USER MOD reduce.3.24.130724 H: found=0, std=0, add=1173, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1172 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 96 THR OG1 : rot 94:sc= 0.18 USER MOD Set 1.2: A 97 ASN :FLIP amide:sc= 0.345 F(o=-0.19,f=0.53) USER MOD Set 2.1: A 79 SER OG : rot -159:sc= 0.494 USER MOD Set 2.2: A 82 THR OG1 : rot 87:sc= -2.8! USER MOD Set 3.1: A 51 MET CE :methyl -127:sc= -0.0626 (180deg=0) USER MOD Set 3.2: A 65 LYS NZ :NH3+ -177:sc= 0 (180deg=0) USER MOD Set 4.1: A 29 GLN : amide:sc= 0.976 K(o=2.1,f=-7.8!) USER MOD Set 4.2: A 31 LYS NZ :NH3+ 165:sc= 1.15 (180deg=0) USER MOD Single : A 1 PHE N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= -1.11 USER MOD Single : A 23 TYR OH : rot 171:sc= -1.58! USER MOD Single : A 24 SER OG : rot -65:sc= -1.06! USER MOD Single : A 27 SER OG : rot -84:sc= 0.248 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 34 GLN : amide:sc= -2.33 X(o=-2.3,f=-2.2!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.6) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0351 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 176:sc= -2.19! (180deg=-2.34!) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.464 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000892) USER MOD Single : A 83 SER OG : rot -41:sc= 0.725 USER MOD Single : A 84 ASN : amide:sc= -0.125 X(o=-0.13,f=-0.41) USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : A 92 ASN : amide:sc= 0.0044 X(o=0.0044,f=-0.045) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -59:sc= 0.915 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -137:sc= -2.55 (180deg=-5.55!) USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 18:sc= 0.0415 USER MOD Single : A 112 HIS : no HE2:sc= -4.41! C(o=-4.4!,f=-13!) USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 45:sc= 0.431 USER MOD Single : B 1 GLN : amide:sc=-0.00092 X(o=-0.00092,f=0) USER MOD Single : B 1 GLN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.00788) USER MOD Single : B 3 THR OG1 : rot 180:sc= 0.0128 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 SER OG : rot -164:sc= 0.425 USER MOD Single : B 10 SER OG : rot 174:sc= 0.474 USER MOD Single : B 21 THR OG1 : rot 55:sc= 0.22 USER MOD Single : B 22 SER OG : rot 180:sc= -0.0835 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 -8.424 -34.571 18.742 1.00 0.00 N ATOM 2 CA PHE A 1 -8.657 -33.880 17.441 1.00 0.00 C ATOM 3 C PHE A 1 -7.343 -33.283 16.913 1.00 0.00 C ATOM 4 O PHE A 1 -7.123 -32.088 17.002 1.00 0.00 O ATOM 5 CB PHE A 1 -9.664 -32.773 17.756 1.00 0.00 C ATOM 6 CG PHE A 1 -10.429 -32.416 16.504 1.00 0.00 C ATOM 7 CD1 PHE A 1 -9.926 -31.446 15.629 1.00 0.00 C ATOM 8 CD2 PHE A 1 -11.642 -33.055 16.218 1.00 0.00 C ATOM 9 CE1 PHE A 1 -10.634 -31.115 14.468 1.00 0.00 C ATOM 10 CE2 PHE A 1 -12.350 -32.724 15.057 1.00 0.00 C ATOM 11 CZ PHE A 1 -11.847 -31.754 14.183 1.00 0.00 C ATOM 0 H1 PHE A 1 -9.320 -34.970 19.088 1.00 0.00 H new ATOM 0 H2 PHE A 1 -7.732 -35.336 18.610 1.00 0.00 H new ATOM 0 H3 PHE A 1 -8.057 -33.889 19.436 1.00 0.00 H new ATOM 0 HA PHE A 1 -9.026 -34.559 16.672 1.00 0.00 H new ATOM 0 HB2 PHE A 1 -10.353 -33.104 18.534 1.00 0.00 H new ATOM 0 HB3 PHE A 1 -9.146 -31.895 18.141 1.00 0.00 H new ATOM 0 HD1 PHE A 1 -8.991 -30.953 15.850 1.00 0.00 H new ATOM 0 HD2 PHE A 1 -12.031 -33.803 16.893 1.00 0.00 H new ATOM 0 HE1 PHE A 1 -10.245 -30.367 13.792 1.00 0.00 H new ATOM 0 HE2 PHE A 1 -13.285 -33.217 14.836 1.00 0.00 H new ATOM 0 HZ PHE A 1 -12.395 -31.498 13.288 1.00 0.00 H new ATOM 23 N ALA A 2 -6.465 -34.099 16.365 1.00 0.00 N ATOM 24 CA ALA A 2 -5.172 -33.564 15.838 1.00 0.00 C ATOM 25 C ALA A 2 -4.757 -34.328 14.570 1.00 0.00 C ATOM 26 O ALA A 2 -3.593 -34.629 14.380 1.00 0.00 O ATOM 27 CB ALA A 2 -4.161 -33.800 16.960 1.00 0.00 C ATOM 0 H ALA A 2 -6.592 -35.106 16.263 1.00 0.00 H new ATOM 0 HA ALA A 2 -5.241 -32.511 15.565 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.182 -33.433 16.651 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -4.481 -33.268 17.856 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.098 -34.867 17.174 1.00 0.00 H new ATOM 33 N LYS A 3 -5.695 -34.645 13.699 1.00 0.00 N ATOM 34 CA LYS A 3 -5.338 -35.387 12.453 1.00 0.00 C ATOM 35 C LYS A 3 -6.196 -34.895 11.276 1.00 0.00 C ATOM 36 O LYS A 3 -7.383 -35.160 11.220 1.00 0.00 O ATOM 37 CB LYS A 3 -5.645 -36.852 12.764 1.00 0.00 C ATOM 38 CG LYS A 3 -4.579 -37.745 12.123 1.00 0.00 C ATOM 39 CD LYS A 3 -5.038 -38.165 10.725 1.00 0.00 C ATOM 40 CE LYS A 3 -5.802 -39.488 10.814 1.00 0.00 C ATOM 41 NZ LYS A 3 -6.329 -39.721 9.440 1.00 0.00 N ATOM 0 H LYS A 3 -6.685 -34.421 13.802 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.296 -35.239 12.169 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.666 -37.009 13.842 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.632 -37.116 12.384 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -3.631 -37.210 12.061 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.408 -38.626 12.741 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -5.675 -37.393 10.293 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.177 -38.274 10.065 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -5.148 -40.301 11.129 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.611 -39.429 11.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -6.866 -40.612 9.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.953 -38.934 9.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -5.536 -39.780 8.769 1.00 0.00 H new ATOM 55 N LEU A 4 -5.611 -34.181 10.334 1.00 0.00 N ATOM 56 CA LEU A 4 -6.403 -33.681 9.171 1.00 0.00 C ATOM 57 C LEU A 4 -5.632 -33.918 7.863 1.00 0.00 C ATOM 58 O LEU A 4 -4.436 -34.141 7.880 1.00 0.00 O ATOM 59 CB LEU A 4 -6.580 -32.184 9.427 1.00 0.00 C ATOM 60 CG LEU A 4 -7.967 -31.745 8.956 1.00 0.00 C ATOM 61 CD1 LEU A 4 -8.972 -31.914 10.097 1.00 0.00 C ATOM 62 CD2 LEU A 4 -7.919 -30.276 8.533 1.00 0.00 C ATOM 0 H LEU A 4 -4.623 -33.927 10.326 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.360 -34.193 9.072 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.460 -31.970 10.489 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.810 -31.621 8.899 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.274 -32.359 8.109 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -9.960 -31.601 9.761 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -9.006 -32.961 10.400 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -8.666 -31.301 10.945 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.907 -29.962 8.197 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -7.612 -29.663 9.381 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.204 -30.155 7.720 1.00 0.00 H new ATOM 74 N VAL A 5 -6.303 -33.873 6.729 1.00 0.00 N ATOM 75 CA VAL A 5 -5.596 -34.098 5.431 1.00 0.00 C ATOM 76 C VAL A 5 -6.070 -33.072 4.384 1.00 0.00 C ATOM 77 O VAL A 5 -6.412 -33.429 3.272 1.00 0.00 O ATOM 78 CB VAL A 5 -5.972 -35.528 5.021 1.00 0.00 C ATOM 79 CG1 VAL A 5 -7.490 -35.647 4.854 1.00 0.00 C ATOM 80 CG2 VAL A 5 -5.286 -35.880 3.697 1.00 0.00 C ATOM 0 H VAL A 5 -7.304 -33.691 6.652 1.00 0.00 H new ATOM 0 HA VAL A 5 -4.516 -33.976 5.514 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.643 -36.217 5.799 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -7.745 -36.666 4.563 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -7.980 -35.406 5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -7.827 -34.954 4.083 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -5.554 -36.896 3.407 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -5.610 -35.184 2.923 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -4.205 -35.810 3.818 1.00 0.00 H new ATOM 90 N ARG A 6 -6.094 -31.800 4.729 1.00 0.00 N ATOM 91 CA ARG A 6 -6.545 -30.767 3.749 1.00 0.00 C ATOM 92 C ARG A 6 -5.526 -29.617 3.683 1.00 0.00 C ATOM 93 O ARG A 6 -4.887 -29.312 4.670 1.00 0.00 O ATOM 94 CB ARG A 6 -7.883 -30.265 4.291 1.00 0.00 C ATOM 95 CG ARG A 6 -9.021 -31.100 3.698 1.00 0.00 C ATOM 96 CD ARG A 6 -9.290 -32.308 4.599 1.00 0.00 C ATOM 97 NE ARG A 6 -10.380 -31.869 5.515 1.00 0.00 N ATOM 98 CZ ARG A 6 -11.616 -31.851 5.097 1.00 0.00 C ATOM 99 NH1 ARG A 6 -12.239 -32.972 4.857 1.00 0.00 N ATOM 100 NH2 ARG A 6 -12.230 -30.713 4.920 1.00 0.00 N ATOM 0 H ARG A 6 -5.821 -31.440 5.644 1.00 0.00 H new ATOM 0 HA ARG A 6 -6.638 -31.168 2.740 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.896 -30.334 5.379 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -8.019 -29.214 4.037 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -9.922 -30.493 3.606 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -8.757 -31.433 2.694 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -9.591 -33.177 4.015 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -8.397 -32.592 5.156 1.00 0.00 H new ATOM 0 HE ARG A 6 -10.160 -31.583 6.469 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -11.760 -33.862 4.996 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -13.205 -32.959 4.530 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.744 -29.836 5.108 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -13.196 -30.700 4.593 1.00 0.00 H new ATOM 114 N PRO A 7 -5.399 -29.011 2.521 1.00 0.00 N ATOM 115 CA PRO A 7 -4.438 -27.890 2.364 1.00 0.00 C ATOM 116 C PRO A 7 -4.970 -26.627 3.065 1.00 0.00 C ATOM 117 O PRO A 7 -6.103 -26.245 2.847 1.00 0.00 O ATOM 118 CB PRO A 7 -4.373 -27.681 0.852 1.00 0.00 C ATOM 119 CG PRO A 7 -5.671 -28.206 0.329 1.00 0.00 C ATOM 120 CD PRO A 7 -6.117 -29.297 1.266 1.00 0.00 C ATOM 0 HA PRO A 7 -3.463 -28.098 2.804 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -4.246 -26.627 0.605 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -3.528 -28.214 0.416 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -6.416 -27.412 0.280 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -5.550 -28.593 -0.683 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -7.197 -29.280 1.412 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -5.864 -30.284 0.878 1.00 0.00 H new ATOM 128 N PRO A 8 -4.146 -26.007 3.888 1.00 0.00 N ATOM 129 CA PRO A 8 -4.586 -24.782 4.601 1.00 0.00 C ATOM 130 C PRO A 8 -4.625 -23.585 3.636 1.00 0.00 C ATOM 131 O PRO A 8 -4.334 -23.723 2.463 1.00 0.00 O ATOM 132 CB PRO A 8 -3.515 -24.580 5.670 1.00 0.00 C ATOM 133 CG PRO A 8 -2.295 -25.257 5.133 1.00 0.00 C ATOM 134 CD PRO A 8 -2.759 -26.371 4.232 1.00 0.00 C ATOM 0 HA PRO A 8 -5.588 -24.870 5.021 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.331 -23.521 5.849 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.821 -25.015 6.621 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -1.675 -24.550 4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.685 -25.650 5.946 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.135 -26.448 3.341 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.714 -27.336 4.737 1.00 0.00 H new ATOM 142 N VAL A 9 -4.978 -22.410 4.119 1.00 0.00 N ATOM 143 CA VAL A 9 -5.027 -21.213 3.219 1.00 0.00 C ATOM 144 C VAL A 9 -4.728 -19.928 4.013 1.00 0.00 C ATOM 145 O VAL A 9 -5.552 -19.461 4.778 1.00 0.00 O ATOM 146 CB VAL A 9 -6.452 -21.181 2.646 1.00 0.00 C ATOM 147 CG1 VAL A 9 -6.687 -22.434 1.799 1.00 0.00 C ATOM 148 CG2 VAL A 9 -7.485 -21.124 3.785 1.00 0.00 C ATOM 0 H VAL A 9 -5.232 -22.233 5.091 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.280 -21.273 2.427 1.00 0.00 H new ATOM 0 HB VAL A 9 -6.566 -20.292 2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -7.698 -22.413 1.391 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -5.967 -22.461 0.982 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -6.564 -23.321 2.420 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -8.490 -21.102 3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -7.377 -22.004 4.419 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -7.321 -20.226 4.380 1.00 0.00 H new ATOM 158 N GLN A 10 -3.556 -19.350 3.840 1.00 0.00 N ATOM 159 CA GLN A 10 -3.218 -18.103 4.591 1.00 0.00 C ATOM 160 C GLN A 10 -2.999 -16.935 3.618 1.00 0.00 C ATOM 161 O GLN A 10 -3.644 -15.909 3.729 1.00 0.00 O ATOM 162 CB GLN A 10 -1.925 -18.431 5.338 1.00 0.00 C ATOM 163 CG GLN A 10 -2.198 -19.539 6.356 1.00 0.00 C ATOM 164 CD GLN A 10 -1.105 -19.530 7.431 1.00 0.00 C ATOM 165 OE1 GLN A 10 0.058 -19.705 7.127 1.00 0.00 O ATOM 166 NE2 GLN A 10 -1.425 -19.332 8.688 1.00 0.00 N ATOM 0 H GLN A 10 -2.827 -19.690 3.213 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.016 -17.801 5.269 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -1.155 -18.749 4.635 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.547 -17.542 5.843 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.175 -19.392 6.816 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.223 -20.508 5.857 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -2.400 -19.184 8.949 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -0.699 -19.326 9.404 1.00 0.00 H new ATOM 175 N ILE A 11 -2.101 -17.076 2.663 1.00 0.00 N ATOM 176 CA ILE A 11 -1.862 -15.965 1.696 1.00 0.00 C ATOM 177 C ILE A 11 -2.080 -16.467 0.257 1.00 0.00 C ATOM 178 O ILE A 11 -1.865 -17.629 -0.036 1.00 0.00 O ATOM 179 CB ILE A 11 -0.430 -15.513 1.961 1.00 0.00 C ATOM 180 CG1 ILE A 11 -0.165 -14.210 1.203 1.00 0.00 C ATOM 181 CG2 ILE A 11 0.569 -16.589 1.522 1.00 0.00 C ATOM 182 CD1 ILE A 11 -0.405 -13.015 2.134 1.00 0.00 