293 2.924 1.00 0.00 C ATOM 126 C ILE A 64 -15.053 -17.569 2.334 1.00 0.00 C ATOM 127 O ILE A 64 -14.735 -17.943 1.209 1.00 0.00 O ATOM 128 CB ILE A 64 -15.309 -15.099 2.497 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.607 -13.791 2.883 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.668 -15.152 3.207 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.411 -12.584 2.374 1.00 0.00 C ATOM 0 H ILE A 64 -12.987 -15.932 1.467 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.448 -16.374 4.011 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.450 -15.139 1.417 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.499 -13.734 3.966 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.602 -13.771 2.461 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.273 -14.299 2.900 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.182 -16.076 2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.516 -15.119 4.286 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.901 -11.663 2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.496 -12.635 1.289 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.407 -12.597 2.817 1.00 0.00 H new ATOM 143 N ARG A 65 -15.918 -18.234 3.100 1.00 0.00 N ATOM 144 CA ARG A 65 -16.553 -19.470 2.639 1.00 0.00 C ATOM 145 C ARG A 65 -17.032 -19.343 1.189 1.00 0.00 C ATOM 146 O ARG A 65 -17.547 -18.306 0.772 1.00 0.00 O ATOM 147 CB ARG A 65 -17.757 -19.806 3.526 1.00 0.00 C ATOM 148 CG ARG A 65 -17.374 -20.827 4.605 1.00 0.00 C ATOM 149 CD ARG A 65 -17.157 -20.117 5.941 1.00 0.00 C ATOM 150 NE ARG A 65 -17.386 -21.051 7.040 1.00 0.00 N ATOM 151 CZ ARG A 65 -16.471 -21.957 7.391 1.00 0.00 C ATOM 152 NH1 ARG A 65 -15.328 -22.036 6.758 1.00 0.00 N ATOM 153 NH2 ARG A 65 -16.725 -22.778 8.373 1.00 0.00 N ATOM 0 H ARG A 65 -16.194 -17.940 4.037 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.808 -20.264 2.698 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.132 -18.897 3.996 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.565 -20.205 2.913 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -18.160 -21.576 4.705 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -16.466 -21.355 4.312 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -16.142 -19.722 5.993 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.835 -19.268 6.026 1.00 0.00 H new ATOM 0 HE ARG A 65 -18.267 -21.010 7.552 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -15.128 -21.400 5.986 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -14.638 -22.733 7.037 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -17.617 -22.724 8.865 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -16.032 -23.474 8.648 1.00 0.00 H new ATOM 517 N LYS A 89 -20.818 -7.474 6.852 1.00 0.00 N ATOM 518 CA LYS A 89 -20.557 -7.942 8.205 1.00 0.00 C ATOM 519 C LYS A 89 -19.073 -8.228 8.394 1.00 0.00 C ATOM 520 O LYS A 89 -18.436 -7.704 9.308 1.00 0.00 O ATOM 521 CB LYS A 89 -21.362 -9.212 8.482 1.00 0.00 C ATOM 522 CG LYS A 89 -21.470 -9.436 9.990 1.00 0.00 C ATOM 523 CD LYS A 89 -22.610 -8.583 10.551 1.00 0.00 C ATOM 524 CE LYS A 89 -22.595 -8.652 12.079 1.00 0.00 C ATOM 525 NZ LYS A 89 -21.500 -7.789 12.602 1.00 0.00 N ATOM 0 HA LYS A 89 -20.858 -7.162 8.904 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.357 -9.126 8.045 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -20.881 -10.069 8.011 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.653 -10.490 10.200 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -20.531 -9.172 10.476 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -22.501 -7.550 10.222 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -23.567 -8.940 10.170 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -23.554 -8.323 12.478 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -22.449 -9.681 12.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -21.640 -7.630 13.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -20.585 -8.258 12.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -21.510 -6.876 12.104 1.00 0.00 H new ATOM 539 N VAL A 90 -18.527 -9.050 7.510 1.00 0.00 N ATOM 540 CA VAL A 90 -17.113 -9.394 7.567 1.00 0.00 C ATOM 541 C VAL A 90 -16.263 -8.178 7.245 1.00 0.00 C ATOM 542 O VAL A 90 -15.190 -7.987 7.815 1.00 0.00 O ATOM 543 CB VAL A 90 -16.808 -10.526 6.592 1.00 0.00 C ATOM 544 CG1 VAL A 90 -17.228 -10.129 5.185 1.00 0.00 C ATOM 545 CG2 VAL A 90 -15.306 -10.820 6.608 1.00 0.00 C ATOM 0 H VAL A 90 -19.040 -9.491 6.746 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.874 -9.728 8.577 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.362 -11.415 6.894 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -17.006 -10.944 4.496 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -18.298 -9.922 5.170 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -16.681 -9.237 4.880 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -15.086 -11.629 5.911 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -14.757 -9.926 6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -15.004 -11.114 7.613 1.00 0.00 H new ATOM 555 N TYR A 91 -16.755 -7.350 6.338 1.00 0.00 N ATOM 556 CA TYR A 91 -16.039 -6.150 5.954 1.00 0.00 C ATOM 557 C TYR A 91 -16.006 -5.169 7.111 1.00 0.00 C ATOM 558 O TYR A 91 -14.990 -4.525 7.367 1.00 0.00 O ATOM 559 CB TYR A 91 -16.700 -5.496 4.743 1.00 0.00 C ATOM 560 CG TYR A 91 -15.889 -4.301 4.295 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.563 -4.462 3.856 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.473 -3.029 4.290 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.834 -3.354 3.417 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.738 -1.921 3.855 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.418 -2.083 3.420 1.00 0.00 C ATOM 566 OH TYR A 91 -13.695 -0.989 2.989 1.00 0.00 O ATOM 0 H TYR A 91 -17.644 -7.488 5.857 1.00 0.00 H new ATOM 0 HA TYR A 91 -15.019 -6.428 5.690 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.781 -6.217 3.929 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.714 -5.184 4.995 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -14.108 -5.442 3.858 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.493 -2.903 4.623 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.817 -3.479 3.075 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.190 -0.940 3.855 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.250 -0.184 3.055 1.00 0.00 H new ATOM 576 N ASP A 92 -17.131 -5.059 7.804 1.00 0.00 N ATOM 577 CA ASP A 92 -17.231 -4.147 8.931 1.00 0.00 C ATOM 578 C ASP A 92 -16.289 -4.573 10.043 1.00 0.00 C ATOM 579 O ASP A 92 -15.647 -3.740 10.679 1.00 0.00 O ATOM 580 CB ASP A 92 -18.669 -4.107 9.456 1.00 0.00 C ATOM 581 CG ASP A 92 -18.802 -3.043 10.540 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.744 -1.872 10.201 1.00 