C ATOM 0 H ILE A 11 -1.531 -17.909 2.518 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.550 -15.129 1.818 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.302 -15.348 3.031 1.00 0.00 H new ATOM 0 HG12 ILE A 11 0.860 -14.195 0.832 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.819 -14.144 0.334 1.00 0.00 H new ATOM 0 HG21 ILE A 11 1.584 -16.245 1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 11 0.382 -17.508 2.078 1.00 0.00 H new ATOM 0 HG23 ILE A 11 0.452 -16.780 0.455 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.216 -12.088 1.592 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -1.438 -13.027 2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.268 -13.079 2.989 1.00 0.00 H new ATOM 194 N TYR A 12 -2.581 -15.622 -0.622 1.00 0.00 N ATOM 195 CA TYR A 12 -2.900 -16.083 -2.015 1.00 0.00 C ATOM 196 C TYR A 12 -2.829 -14.911 -3.005 1.00 0.00 C ATOM 197 O TYR A 12 -3.833 -14.283 -3.290 1.00 0.00 O ATOM 198 CB TYR A 12 -4.357 -16.638 -1.960 1.00 0.00 C ATOM 199 CG TYR A 12 -5.104 -16.098 -0.744 1.00 0.00 C ATOM 200 CD1 TYR A 12 -4.934 -16.722 0.496 1.00 0.00 C ATOM 201 CD2 TYR A 12 -5.912 -14.960 -0.848 1.00 0.00 C ATOM 202 CE1 TYR A 12 -5.562 -16.218 1.631 1.00 0.00 C ATOM 203 CE2 TYR A 12 -6.547 -14.451 0.293 1.00 0.00 C ATOM 204 CZ TYR A 12 -6.369 -15.080 1.535 1.00 0.00 C ATOM 205 OH TYR A 12 -6.995 -14.578 2.658 1.00 0.00 O ATOM 0 H TYR A 12 -2.781 -14.639 -0.435 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.188 -16.837 -2.351 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -4.889 -16.362 -2.870 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -4.334 -17.727 -1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.311 -17.601 0.573 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -6.046 -14.476 -1.804 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -5.426 -16.705 2.585 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -7.173 -13.575 0.217 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.516 -13.784 2.415 1.00 0.00 H new ATOM 215 N GLY A 13 -1.664 -14.611 -3.538 1.00 0.00 N ATOM 216 CA GLY A 13 -1.559 -13.487 -4.508 1.00 0.00 C ATOM 217 C GLY A 13 -0.289 -12.677 -4.228 1.00 0.00 C ATOM 218 O GLY A 13 -0.161 -12.068 -3.183 1.00 0.00 O ATOM 0 H GLY A 13 -0.790 -15.098 -3.340 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.537 -13.874 -5.527 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.436 -12.844 -4.430 1.00 0.00 H new ATOM 222 N ILE A 14 0.655 -12.660 -5.155 1.00 0.00 N ATOM 223 CA ILE A 14 1.930 -11.870 -4.934 1.00 0.00 C ATOM 224 C ILE A 14 1.606 -10.439 -4.431 1.00 0.00 C ATOM 225 O ILE A 14 2.345 -9.879 -3.644 1.00 0.00 O ATOM 226 CB ILE A 14 2.672 -11.856 -6.301 1.00 0.00 C ATOM 227 CG1 ILE A 14 4.170 -11.584 -6.084 1.00 0.00 C ATOM 228 CG2 ILE A 14 2.083 -10.804 -7.255 1.00 0.00 C ATOM 229 CD1 ILE A 14 4.385 -10.208 -5.445 1.00 0.00 C ATOM 0 H ILE A 14 0.601 -13.153 -6.046 1.00 0.00 H new ATOM 0 HA ILE A 14 2.558 -12.320 -4.166 1.00 0.00 H new ATOM 0 HB ILE A 14 2.541 -12.836 -6.760 1.00 0.00 H new ATOM 0 HG12 ILE A 14 4.596 -12.357 -5.445 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.695 -11.633 -7.038 1.00 0.00 H new ATOM 0 HG21 ILE A 14 2.627 -10.824 -8.199 1.00 0.00 H new ATOM 0 HG22 ILE A 14 1.032 -11.026 -7.437 1.00 0.00 H new ATOM 0 HG23 ILE A 14 2.172 -9.815 -6.806 1.00 0.00 H new ATOM 0 HD11 ILE A 14 5.452 -10.037 -5.301 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.979 -9.436 -6.098 1.00 0.00 H new ATOM 0 HD13 ILE A 14 3.878 -10.171 -4.481 1.00 0.00 H new ATOM 241 N GLU A 15 0.498 -9.855 -4.862 1.00 0.00 N ATOM 242 CA GLU A 15 0.144 -8.470 -4.370 1.00 0.00 C ATOM 243 C GLU A 15 0.097 -8.460 -2.830 1.00 0.00 C ATOM 244 O GLU A 15 0.469 -7.488 -2.209 1.00 0.00 O ATOM 245 CB GLU A 15 -1.244 -8.115 -4.945 1.00 0.00 C ATOM 246 CG GLU A 15 -1.224 -6.684 -5.492 1.00 0.00 C ATOM 247 CD GLU A 15 -2.655 -6.224 -5.784 1.00 0.00 C ATOM 248 OE1 GLU A 15 -3.466 -7.062 -6.144 1.00 0.00 O ATOM 249 OE2 GLU A 15 -2.915 -5.040 -5.643 1.00 0.00 O ATOM 0 H GLU A 15 -0.163 -10.268 -5.519 1.00 0.00 H new ATOM 0 HA GLU A 15 0.889 -7.742 -4.693 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.510 -8.814 -5.738 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.004 -8.208 -4.170 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -0.757 -6.015 -4.770 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.625 -6.640 -6.401 1.00 0.00 H new ATOM 256 N GLY A 16 -0.346 -9.537 -2.206 1.00 0.00 N ATOM 257 CA GLY A 16 -0.391 -9.570 -0.711 1.00 0.00 C ATOM 258 C GLY A 16 1.024 -9.349 -0.147 1.00 0.00 C ATOM 259 O GLY A 16 1.192 -8.688 0.862 1.00 0.00 O ATOM 0 H GLY A 16 -0.674 -10.384 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.066 -8.798 -0.340 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.784 -10.528 -0.370 1.00 0.00 H new ATOM 263 N ARG A 17 2.048 -9.885 -0.788 1.00 0.00 N ATOM 264 CA ARG A 17 3.450 -9.678 -0.268 1.00 0.00 C ATOM 265 C ARG A 17 3.776 -8.181 -0.165 1.00 0.00 C ATOM 266 O ARG A 17 4.556 -7.785 0.677 1.00 0.00 O ATOM 267 CB ARG A 17 4.402 -10.358 -1.266 1.00 0.00 C ATOM 268 CG ARG A 17 4.275 -11.878 -1.139 1.00 0.00 C ATOM 269 CD ARG A 17 5.358 -12.553 -1.984 1.00 0.00 C ATOM 270 NE ARG A 17 4.796 -13.887 -2.335 1.00 0.00 N ATOM 271 CZ ARG A 17 5.422 -14.973 -1.974 1.00 0.00 C ATOM 272 NH1 ARG A 17 6.659 -15.167 -2.344 1.00 0.00 N ATOM 273 NH2 ARG A 17 4.811 -15.868 -1.246 1.00 0.00 N ATOM 0 H ARG A 17 1.976 -10.448 -1.635 1.00 0.00 H new ATOM 0 HA ARG A 17 3.555 -10.104 0.730 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.163 -10.046 -2.283 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.430 -10.051 -1.072 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.375 -12.176 -0.095 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.287 -12.200 -1.469 1.00 0.00 H new ATOM 0 HD2 ARG A 17 5.581 -11.971 -2.878 1.00 0.00 H new ATOM 0 HD3 ARG A 17 6.290 -12.651 -1.427 1.00 0.00 H new ATOM 0 HE ARG A 17 3.922 -13.951 -2.857 1.00 0.00 H new ATOM 0 HH11 ARG A 17 7.136 -14.469 -2.915 1.00 0.00 H new ATOM 0 HH12 ARG A 17 7.149 -16.016 -2.062 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.844 -15.718 -0.959 1.00 0.00 H new ATOM 0 HH22 ARG A 17 5.301 -16.717 -0.964 1.00 0.00 H new ATOM 287 N TYR A 18 3.187 -7.331 -0.993 1.00 0.00 N ATOM 288 CA TYR A 18 3.494 -5.854 -0.879 1.00 0.00 C ATOM 289 C TYR A 18 3.234 -5.386 0.563 1.00 0.00 C ATOM 290 O TYR A 18 3.977 -4.588 1.102 1.00 0.00 O ATOM 291 CB TYR A 18 2.545 -5.117 -1.842 1.00 0.00 C ATOM 292 CG TYR A 18 3.150 -5.019 -3.227 1.00 0.00 C ATOM 293 CD1 TYR A 18 3.772 -6.129 -3.818 1.00 0.00 C ATOM 294 CD2 TYR A 18 3.071 -3.809 -3.927 1.00 0.00 C ATOM 295 CE1 TYR A 18 4.315 -6.026 -5.104 1.00 0.00 C ATOM 296 CE2 TYR A 18 3.615 -3.706 -5.212 1.00 0.00 C ATOM 297 CZ TYR A 18 4.237 -4.814 -5.801 1.00 0.00 C ATOM 298 OH TYR A 18 4.771 -4.713 -7.069 1.00 0.00 O ATOM 0 H TYR A 18 2.524 -7.587 -1.724 1.00 0.00 H new ATOM 0 HA TYR A 18 4.535 -5.650 -1.128 1.00 0.00 H new ATOM 0 HB2 TYR A 18 1.592 -5.643 -1.894 1.00 0.00 H new ATOM 0 HB3 TYR A 18 2.337 -4.118 -1.460 1.00 0.00 H new ATOM 0 HD1 TYR A 18 3.832 -7.064 -3.280 1.00 0.00 H new ATOM 0 HD2 TYR A 18 2.590 -2.954 -3.475 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.794 -6.881 -5.558 1.00 0.00 H new ATOM 0 HE2 TYR A 18 3.555 -2.771 -5.750 1.00 0.00 H new ATOM 0 HH TYR A 18 4.631 -3.806 -7.412 1.00 0.00 H new ATOM 308 N ALA A 19 2.193 -5.893 1.198 1.00 0.00 N ATOM 309 CA ALA A 19 1.918 -5.478 2.616 1.00 0.00 C ATOM 310 C ALA A 19 2.947 -6.122 3.549 1.00 0.00 C ATOM 311 O ALA A 19 3.421 -5.491 4.476 1.00 0.00 O ATOM 312 CB ALA A 19 0.509 -5.976 2.972 1.00 0.00 C ATOM 0 H ALA A 19 1.535 -6.564 0.802 1.00 0.00 H new ATOM 0 HA ALA A 19 1.984 -4.395 2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.271 -5.693 3.998 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -0.217 -5.527 2.294 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.472 -7.061 2.877 1.00 0.00 H new ATOM 318 N THR A 20 3.308 -7.371 3.316 1.00 0.00 N ATOM 319 CA THR A 20 4.319 -8.018 4.216 1.00 0.00 C ATOM 320 C THR A 20 5.722 -7.483 3.916 1.00 0.00 C ATOM 321 O THR A 20 6.528 -7.339 4.817 1.00 0.00 O ATOM 322 CB THR A 20 4.236 -9.537 3.994 1.00 0.00 C ATOM 323 OG1 THR A 20 3.381 -9.816 2.890 1.00 0.00 O ATOM 324 CG2 THR A 20 3.674 -10.192 5.259 1.00 0.00 C ATOM 0 H THR A 20 2.953 -7.955 2.559 1.00 0.00 H new ATOM 0 HA THR A 20 4.110 -7.788 5.261 1.00 0.00 H new ATOM 0 HB THR A 20 5.229 -9.933 3.782 1.00 0.00 H new ATOM 0 HG1 THR A 20 3.332 -10.785 2.751 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.611 -11.270 5.113 1.00 0.00 H new ATOM 0 HG22 THR A 20 4.331 -9.978 6.102 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.680 -9.795 5.464 1.00 0.00 H new ATOM 332 N ALA A 21 6.025 -7.151 2.677 1.00 0.00 N ATOM 333 CA ALA A 21 7.385 -6.586 2.389 1.00 0.00 C ATOM 334 C ALA A 21 7.466 -5.126 2.870 1.00 0.00 C ATOM 335 O ALA A 21 8.550 -4.599 3.036 1.00 0.00 O ATOM 336 CB ALA A 21 7.599 -6.670 0.870 1.00 0.00 C ATOM 0 H ALA A 21 5.405 -7.244 1.872 1.00 0.00 H new ATOM 0 HA ALA A 21 8.159 -7.146 2.914 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.580 -6.268 0.618 1.00 0.00 H new ATOM 0 HB2 ALA A 21 7.541 -7.711 0.551 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.828 -6.091 0.361 1.00 0.00 H new ATOM 342 N LEU A 22 6.345 -4.469 3.133 1.00 0.00 N ATOM 343 CA LEU A 22 6.420 -3.062 3.640 1.00 0.00 C ATOM 344 C LEU A 22 6.245 -3.092 5.151 1.00 0.00 C ATOM 345 O LEU A 22 7.026 -2.500 5.877 1.00 0.00 O ATOM 346 CB LEU A 22 5.278 -2.286 2.975 1.00 0.00 C ATOM 347 CG LEU A 22 5.322 -0.822 3.437 1.00 0.00 C ATOM 348 CD1 LEU A 22 6.028 0.030 2.381 1.00 0.00 C ATOM 349 CD2 LEU A 22 3.896 -0.306 3.646 1.00 0.00 C ATOM 0 H LEU A 22 5.404 -4.845 3.018 1.00 0.00 H new ATOM 0 HA LEU A 22 7.374 -2.587 3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.370 -2.340 1.890 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.319 -2.733 3.236 1.00 0.00 H new ATOM 0 HG LEU A 22 5.870 -0.757 4.377 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.058 1.068 2.712 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.045 -0.335 2.240 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.485 -0.035 1.438 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.929 0.733 3.974 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.344 -0.373 2.709 1.00 0.00 H new ATOM 0 HD23 LEU A 22 3.398 -0.910 4.405 1.00 0.00 H new ATOM 361 N TYR A 23 5.257 -3.809 5.645 1.00 0.00 N ATOM 362 CA TYR A 23 5.103 -3.890 7.119 1.00 0.00 C ATOM 363 C TYR A 23 6.235 -4.776 7.696 1.00 0.00 C ATOM 364 O TYR A 23 6.493 -4.709 8.877 1.00 0.00 O ATOM 365 CB TYR A 23 3.661 -4.421 7.396 1.00 0.00 C ATOM 366 CG TYR A 23 3.660 -5.775 8.061 1.00 0.00 C ATOM 367 CD1 TYR A 23 4.099 -5.910 9.380 1.00 0.00 C ATOM 368 CD2 TYR A 23 3.229 -6.884 7.347 1.00 0.00 C ATOM 369 CE1 TYR A 23 4.111 -7.164 9.985 1.00 0.00 C ATOM 370 CE2 TYR A 23 3.238 -8.140 7.942 1.00 0.00 C ATOM 371 CZ TYR A 23 3.682 -8.289 9.265 1.00 0.00 C ATOM 372 OH TYR A 23 3.691 -9.535 9.857 1.00 0.00 O ATOM 0 H TYR A 23 4.570 -4.327 5.097 1.00 0.00 H new ATOM 0 HA TYR A 23 5.203 -2.926 7.617 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.131 -3.709 8.029 1.00 0.00 H new ATOM 0 HB3 TYR A 23 3.113 -4.482 6.456 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.429 -5.042 9.931 1.00 0.00 H new ATOM 0 HD2 TYR A 23 2.887 -6.771 6.329 1.00 0.00 H new ATOM 0 HE1 TYR A 23 4.449 -7.270 11.005 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.903 -9.003 7.385 1.00 0.00 H new ATOM 0 HH TYR A 23 3.231 -10.176 9.276 1.00 0.00 H new ATOM 382 N SER A 24 6.936 -5.584 6.889 1.00 0.00 N ATOM 383 CA SER A 24 8.064 -6.414 7.473 1.00 0.00 C ATOM 384 C SER A 24 8.985 -5.494 8.296 1.00 0.00 C ATOM 385 O SER A 24 9.441 -5.860 9.364 1.00 0.00 O ATOM 386 CB SER A 24 8.830 -7.026 6.291 1.00 0.00 C ATOM 387 OG SER A 24 10.200 -7.171 6.644 1.00 0.00 O ATOM 0 H SER A 24 6.778 -5.697 5.888 1.00 0.00 H new ATOM 0 HA SER A 24 7.691 -7.201 8.128 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.405 -7.995 6.030 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.734 -6.389 5.412 1.00 0.00 H new ATOM 0 HG SER A 24 10.598 -6.286 6.782 1.00 0.00 H new ATOM 393 N ALA A 25 9.195 -4.270 7.840 1.00 0.00 N ATOM 394 CA ALA A 25 10.009 -3.310 8.649 1.00 0.00 C ATOM 395 C ALA A 25 9.104 -2.767 9.767 1.00 0.00 C ATOM 396 O ALA A 25 9.530 -2.618 10.896 1.00 0.00 O ATOM 397 CB ALA A 25 10.445 -2.181 7.702 1.00 0.00 C ATOM 0 H ALA A 25 8.841 -3.906 6.955 1.00 0.00 H new ATOM 0 HA ALA A 25 10.889 -3.773 9.095 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.044 -1.455 8.252 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.038 -2.598 6.888 1.00 0.00 H new ATOM 0 HB3 ALA A 25 9.563 -1.688 7.293 1.00 0.00 H new ATOM 403 N ALA A 26 7.837 -2.496 9.469 1.00 0.00 N ATOM 404 CA ALA A 26 6.908 -1.996 10.544 1.00 0.00 C ATOM 405 C ALA A 26 6.822 -3.034 11.678 1.00 0.00 C ATOM 406 O ALA A 26 6.746 -2.678 12.838 1.00 0.00 O ATOM 407 CB ALA A 26 5.525 -1.817 9.891 1.00 0.00 C ATOM 0 H ALA A 26 7.419 -2.599 8.544 1.00 0.00 H new ATOM 0 HA ALA A 26 7.264 -1.057 10.968 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.816 -1.455 10.635 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.598 -1.096 9.077 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.182 -2.774 9.498 1.00 0.00 H new ATOM 413 N SER A 