0.00 O ATOM 583 OD2 ASP A 92 -18.953 -3.413 11.692 1.00 0.00 O ATOM 0 H ASP A 92 -17.981 -5.587 7.606 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.949 -3.150 8.592 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.357 -3.892 8.638 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.945 -5.082 9.857 1.00 0.00 H new ATOM 588 N SER A 93 -16.214 -5.875 10.267 1.00 0.00 N ATOM 589 CA SER A 93 -15.343 -6.413 11.307 1.00 0.00 C ATOM 590 C SER A 93 -13.883 -6.166 10.961 1.00 0.00 C ATOM 591 O SER A 93 -13.072 -5.833 11.826 1.00 0.00 O ATOM 592 CB SER A 93 -15.585 -7.911 11.474 1.00 0.00 C ATOM 593 OG SER A 93 -16.900 -8.118 11.970 1.00 0.00 O ATOM 0 H SER A 93 -16.741 -6.577 9.748 1.00 0.00 H new ATOM 0 HA SER A 93 -15.574 -5.905 12.244 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.459 -8.421 10.519 1.00 0.00 H new ATOM 0 HB3 SER A 93 -14.853 -8.336 12.161 1.00 0.00 H new ATOM 0 HG SER A 93 -17.545 -8.021 11.238 1.00 0.00 H new ATOM 599 N LEU A 94 -13.556 -6.336 9.688 1.00 0.00 N ATOM 600 CA LEU A 94 -12.185 -6.130 9.235 1.00 0.00 C ATOM 601 C LEU A 94 -11.883 -4.635 9.085 1.00 0.00 C ATOM 602 O LEU A 94 -10.722 -4.242 8.960 1.00 0.00 O ATOM 603 CB LEU A 94 -11.954 -6.841 7.893 1.00 0.00 C ATOM 604 CG LEU A 94 -12.113 -8.359 8.061 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.015 -9.038 6.695 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.006 -8.897 8.976 1.00 0.00 C ATOM 0 H LEU A 94 -14.211 -6.613 8.957 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.514 -6.551 9.984 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.664 -6.474 7.152 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.956 -6.612 7.519 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.086 -8.571 8.505 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.128 -10.115 6.815 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.804 -8.661 6.044 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.043 -8.822 6.250 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.122 -9.974 9.093 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.033 -8.683 8.534 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.075 -8.417 9.952 1.00 0.00 H new ATOM 618 N LYS A 95 -12.930 -3.810 9.096 1.00 0.00 N ATOM 619 CA LYS A 95 -12.754 -2.369 8.961 1.00 0.00 C ATOM 620 C LYS A 95 -12.719 -1.679 10.322 1.00 0.00 C ATOM 621 O LYS A 95 -12.030 -0.675 10.506 1.00 0.00 O ATOM 622 CB LYS A 95 -13.895 -1.778 8.141 1.00 0.00 C ATOM 623 CG LYS A 95 -13.454 -1.665 6.687 1.00 0.00 C ATOM 624 CD LYS A 95 -12.781 -0.308 6.471 1.00 0.00 C ATOM 625 CE LYS A 95 -11.654 -0.453 5.451 1.00 0.00 C ATOM 626 NZ LYS A 95 -11.170 0.900 5.056 1.00 0.00 N ATOM 0 H LYS A 95 -13.899 -4.113 9.196 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.801 -2.202 8.459 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.780 -2.409 8.218 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.169 -0.797 8.529 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.763 -2.471 6.440 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.313 -1.768 6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.512 0.420 6.120 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.385 0.068 7.415 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.836 -1.035 5.876 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -12.009 -0.995 4.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.402 0.805 4.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.953 1.440 4.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.817 1.401 5.896 1.00 0.00 H new ATOM 640 N ASN A 96 -13.466 -2.227 11.273 1.00 0.00 N ATOM 641 CA ASN A 96 -13.523 -1.662 12.617 1.00 0.00 C ATOM 642 C ASN A 96 -12.472 -2.298 13.520 1.00 0.00 C ATOM 643 O ASN A 96 -12.420 -2.010 14.717 1.00 0.00 O ATOM 644 CB ASN A 96 -14.912 -1.871 13.220 1.00 0.00 C ATOM 645 CG ASN A 96 -15.941 -1.057 12.446 1.00 0.00 C ATOM 646 OD1 ASN A 96 -16.768 -1.617 11.728 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.942 0.245 12.554 1.00 0.00 N ATOM 0 H ASN A 96 -14.040 -3.060 11.140 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.318 -0.594 12.543 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.175 -2.928 13.191 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -14.912 -1.571 14.268 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.629 0.799 12.043 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -15.256 0.708 13.150 1.00 0.00 H new ATOM 654 N MET A 97 -11.634 -3.157 12.948 1.00 0.00 N ATOM 655 CA MET A 97 -10.591 -3.819 13.715 1.00 0.00 C ATOM 656 C MET A 97 -9.751 -2.816 14.494 1.00 0.00 C ATOM 657 O MET A 97 -9.064 -3.201 15.441 1.00 0.00 O ATOM 658 CB MET A 97 -9.693 -4.624 12.776 1.00 0.00 C ATOM 659 CG MET A 97 -10.021 -6.111 12.910 1.00 0.00 C ATOM 660 SD MET A 97 -9.344 -7.003 11.490 1.00 0.00 S ATOM 661 CE MET A 97 -9.263 -8.636 12.264 1.00 0.00 C ATOM 0 H MET A 97 -11.658 -3.409 11.960 1.00 0.00 H new ATOM 0 HA MET A 97 -11.070 -4.486 14.431 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.841 -4.299 11.746 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.645 -4.448 13.018 1.00 0.00 H new ATOM 0 HG2 MET A 97 -9.602 -6.506 13.835 1.00 0.00 H new ATOM 0 HG3 MET A 97 -11.100 -6.254 12.963 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.230 -8.863 12.527 1.00 0.00 H new ATOM 0 HE2 MET A 97 -9.877 -8.642 13.165 1.00 0.00 H new ATOM 0 HE3 MET A 97 -9.634 -9.388 11.567 1.00 0.00 H new ATOM 671 N SER A 98 -9.791 -1.536 14.082 1.00 0.00 N ATOM 672 CA SER A 98 -9.018 -0.481 14.742 1.00 0.00 C ATOM 673 C SER A 98 -7.558 -0.562 14.321 1.00 0.00 C ATOM 674 O SER A 98 -7.046 0.328 13.642 1.00 0.00 O ATOM 675 CB SER A 98 -9.142 -0.585 16.264 1.00 0.00 C ATOM 676 OG SER A 98 -9.009 0.708 16.836 1.00 0.00 O ATOM 0 H SER A 98 -10.352 -1.212 13.294 1.00 0.00 H new ATOM 0 HA SER A 98 -9.421 0.484 14.435 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.106 -1.017 16.533 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.374 -1.250 16.658 1.00 0.00 H new ATOM 0 HG SER A 98 -9.090 0.644 17.811 1.00 0.00 H new ATOM 682 N THR A 99 -6.905 -1.646 14.705 1.00 0.00 N ATOM 683 CA THR A 99 -5.510 -1.856 14.341 1.00 0.00 C ATOM 684 C THR A 99 -5.363 -1.961 12.821 1.00 0.00 C ATOM 685 O THR A 99 -4.269 -1.793 12.280 1.00 0.00 O ATOM 686 CB THR A 99 -4.983 -3.126 15.009 1.00 0.00 C ATOM 687 OG1 THR A 99 -4.913 -2.922 16.414 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.595 -3.461 14.462 1.00 0.00 C ATOM 0 H THR A 99 -7.315 -2.393 15.266 1.00 0.00 H new ATOM 0 HA THR A 99 -4.926 -1.003 14.687 1.00 0.00 H new ATOM 0 HB THR A 99 -5.656 -3.956 14.796 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.577 -3.735 16.846 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.224 -4.367 14.941 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.657 -3.619 13.385 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.914 -2.636 14.669 1.00 0.00 H new ATOM 696 N VAL A 100 -6.473 -2.243 12.139 1.00 0.00 N ATOM 697 CA VAL A 100 -6.462 -2.369 10.687 1.00 0.00 C ATOM 698 C VAL A 100 -6.290 -1.012 10.009 1.00 0.00 C ATOM 699 O VAL A 100 -6.775 0.010 10.497 1.00 0.00 O ATOM 700 CB VAL A 100 -7.774 -2.992 10.197 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.951 -2.121 10.649 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.757 -3.078 8.662 1.00 0.00 C ATOM 0 H VAL A 100 -7.386 -2.388 12.569 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.619 -3.008 10.426 1.00 0.00 H new ATOM 0 HB VAL A 100 -7.882 -3.993 10.615 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.885 -2.563 10.301 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.961 -2.060 11.737 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.845 -1.120 10.230 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.689 -3.521 8.312 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.651 -2.078 8.243 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -6.919 -3.697 8.342 1.00 0.00 H new ATOM 712 N LYS A 101 -5.600 -1.016 8.873 1.00 0.00 N ATOM 713 CA LYS A 101 -5.374 0.209 8.117 1.00 0.00 C ATOM 714 C LYS A 101 -6.373 0.325 6.969 1.00 0.00 C ATOM 715 O LYS A 101 -6.952 1.388 6.742 1.00 0.00 O ATOM 716 CB LYS A 101 -3.942 0.239 7.575 1.00 0.00 C ATOM 717 CG LYS A 101 -3.726 1.539 6.799 1.00 0.00 C ATOM 718 CD LYS A 101 -2.228 1.832 6.694 1.00 0.00 C ATOM 719 CE LYS A 101 -1.555 0.789 5.804 1.00 0.00 C ATOM 720 NZ LYS A 101 -0.101 1.097 5.696 1.00 0.00 N ATOM 0 H LYS A 101 -5.189 -1.852 8.457 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.517 1.058 8.786 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.228 0.168 8.396 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.768 -0.619 6.926 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.161 1.456 5.803 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.233 2.363 7.301 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.072 2.829 6.282 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.776 1.822 7.686 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.697 -0.208 6.221 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.013 0.789 4.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.360 0.388 5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.024 2.042 5.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.330 1.076 6.642 1.00 0.00 H new ATOM 734 N SER A 102 -6.574 -0.777 6.251 1.00 0.00 N ATOM 735 CA SER A 102 -7.512 -0.793 5.135 1.00 0.00 C ATOM 736 C SER A 102 -7.903 -2.222 4.789 1.00 0.00 C ATOM 737 O SER A 102 -7.185 -3.172 5.105 1.00 0.00 O ATOM 738 CB SER A 102 -6.877 -0.119 3.919 1.00 0.00 C ATOM 739 OG SER A 102 -5.786 -0.904 3.463 1.00 0.00 O ATOM 0 H SER A 102 -6.102 -1.665 6.422 1.00 0.00 H new ATOM 0 HA SER A 102 -8.410 -0.247 5.423 1.00 0.00 H new ATOM 0 HB2 SER A 102 -7.615 -0.006 3.125 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.535 0.882 4.181 1.00 0.00 H new ATOM 0 HG SER A 102 -5.378 -0.475 2.682 1.00 0.00 H new ATOM 745 N VAL A 103 -9.036 -2.361 4.116 1.00 0.00 N ATOM 746 CA VAL A 103 -9.513 -3.679 3.708 1.00 0.00 C ATOM 747 C VAL A 103 -9.989 -3.653 2.254 1.00 0.00 C ATOM 748 O VAL A 103 -10.773 -2.786 1.865 1.00 0.00 O ATOM 749 CB VAL A 103 -10.655 -4.133 4.614 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.105 -5.539 4.203 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.193 -4.128 6.078 1.00 0.00 C ATOM 0 H VAL A 103 -9.639 -1.586 3.842 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.685 -4.383 3.795 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.495 -3.447 4.512 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.920 -5.864 4.850 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.447 -5.524 3.168 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.268 -6.231 4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.012 -4.453 6.719 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.349 -4.808 6.195 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.889 -3.120 6.360 1.00 0.00 H new ATOM 761 N THR A 104 -9.497 -4.595 1.460 1.00 0.00 N ATOM 762 CA THR A 104 -9.863 -4.673 0.051 1.00 0.00 C ATOM 763 C THR A 104 -10.476 -6.028 -0.270 1.00 0.00 C ATOM 764 O THR A 104 -9.947 -7.071 0.105 1.00 0.00 O ATOM 765 CB THR A 104 -8.624 -4.466 -0.821 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.063 -3.188 -0.567 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.002 -4.584 -2.298 1.00 0.00 C ATOM 0 H THR A 104 -8.844 -5.316 1.767 1.00 0.00 H new ATOM 0 HA THR A 104 -10.595 -3.892 -0.155 1.00 0.00 H new ATOM 0 HB THR A 104 -7.887 -5.232 -0.580 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.269 -3.062 -1.127 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.115 -4.435 -2.914 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.415 -5.574 -2.490 1.00 0.00 H new ATOM 0 HG23 THR A 104 -9.746 -3.826 -2.545 1.00 0.00 H new ATOM 775 N PHE A 105 -11.591 -6.005 -0.975 1.00 0.00 N ATOM 776 CA PHE A 105 -12.274 -7.226 -1.354 1.00 0.00 C ATOM 777 C PHE A 105 -11.681 -7.758 -2.653 1.00 0.00 C ATOM 778 O PHE A 105 -11.628 -7.054 -3.660 1.00 0.00 O ATOM 779 CB PHE A 105 -13.759 -6.922 -1.573 1.00 0.00 C ATOM 780 CG PHE A 105 -14.524 -8.199 -1.786 1.00 0.00 C ATOM 781 CD1 PHE A 105 -15.176 -8.796 -0.708 1.00 0.00 C ATOM 782 CD2 PHE A 105 -14.587 -8.783 -3.057 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.890 -9.979 -0.892 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.303 -9.971 -3.244 1.00 0.00 C ATOM 785 CZ PHE A 105 -15.957 -10.567 -2.159 1.00 0.00 C ATOM 0 H PHE A 105 -12.044 -5.150 -1.298 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.157 -7.969 -0.565 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.160 -6.389 -0.711 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -13.880 -6.268 -2.437 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -15.128 -8.342 0.271 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -14.084 -8.318 -3.892 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -16.392 -10.442 -0.055 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -15.351 -10.426 -4.222 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.514 -11.482 -2.301 1.00 0.00 H new ATOM 795 N SER A 106 -11.232 -9.000 -2.622 1.00 0.00 N ATOM 796 CA SER A 106 -10.639 -9.614 -3.804 1.00 0.00 C ATOM 797 C SER A 106 -11.537 -10.714 -4.359 1.00 0.00 C ATOM 798 O SER A 106 -11.404 -11.883 -3.993 1.00 0.00 O ATOM 799 CB SER A 106 -9.288 -10.211 -3.437 1.00 0.00 C ATOM 800 OG SER A 106 -8.263 -9.267 -3.711 1.00 0.00 O ATOM 0 H SER A 106 -11.265 -9.602 -1.799 1.00 0.00 H new ATOM 0 HA SER A 106 -10.519 -8.845 -4.567 1.00 0.00 H new ATOM 0 HB2 SER A 106 -9.273 -10.484 -2.382 