27 6.838 -4.320 11.357 1.00 0.00 N ATOM 414 CA SER A 27 6.762 -5.365 12.441 1.00 0.00 C ATOM 415 C SER A 27 7.910 -5.153 13.440 1.00 0.00 C ATOM 416 O SER A 27 7.717 -5.252 14.638 1.00 0.00 O ATOM 417 CB SER A 27 6.904 -6.732 11.753 1.00 0.00 C ATOM 418 OG SER A 27 8.283 -7.056 11.636 1.00 0.00 O ATOM 0 H SER A 27 6.899 -4.683 10.406 1.00 0.00 H new ATOM 0 HA SER A 27 5.821 -5.303 12.987 1.00 0.00 H new ATOM 0 HB2 SER A 27 6.386 -7.498 12.330 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.439 -6.706 10.767 1.00 0.00 H new ATOM 0 HG SER A 27 8.650 -6.639 10.828 1.00 0.00 H new ATOM 424 N LYS A 28 9.099 -4.838 12.962 1.00 0.00 N ATOM 425 CA LYS A 28 10.240 -4.595 13.915 1.00 0.00 C ATOM 426 C LYS A 28 9.913 -3.377 14.796 1.00 0.00 C ATOM 427 O LYS A 28 10.199 -3.371 15.978 1.00 0.00 O ATOM 428 CB LYS A 28 11.490 -4.312 13.062 1.00 0.00 C ATOM 429 CG LYS A 28 12.236 -5.622 12.801 1.00 0.00 C ATOM 430 CD LYS A 28 11.593 -6.352 11.620 1.00 0.00 C ATOM 431 CE LYS A 28 12.243 -7.728 11.452 1.00 0.00 C ATOM 432 NZ LYS A 28 12.380 -7.911 9.981 1.00 0.00 N ATOM 0 H LYS A 28 9.326 -4.740 11.972 1.00 0.00 H new ATOM 0 HA LYS A 28 10.407 -5.455 14.564 1.00 0.00 H new ATOM 0 HB2 LYS A 28 11.202 -3.851 12.117 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.142 -3.606 13.576 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.285 -5.418 12.588 1.00 0.00 H new ATOM 0 HG3 LYS A 28 12.208 -6.252 13.690 1.00 0.00 H new ATOM 0 HD2 LYS A 28 10.522 -6.463 11.787 1.00 0.00 H new ATOM 0 HD3 LYS A 28 11.714 -5.767 10.708 1.00 0.00 H new ATOM 0 HE2 LYS A 28 13.213 -7.770 11.947 1.00 0.00 H new ATOM 0 HE3 LYS A 28 11.627 -8.512 11.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 12.819 -8.833 9.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 11.440 -7.873 9.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 12.977 -7.154 9.591 1.00 0.00 H new ATOM 446 N GLN A 29 9.297 -2.349 14.236 1.00 0.00 N ATOM 447 CA GLN A 29 8.941 -1.147 15.068 1.00 0.00 C ATOM 448 C GLN A 29 7.536 -1.286 15.698 1.00 0.00 C ATOM 449 O GLN A 29 7.119 -0.425 16.447 1.00 0.00 O ATOM 450 CB GLN A 29 8.977 0.056 14.114 1.00 0.00 C ATOM 451 CG GLN A 29 10.431 0.427 13.815 1.00 0.00 C ATOM 452 CD GLN A 29 10.477 1.408 12.637 1.00 0.00 C ATOM 453 OE1 GLN A 29 10.209 2.581 12.803 1.00 0.00 O ATOM 454 NE2 GLN A 29 10.808 0.980 11.443 1.00 0.00 N ATOM 0 H GLN A 29 9.030 -2.293 13.253 1.00 0.00 H new ATOM 0 HA GLN A 29 9.641 -1.033 15.896 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.454 -0.185 13.188 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.459 0.904 14.561 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.891 0.877 14.695 1.00 0.00 H new ATOM 0 HG3 GLN A 29 11.005 -0.469 13.578 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.034 -0.004 11.298 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.840 1.631 10.658 1.00 0.00 H new ATOM 463 N ASN A 30 6.788 -2.348 15.405 1.00 0.00 N ATOM 464 CA ASN A 30 5.415 -2.519 15.987 1.00 0.00 C ATOM 465 C ASN A 30 4.478 -1.466 15.394 1.00 0.00 C ATOM 466 O ASN A 30 3.668 -0.885 16.093 1.00 0.00 O ATOM 467 CB ASN A 30 5.540 -2.354 17.511 1.00 0.00 C ATOM 468 CG ASN A 30 4.542 -3.285 18.210 1.00 0.00 C ATOM 469 OD1 ASN A 30 4.609 -4.487 18.053 1.00 0.00 O ATOM 470 ND2 ASN A 30 3.610 -2.783 18.984 1.00 0.00 N ATOM 0 H ASN A 30 7.082 -3.101 14.783 1.00 0.00 H new ATOM 0 HA ASN A 30 5.002 -3.500 15.755 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.556 -2.587 17.831 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.347 -1.319 17.792 1.00 0.00 H new ATOM 0 HD21 ASN A 30 2.946 -3.402 19.450 1.00 0.00 H new ATOM 0 HD22 ASN A 30 3.549 -1.774 19.120 1.00 0.00 H new ATOM 477 N LYS A 31 4.575 -1.220 14.103 1.00 0.00 N ATOM 478 CA LYS A 31 3.678 -0.210 13.472 1.00 0.00 C ATOM 479 C LYS A 31 2.614 -0.873 12.570 1.00 0.00 C ATOM 480 O LYS A 31 1.965 -0.189 11.801 1.00 0.00 O ATOM 481 CB LYS A 31 4.604 0.692 12.652 1.00 0.00 C ATOM 482 CG LYS A 31 5.468 1.524 13.602 1.00 0.00 C ATOM 483 CD LYS A 31 6.174 2.633 12.822 1.00 0.00 C ATOM 484 CE LYS A 31 7.055 3.447 13.773 1.00 0.00 C ATOM 485 NZ LYS A 31 8.086 4.073 12.899 1.00 0.00 N ATOM 0 H LYS A 31 5.233 -1.675 13.470 1.00 0.00 H new ATOM 0 HA LYS A 31 3.120 0.348 14.223 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.236 0.088 12.001 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.017 1.347 12.008 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.848 1.957 14.387 1.00 0.00 H new ATOM 0 HG3 LYS A 31 6.204 0.886 14.092 1.00 0.00 H new ATOM 0 HD2 LYS A 31 6.782 2.202 12.026 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.439 3.282 12.346 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.473 4.202 14.301 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.513 2.810 14.