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.116 -11.125 -4.005 1.00 0.00 H new ATOM 0 HG SER A 106 -7.526 -9.711 -4.180 1.00 0.00 H new ATOM 806 N SER A 107 -12.436 -10.348 -5.262 1.00 0.00 N ATOM 807 CA SER A 107 -13.337 -11.328 -5.851 1.00 0.00 C ATOM 808 C SER A 107 -12.550 -12.512 -6.392 1.00 0.00 C ATOM 809 O SER A 107 -11.436 -12.360 -6.873 1.00 0.00 O ATOM 810 CB SER A 107 -14.142 -10.687 -6.982 1.00 0.00 C ATOM 811 OG SER A 107 -14.964 -9.658 -6.447 1.00 0.00 O ATOM 0 H SER A 107 -12.560 -9.393 -5.599 1.00 0.00 H new ATOM 0 HA SER A 107 -14.020 -11.680 -5.078 1.00 0.00 H new ATOM 0 HB2 SER A 107 -13.470 -10.277 -7.735 1.00 0.00 H new ATOM 0 HB3 SER A 107 -14.756 -11.438 -7.478 1.00 0.00 H new ATOM 0 HG SER A 107 -14.664 -9.438 -5.540 1.00 0.00 H new ATOM 817 N LYS A 108 -13.141 -13.692 -6.293 1.00 0.00 N ATOM 818 CA LYS A 108 -12.500 -14.913 -6.759 1.00 0.00 C ATOM 819 C LYS A 108 -12.199 -14.823 -8.242 1.00 0.00 C ATOM 820 O LYS A 108 -11.175 -15.321 -8.707 1.00 0.00 O ATOM 821 CB LYS A 108 -13.421 -16.111 -6.499 1.00 0.00 C ATOM 822 CG LYS A 108 -14.691 -16.008 -7.352 1.00 0.00 C ATOM 823 CD LYS A 108 -15.823 -16.796 -6.685 1.00 0.00 C ATOM 824 CE LYS A 108 -16.717 -17.419 -7.763 1.00 0.00 C ATOM 825 NZ LYS A 108 -18.118 -17.522 -7.261 1.00 0.00 N ATOM 0 H LYS A 108 -14.069 -13.831 -5.892 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.564 -15.043 -6.216 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -12.895 -17.038 -6.729 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -13.688 -16.150 -5.443 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -14.980 -14.963 -7.467 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -14.502 -16.399 -8.352 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -15.410 -17.576 -6.045 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.411 -16.138 -6.046 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -16.689 -16.811 -8.667 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -16.344 -18.407 -8.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.720 -17.945 -7.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.139 -18.120 -6.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -18.473 -16.573 -7.026 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.814 -17.216 -2.799 1.00 0.00 N ATOM 1238 CA TYR A 134 -13.210 -16.870 -2.619 1.00 0.00 C ATOM 1239 C TYR A 134 -13.357 -15.578 -1.847 1.00 0.00 C ATOM 1240 O TYR A 134 -13.176 -15.566 -0.629 1.00 0.00 O ATOM 1241 CB TYR A 134 -13.930 -17.980 -1.866 1.00 0.00 C ATOM 1242 CG TYR A 134 -12.929 -19.009 -1.401 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.438 -18.967 -0.096 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -12.502 -20.011 -2.276 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -11.520 -19.927 0.334 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -11.585 -20.966 -1.851 1.00 0.00 C ATOM 1247 CZ TYR A 134 -11.090 -20.929 -0.543 1.00 0.00 C ATOM 1248 OH TYR A 134 -10.181 -21.875 -0.120 1.00 0.00 O ATOM 0 HA TYR A 134 -13.651 -16.743 -3.608 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -14.464 -17.566 -1.011 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.674 -18.447 -2.511 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.768 -18.193 0.581 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.885 -20.044 -3.285 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.141 -19.896 1.345 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -11.255 -21.737 -2.531 1.00 0.00 H new ATOM 0 HH TYR A 134 -9.991 -22.497 -0.853 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.699 -14.507 -2.563 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.904 -13.181 -1.971 1.00 0.00 C ATOM 1260 C ASP A 135 -12.598 -12.524 -1.551 1.00 0.00 C ATOM 1261 O ASP A 135 -12.382 -11.363 -1.857 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.833 -13.272 -0.765 1.00 0.00 C ATOM 1263 CG ASP A 135 -16.173 -13.860 -1.182 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -16.550 -13.674 -2.327 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -16.800 -14.492 -0.352 1.00 0.00 O ATOM 0 H ASP A 135 -13.843 -14.532 -3.573 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.358 -12.561 -2.744 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.379 -13.893 0.008 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.980 -12.282 -0.333 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.766 -13.280 -0.844 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.470 -12.828 -0.339 1.00 0.00 C ATOM 1272 C ALA A 136 -10.527 -11.408 0.218 1.00 0.00 C ATOM 1273 O ALA A 136 -10.880 -10.464 -0.462 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.433 -12.911 -1.460 1.00 0.00 C ATOM 0 H ALA A 136 -11.977 -14.247 -0.599 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.187 -13.483 0.485 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.466 -12.575 -1.087 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.351 -13.942 -1.804 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.742 -12.275 -2.290 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.122 -11.247 1.459 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.114 -9.921 2.059 1.00 0.00 C ATOM 1282 C TYR A 137 -8.689 -9.489 2.351 1.00 0.00 C ATOM 1283 O TYR A 137 -8.059 -9.991 3.278 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.915 -9.938 3.361 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.283 -9.360 3.143 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.400 -10.113 3.487 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.437 -8.087 2.587 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.673 -9.602 3.274 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.713 -7.569 2.375 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.836 -8.327 2.717 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.099 -7.822 2.497 1.00 0.00 O ATOM 0 H TYR A 137 -9.799 -11.999 2.067 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.567 -9.217 1.361 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.000 -10.960 3.729 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.390 -9.366 4.126 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.277 -11.095 3.920 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.567 -7.505 2.322 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.540 -10.189 3.538 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.834 -6.585 1.948 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.030 -6.939 2.077 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.181 -8.565 1.555 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.826 -8.094 1.747 1.00 0.00 C ATOM 1303 C ILE A 138 -6.817 -6.995 2.808 1.00 0.00 C ATOM 1304 O ILE A 138 -7.287 -5.885 2.568 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.280 -7.529 0.427 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.444 -8.581 -0.688 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.793 -7.117 0.580 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.073 -7.970 -2.041 1.00 0.00 C ATOM 0 H ILE A 138 -8.681 -8.132 0.779 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.199 -8.925 2.071 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.846 -6.636 0.160 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -5.809 -9.443 -0.482 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.473 -8.941 -0.712 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.426 -6.720 -0.366 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.705 -6.353 1.353 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.201 -7.988 0.861 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.191 -8.720 -2.823 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.726 -7.122 -2.249 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.037 -7.632 -2.016 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.292 -7.317 3.980 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.235 -6.377 5.081 1.00 0.00 C ATOM 1322 C VAL A 139 -4.803 -5.924 5.330 1.00 0.00 C ATOM 1323 O VAL A 139 -3.870 -6.726 5.307 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.786 -7.027 6.354 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.543 -6.086 7.537 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.296 -7.285 6.195 1.00 0.00 C ATOM 0 H VAL A 139 -5.896 -8.233 4.191 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.841 -5.510 4.819 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.282 -7.977 6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -6.932 -6.540 8.449 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.473 -5.909 7.647 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.051 -5.138 7.358 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.684 -7.747 7.103 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.810 -6.340 6.021 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.464 -7.951 5.348 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.644 -4.632 5.566 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.324 -4.071 5.828 1.00 0.00 C ATOM 1338 C GLU A 140 -3.185 -3.702 7.303 1.00 0.00 C ATOM 1339 O GLU A 140 -3.825 -2.772 7.784 1.00 0.00 O ATOM 1340 CB GLU A 140 -3.099 -2.830 4.967 1.00 0.00 C ATOM 1341 CG GLU A 140 -2.456 -3.242 3.644 1.00 0.00 C ATOM 1342 CD GLU A 140 -2.004 -2.010 2.869 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -2.861 -1.307 2.363 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -0.808 -1.786 2.797 1.00 0.00 O ATOM 0 H GLU A 140 -5.406 -3.954 5.582 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.575 -4.823 5.578 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -4.047 -2.325 4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.458 -2.121 5.491 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -1.603 -3.894 3.834 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.168 -3.814 3.048 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.337 -4.441 8.016 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.118 -4.180 9.434 1.00 0.00 C ATOM 1353 C ALA A 141 -1.306 -2.905 9.627 1.00 0.00 C ATOM 1354 O ALA A 141 -0.442 -2.582 8.813 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.386 -5.358 10.077 1.00 0.00 C ATOM 0 H ALA A 141 -1.795 -5.218 7.638 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.089 -4.053 9.913 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.227 -5.154 11.136 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.985 -6.262 9.968 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.423 -5.500 9.586 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.585 -2.176 10.701 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.863 -0.936 10.967 1.00 0.00 C ATOM 1363 C ASN A 142 0.641 -1.187 10.947 1.00 0.00 C ATOM 1364 O ASN A 142 1.417 -0.321 10.539 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.267 -0.369 12.331 1.00 0.00 C ATOM 1366 CG ASN A 142 -0.316 -0.867 13.412 1.00 0.00 C ATOM 1367 OD1 ASN A 142 0.633 -0.172 13.772 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -0.500 -2.045 13.941 1.00 0.00 N ATOM 0 H ASN A 142 -2.295 -2.416 11.393 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.118 -0.216 10.189 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -1.253 0.720 12.298 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -2.288 -0.668 12.569 1.00 0.00 H new ATOM 0 HD21 ASN A 142 0.143 -2.390 14.653 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -1.287 -2.621 13.642 1.00 0.00 H new ATOM 1375 N ALA A 143 1.054 -2.371 11.396 1.00 0.00 N ATOM 1376 CA ALA A 143 2.471 -2.713 11.427 1.00 0.00 C ATOM 1377 C ALA A 143 2.676 -4.181 11.039 1.00 0.00 C ATOM 1378 O ALA A 143 1.752 -4.987 11.119 1.00 0.00 O ATOM 1379 CB ALA A 143 3.036 -2.461 12.829 1.00 0.00 C ATOM 0 H ALA A 143 0.432 -3.103 11.740 1.00 0.00 H new ATOM 0 HA ALA A 143 2.998 -2.085 10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.095 -2.718 12.846 1.00 0.00 H new ATOM 0 HB2 ALA A 143 2.914 -1.409 13.087 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.501 -3.076 13.553 1.00 0.00 H new ATOM 1385 N PRO A 144 3.868 -4.537 10.633 1.00 0.00 N ATOM 1386 CA PRO A 144 4.199 -5.940 10.235 1.00 0.00 C ATOM 1387 C PRO A 144 4.085 -6.915 11.407 1.00 0.00 C ATOM 1388 O PRO A 144 3.950 -8.124 11.213 1.00 0.00 O ATOM 1389 CB PRO A 144 5.641 -5.848 9.727 1.00 0.00 C ATOM 1390 CG PRO A 144 6.203 -4.617 10.354 1.00 0.00 C ATOM 1391 CD PRO A 144 5.035 -3.648 10.512 1.00 0.00 C ATOM 0 HA PRO A 144 3.508 -6.326 9.485 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.215 -6.730 10.010 1.00 0.00 H new ATOM 0 HB3 PRO A 144 5.671 -5.784 8.639 1.00 0.00 H new ATOM 0 HG2 PRO A 144 6.654 -4.844 11.320 1.00 0.00 H new ATOM 0 HG3 PRO A 144 6.985 -4.185 9.730 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.153 -3.017 11.393 1.00 0.00 H new ATOM 0 HD3 PRO A 144 4.946 -2.983 9.653 1.00 0.00 H new ATOM 1399 N ASN A 145 4.135 -6.379 12.623 1.00 0.00 N ATOM 1400 CA ASN A 145 4.027 -7.206 13.823 1.00 0.00 C ATOM 1401 C ASN A 145 2.562 -7.399 14.234 1.00 0.00 C ATOM 1402 O ASN A 145 2.267 -8.136 15.175 1.00 0.00 O ATOM 1403 CB ASN A 145 4.800 -6.556 14.972 1.00 0.00 C ATOM 1404 CG ASN A 145 4.715 -7.431 16.218 1.00 0.00 C ATOM 1405 OD1 ASN A 145 3.876 -7.195 17.088 1.00 0.00 O ATOM 1406 ND2 ASN A 145 5.539 -8.433 16.356 1.00 0.00 N ATOM 0 H ASN A 145 4.249 -5.382 12.804 1.00 0.00 H new ATOM 0 HA ASN A 145 4.452 -8.184 13.599 1.00 0.00 H new ATOM 0 HB2 ASN A 145 5.843 -6.416 14.686 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.392 -5.568 15.183 1.00 0.00 H new ATOM 0 HD21 ASN A 145 5.489 -9.023 17.186 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.233 -8.626 15.634 1.00 0.00 H new ATOM 1413 N ASP A 146 1.650 -6.737 13.521 1.00 0.00 N ATOM 1414 CA ASP A 146 0.228 -6.840 13.810 1.00 0.00 C ATOM 1415 C ASP A 146 -0.464 -7.747 12.798 1.00 0.00 C ATOM 1416 O ASP A 146 -1.627 -8.082 12.964 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.409 -5.450 13.764 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.145 -4.716 15.074 1.00 0.00 C ATOM 1419 OD1 ASP A 146 -0.927 -4.890 15.993 1.00 0.00 O ATOM 1420 OD2 ASP A 146 0.843 -4.005 15.145 1.00 0.00 O ATOM 0 H ASP A 146 1.876 -6.123 12.738 1.00 0.00 H new ATOM 0 HA ASP A 146 0.108 -7.269 14.805 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.001 -4.881 12.929 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.482 -5.537 13.596 1.00 0.00 H new ATOM 1425 N VAL A 147 0.254 -8.140 11.751 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.321 -9.000 10.728 1.00 0.00 C ATOM 1427 C VAL A 147 -0.719 -10.329 11.340 1.00 0.00 C ATOM 1428 O VAL A 147 -1.635 -11.001 10.863 1.00 0.00 O ATOM 1429 CB VAL A 147 0.708 -9.234 9.621 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.253 -7.890 9.147 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.860 -10.095 10.161 1.00 0.00 C ATOM 0 H VAL A 147 1.227 -7.878 11.591 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.204 -8.519 10.308 1.00 0.00 H new ATOM 0 HB VAL A 147 0.234 -9.751 8.786 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.987 -8.053 8.358 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.435 -7.281 8.762 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.727 -7.375 9.982 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.592 -10.261 9.371 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.337 -9.582 10.996 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.469 -11.054 10.500 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.025 -10.701 12.403 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.320 -11.956 13.077 1.00 0.00 C ATOM 1443 C LYS A 148 -1.501 -11.776 14.017 1.00 0.00 C ATOM 1444 O LYS A 148 -2.310 -12.686 14.201 1.00 0.00 O ATOM 1445 CB LYS A 148 0.889 -12.435 13.887 1.00 0.00 C ATOM 1446 CG LYS A 148 2.189 -12.141 13.132 1.00 0.00 C ATOM 1447 CD LYS A 148 2.852 -10.908 13.743 1.00 0.00 C ATOM 1448 CE LYS A 148 3.645 -11.323 14.984 1.00 0.00 C ATOM 1449 NZ LYS A 148 4.923 -11.986 14.579 1.00 0.00 N ATOM 0 H LYS A 148 0.737 -10.161 12.814 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.559 -12.699 12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.904 -11.938 14.857 1.00 0.00 H new ATOM 0 HB3 LYS A 148 0.806 -13.505 14.078 1.00 0.00 H new ATOM 0 HG2 LYS A 148 2.860 -12.998 13.191 1.00 0.00 H new ATOM 0 HG3 LYS A 148 1.981 -11.972 12.076 1.00 0.00 H new ATOM 0 HD2 LYS A 148 3.513 -10.438 13.015 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.096 -10.169 14.010 1.00 0.00 H new ATOM 0 HE2 LYS A 148 3.859 -10.448 15.598 1.00 0.00 H new ATOM 0 HE3 LYS A 148 3.051 -12.003 15.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 5.582 -11.989 15.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 4.729 -12.965 14.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 5.348 -11.465 13.785 1.00 0.00 H new ATOM 1463 N THR A 149 -1.606 -10.584 14.594 1.00 0.00 N ATOM 1464 CA THR A 149 -2.702 -10.281 15.501 1.00 0.00 C ATOM 1465 C THR A 149 -4.005 -10.115 14.728 1.00 0.00 C ATOM 1466 O THR A 149 -5.068 -10.533 15.171 1.00 0.00 O ATOM 1467 CB THR A 149 -2.396 -9.005 16.292 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.168 -9.177 16.991 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.510 -8.754 17.305 1.00 0.00 C ATOM 0 H THR A 149 -0.949 -9.817 14.450 1.00 0.00 H new ATOM 0 HA THR A 149 -2.813 -11.112 16.197 1.00 0.00 H new ATOM 0 HB THR A 149 -2.324 -8.159 15.608 1.00 0.00 H new ATOM 0 HG1 THR A 149 -0.964 -8.364 17.499 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.292 -7.846 17.868 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.459 -8.637 16.781 1.00 0.00 H new ATOM 0 HG23 THR A 149 -3.576 -9.599 17.991 1.00 0.00 H new ATOM 1477 N ILE A 150 -3.912 -9.489 13.572 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.079 -9.263 12.746 1.00 0.00 C ATOM 1479 C ILE A 150 -5.576 -10.575 12.167 1.00 0.00 C ATOM 1480 O ILE A 150 -6.779 -10.815 12.088 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.730 -8.289 11.618 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.328 -6.935 12.219 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -5.948 -8.100 10.712 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.560 -6.191 12.741 1.00 0.00 C ATOM 0 H ILE A 150 -3.040 -9.128 13.184 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.871 -8.833 13.359 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.901 -8.691 11.035 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.617 -7.088 13.031 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.824 -6.331 11.464 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.700 -7.406 9.909 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.237 -9.061 10.286 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.776 -7.698 11.295 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.255 -5.234 13.163 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.257 -6.020 11.920 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.047 -6.789 13.512 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.643 -11.422 11.763 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.001 -12.705 11.189 1.00 0.00 C ATOM 1498 C ALA A 151 -5.728 -13.565 12.213 1.00 0.00 C ATOM 1499 O ALA A 151 -6.695 -14.253 11.892 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.748 -13.438 10.709 1.00 0.00 C ATOM 0 H ALA A 151 -3.640 -11.245 11.822 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.662 -12.525 10.341 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.031 -14.399 10.280 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.243 -12.838 9.952 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.076 -13.600 11.552 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.250 -13.522 13.450 1.00 0.00 N ATOM 1507 CA GLU A 152 -5.867 -14.325 14.503 1.00 0.00 C ATOM 1508 C GLU A 152 -7.225 -13.748 14.888 1.00 0.00 C ATOM 1509 O GLU A 152 -8.125 -14.476 15.308 1.00 0.00 O ATOM 1510 CB GLU A 152 -4.948 -14.402 15.733 1.00 0.00 C ATOM 1511 CG GLU A 152 -5.343 -13.330 16.751 1.00 0.00 C ATOM 1512 CD GLU A 152 -4.240 -13.160 17.788 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -3.111 -13.518 17.491 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -4.539 -12.670 18.863 1.00 0.00 O ATOM 0 H GLU A 152 -4.456 -12.955 13.747 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.016 -15.335 14.121 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.018 -15.390 16.188 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -3.910 -14.263 15.431 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -5.523 -12.383 16.242 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -6.275 -13.610 17.242 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.364 -12.438 14.741 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.615 -11.768 15.062 1.00 0.00 C ATOM 1523 C ASP A 153 -9.647 -11.999 13.957 1.00 0.00 C ATOM 1524 O ASP A 153 -10.840 -12.142 14.224 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.364 -10.271 15.246 1.00 0.00 C ATOM 1526 CG ASP A 153 -7.549 -10.041 16.515 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.504 -10.941 17.338 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -6.975 -8.972 16.643 1.00 0.00 O ATOM 0 H ASP A 153 -6.627 -11.819 14.402 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.009 -12.183 15.990 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.831 -9.872 14.382 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.313 -9.738 15.309 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.172 -12.042 12.718 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.044 -12.263 11.570 1.00 0.00 C ATOM 1535 C ALA A 154 -10.671 -13.649 11.631 1.00 0.00 C ATOM 1536 O ALA A 154 -11.815 -13.842 11.225 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.262 -12.101 10.266 1.00 0.00 C ATOM 0 H ALA A 154 -8.186 -11.927 12.482 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.839 -11.518 11.599 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -9.928 -12.269 9.419 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -8.852 -11.093 10.210 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.448 -12.826 10.237 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.915 -14.613 12.147 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.410 -15.981 12.255 1.00 0.00 C ATOM 1545 C LYS A 155 -11.609 -16.050 13.192 1.00 0.00 C ATOM 1546 O LYS A 155 -12.332 -17.049 13.218 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.300 -16.899 12.771 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.243 -17.080 11.682 1.00 0.00 C ATOM 1549 CD LYS A 155 -7.101 -17.944 12.217 1.00 0.00 C ATOM 1550 CE LYS A 155 -6.044 -18.129 11.127 1.00 0.00 C ATOM 1551 NZ LYS A 155 -4.923 -18.955 11.658 1.00 0.00 N ATOM 0 H LYS A 155 -8.966 -14.475 12.494 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.723 -16.311 11.264 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.847 -16.472 13.666 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.715 -17.866 13.054 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.687 -17.549 10.804 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -7.861 -16.109 11.366 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -6.656 -17.474 13.094 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -7.483 -18.914 12.535 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.485 -18.613 10.256 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -5.671 -17.159 10.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -4.204 -19.081 10.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -4.497 -18.476 12.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -5.285 -19.885 11.951 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.822 -14.987 13.957 1.00 0.00 N ATOM 1566 CA LYS A 156 -12.944 -14.938 14.888 1.00 0.00 C ATOM 1567 C LYS A 156 -14.184 -14.331 14.224 1.00 0.00 C ATOM 1568 O LYS A 156 -15.238 -14.223 14.851 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.554 -14.102 16.105 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.281 -14.677 16.739 1.00 0.00 C ATOM 1571 CD LYS A 156 -11.552 -16.082 17.279 1.00 0.00 C ATOM 1572 CE LYS A 156 -10.286 -16.614 17.948 1.00 0.00 C ATOM 1573 NZ LYS A 156 -10.553 -17.968 18.522 1.00 0.00 N ATOM 0 H LYS A 156 -11.237 -14.151 13.952 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.185 -15.956 15.195 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -12.389 -13.066 15.809 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.366 -14.100 16.833 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -10.481 -14.711 16.000 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -10.942 -14.028 17.546 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -12.374 -16.058 17.995 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -11.855 -16.744 16.468 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -9.475 -16.669 17.222 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -9.964 -15.932 18.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -9.690 -18.329 18.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -11.315 -17.902 19.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -10.840 -18.617 17.762 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.055 -13.934 12.958 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.170 -13.341 12.229 1.00 0.00 C ATOM 1589 C ILE A 157 -15.965 -14.413 11.488 1.00 0.00 C ATOM 1590 O ILE A 157 -15.403 -15.258 10.785 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.649 -12.313 11.232 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.963 -11.171 11.988 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.814 -11.763 10.410 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -13.218 -10.271 10.998 1.00 0.00 C ATOM 0 H ILE A 157 -13.192 -14.013 12.420 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.828 -12.853 12.948 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.929 -12.785 10.563 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.703 -10.589 12.537 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -13.266 -11.575 12.722 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.441 -11.028 9.697 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.296 -12.579 9.871 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.537 -11.290 11.075 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -12.731 -9.460 11.539 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -12.466 -10.856 10.469 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.926 -9.855 10.281 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.280 -14.375 11.648 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.141 -15.345 10.991 1.00 0.00 C ATOM 1608 C GLU A 158 -18.064 -15.182 9.480 1.00 0.00 C ATOM 1609 O GLU A 158 -17.996 -14.066 8.965 1.00 0.00 O ATOM 1610 CB GLU A 158 -19.581 -15.150 11.459 1.00 0.00 C ATOM 1611 CG GLU A 158 -19.632 -15.303 12.978 1.00 0.00 C ATOM 1612 CD GLU A 158 -21.065 -15.130 13.471 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -21.704 -14.180 13.052 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -21.501 -15.952 14.260 1.00 0.00 O ATOM 0 H GLU A 158 -17.770 -13.689 12.222 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.807 -16.349 11.252 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.942 -14.164 11.167 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -20.234 -15.882 10.984 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -19.255 -16.285 13.266 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.985 -14.563 13.448 1.00 0.00 H new ATOM 1621 N GLY A 159 -18.070 -16.304 8.774 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.992 -16.284 7.320 1.00 0.00 C ATOM 1623 C GLY A 159 -16.553 -16.477 6.842 1.00 0.00 C ATOM 1624 O GLY A 159 -16.319 -16.764 5.668 1.00 0.00 O ATOM 0 H GLY A 159 -18.128 -17.237 9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.624 -17.071 6.908 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.379 -15.336 6.945 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.591 -16.332 7.755 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.189 -16.505 7.395 1.00 0.00 C ATOM 1630 C VAL A 160 -13.858 -17.985 7.230 1.00 0.00 C ATOM 1631 O VAL A 160 -14.121 -18.793 8.119 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.299 -15.898 8.481 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -11.835 -16.215 8.174 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -13.500 -14.382 8.511 1.00 0.00 C ATOM 0 H VAL A 160 -15.756 -16.099 8.734 1.00 0.00 H new ATOM 0 HA VAL A 160 -14.007 -15.997 6.448 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.565 -16.319 9.451 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -11.199 -15.783 8.947 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -11.694 -17.296 8.150 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -11.567 -15.793 7.206 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -12.867 -13.946 9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -13.232 -13.960 7.542 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -14.544 -14.158 8.728 1.00 0.00 H new ATOM 1644 N SER A 161 -13.278 -18.329 6.085 1.00 0.00 N ATOM 1645 CA SER A 161 -12.907 -19.709 5.805 1.00 0.00 C ATOM 1646 C SER A 161 -11.450 -19.966 6.178 1.00 0.00 C ATOM 1647 O SER A 161 -11.140 -20.936 6.869 1.00 0.00 O ATOM 1648 CB SER A 161 -13.115 -20.015 4.321 1.00 0.00 C ATOM 1649 OG SER A 161 -12.593 -21.306 4.029 1.00 0.00 O ATOM 0 H SER A 161 -13.055 -17.671 5.338 1.00 0.00 H new ATOM 0 HA SER A 161 -13.542 -20.361 6.405 1.00 0.00 H new ATOM 0 HB2 SER A 161 -14.176 -19.975 4.075 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.618 -19.262 3.710 1.00 0.00 H new ATOM 0 HG SER A 161 -12.726 -21.506 3.079 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.559 -19.096 5.711 1.00 0.00 N ATOM 1656 CA GLU A 162 -9.133 -19.253 5.998 1.00 0.00 C ATOM 1657 C GLU A 162 -8.434 -17.903 6.022 1.00 0.00 C ATOM 1658 O GLU A 162 -8.757 -17.019 5.242 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.481 -20.148 4.944 1.00 0.00 C ATOM 1660 CG GLU A 162 -7.115 -20.615 5.448 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.007 -19.864 4.720 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -5.605 -18.821 5.208 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.577 -20.342 3.681 1.00 0.00 O ATOM 0 H GLU A 162 -10.793 -18.284 5.139 1.00 0.00 H new ATOM 0 HA GLU A 162 -9.033 -19.716 6.980 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.118 -21.008 4.737 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.368 -19.602 4.007 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -7.037 -20.445 6.522 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -7.006 -21.687 5.287 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.475 -17.746 6.923 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.747 -16.488 7.028 1.00 0.00 C ATOM 1672 C VAL A 163 -5.241 -16.731 7.011 1.00 0.00 C ATOM 1673 O VAL A 163 -4.736 -17.597 7.729 1.00 0.00 O ATOM 1674 CB VAL A 163 -7.134 -15.768 8.315 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -6.383 -14.441 8.403 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -8.639 -15.506 8.318 1.00 0.00 C ATOM 0 H VAL A 163 -7.184 -18.465 7.586 1.00 0.00 H new ATOM 0 HA VAL A 163 -7.010 -15.868 6.171 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.872 -16.389 9.172 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.660 -13.927 9.323 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -5.309 -14.630 8.402 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.643 -13.818 7.547 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.917 -14.991 9.238 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.902 -14.886 7.461 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -9.173 -16.454 8.257 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.529 -15.964 6.194 1.00 0.00 N ATOM 1687 CA GLN A 164 -3.086 -16.108 6.102 1.00 0.00 C ATOM 1688 C GLN A 164 -2.413 -14.740 6.094 1.00 0.00 C ATOM 1689 O GLN A 164 -2.966 -13.760 5.596 1.00 0.00 O ATOM 1690 CB GLN A 164 -2.710 -16.870 4.826 1.00 0.00 C ATOM 1691 CG GLN A 164 -3.046 -16.019 3.597 1.00 0.00 C ATOM 1692 CD GLN A 164 -2.702 -16.782 2.322 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -2.633 -18.011 2.329 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -2.470 -16.118 1.223 1.00 0.00 N ATOM 0 H GLN A 164 -4.925 -15.243 5.592 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.742 -16.669 6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -1.647 -17.110 4.834 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.250 -17.816 4.784 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -4.105 -15.762 3.602 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -2.490 -15.082 3.631 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -2.528 -15.100 1.221 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -2.231 -16.617 0.366 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.214 -14.695 6.644 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.445 -13.456 6.704 1.00 0.00 C ATOM 1705 C ASP A 165 0.377 -13.263 5.432 1.00 0.00 C ATOM 1706 O ASP A 165 0.224 -14.010 4.464 1.00 0.00 O ATOM 1707 CB ASP A 165 0.476 -13.466 7.927 1.00 0.00 C ATOM 1708 CG ASP A 165 1.492 -14.598 7.821 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.435 -15.335 6.850 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.312 -14.713 8.716 1.00 0.00 O ATOM 0 H ASP A 165 -0.747 -15.502 7.058 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.144 -12.624 6.790 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.994 -12.510 8.007 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.116 -13.585 8.835 1.00 0.00 H new ATOM 1715 N GLY A 166 1.240 -12.253 5.441 1.00 0.00 N ATOM 1716 CA GLY A 166 2.077 -11.965 4.280 1.00 0.00 C ATOM 1717 C GLY A 166 3.254 -12.933 4.199 1.00 0.00 C ATOM 1718 O GLY A 166 3.066 -14.148 4.151 1.00 0.00 O ATOM 0 H GLY A 166 1.379 -11.624 6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 166 1.480 -12.036 3.371 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.447 -10.941 4.339 1.00 0.00 H new