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 8.565 4.836 13.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 8.784 3.355 12.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.630 4.466 12.051 1.00 0.00 H new ATOM 499 N LEU A 32 2.400 -2.187 12.657 1.00 0.00 N ATOM 500 CA LEU A 32 1.336 -2.836 11.796 1.00 0.00 C ATOM 501 C LEU A 32 0.010 -2.064 11.910 1.00 0.00 C ATOM 502 O LEU A 32 -0.734 -1.980 10.956 1.00 0.00 O ATOM 503 CB LEU A 32 1.167 -4.266 12.322 1.00 0.00 C ATOM 504 CG LEU A 32 2.170 -5.179 11.601 1.00 0.00 C ATOM 505 CD1 LEU A 32 2.988 -5.977 12.618 1.00 0.00 C ATOM 506 CD2 LEU A 32 1.423 -6.135 10.656 1.00 0.00 C ATOM 0 H LEU A 32 2.907 -2.821 13.275 1.00 0.00 H new ATOM 0 HA LEU A 32 1.624 -2.833 10.745 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.336 -4.295 13.398 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.148 -4.614 12.150 1.00 0.00 H new ATOM 0 HG LEU A 32 2.850 -4.561 11.016 1.00 0.00 H new ATOM 0 HD11 LEU A 32 3.695 -6.620 12.093 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.534 -5.290 13.265 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.319 -6.590 13.222 1.00 0.00 H new ATOM 0 HD21 LEU A 32 2.141 -6.779 10.148 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.729 -6.748 11.232 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.869 -5.557 9.917 1.00 0.00 H new ATOM 518 N GLU A 33 -0.281 -1.475 13.055 1.00 0.00 N ATOM 519 CA GLU A 33 -1.554 -0.681 13.171 1.00 0.00 C ATOM 520 C GLU A 33 -1.418 0.579 12.301 1.00 0.00 C ATOM 521 O GLU A 33 -2.325 0.937 11.573 1.00 0.00 O ATOM 522 CB GLU A 33 -1.717 -0.301 14.651 1.00 0.00 C ATOM 523 CG GLU A 33 -3.203 -0.266 15.009 1.00 0.00 C ATOM 524 CD GLU A 33 -3.407 0.589 16.261 1.00 0.00 C ATOM 525 OE1 GLU A 33 -3.317 0.045 17.348 1.00 0.00 O ATOM 526 OE2 GLU A 33 -3.650 1.776 16.111 1.00 0.00 O ATOM 0 H GLU A 33 0.295 -1.509 13.896 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.423 -1.247 12.835 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.197 -1.022 15.282 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.264 0.672 14.839 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.778 0.143 14.179 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.570 -1.278 15.183 1.00 0.00 H new ATOM 533 N GLN A 34 -0.275 1.240 12.350 1.00 0.00 N ATOM 534 CA GLN A 34 -0.078 2.464 11.491 1.00 0.00 C ATOM 535 C GLN A 34 -0.096 2.088 9.998 1.00 0.00 C ATOM 536 O GLN A 34 -0.391 2.918 9.162 1.00 0.00 O ATOM 537 CB GLN A 34 1.289 3.058 11.870 1.00 0.00 C ATOM 538 CG GLN A 34 1.169 3.811 13.199 1.00 0.00 C ATOM 539 CD GLN A 34 0.216 5.004 13.032 1.00 0.00 C ATOM 540 OE1 GLN A 34 -0.979 4.861 13.190 1.00 0.00 O ATOM 541 NE2 GLN A 34 0.694 6.183 12.719 1.00 0.00 N ATOM 0 H GLN A 34 0.519 0.989 12.939 1.00 0.00 H new ATOM 0 HA GLN A 34 -0.880 3.183 11.656 1.00 0.00 H new ATOM 0 HB2 GLN A 34 2.031 2.264 11.955 1.00 0.00 H new ATOM 0 HB3 GLN A 34 1.633 3.734 11.087 1.00 0.00 H new ATOM 0 HG2 GLN A 34 0.798 3.142 13.975 1.00 0.00 H new ATOM 0 HG3 GLN A 34 2.150 4.159 13.521 1.00 0.00 H new ATOM 0 HE21 GLN A 34 1.698 6.307 12.585 1.00 0.00 H new ATOM 0 HE22 GLN A 34 0.063 6.977 12.609 1.00 0.00 H new ATOM 550 N VAL A 35 0.220 0.856 9.647 1.00 0.00 N ATOM 551 CA VAL A 35 0.216 0.474 8.193 1.00 0.00 C ATOM 552 C VAL A 35 -1.091 -0.268 7.839 1.00 0.00 C ATOM 553 O VAL A 35 -1.654 -0.060 6.782 1.00 0.00 O ATOM 554 CB VAL A 35 1.434 -0.458 7.961 1.00 0.00 C ATOM 555 CG1 VAL A 35 1.850 -0.378 6.492 1.00 0.00 C ATOM 556 CG2 VAL A 35 2.639 -0.059 8.841 1.00 0.00 C ATOM 0 H VAL A 35 0.476 0.111 10.294 1.00 0.00 H new ATOM 0 HA VAL A 35 0.279 1.361 7.562 1.00 0.00 H new ATOM 0 HB VAL A 35 1.137 -1.472 8.230 1.00 0.00 H new ATOM 0 HG11 VAL A 35 2.706 -1.031 6.320 1.00 0.00 H new ATOM 0 HG12 VAL A 35 1.020 -0.695 5.861 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.121 0.649 6.246 1.00 0.00 H new ATOM 0 HG21 VAL A 35 3.471 -0.737 8.648 1.00 0.00 H new ATOM 0 HG22 VAL A 35 2.940 0.962 8.605 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.358 -0.120 9.892 1.00 0.00 H new ATOM 566 N GLU A 36 -1.578 -1.132 8.710 1.00 0.00 N ATOM 567 CA GLU A 36 -2.852 -1.881 8.401 1.00 0.00 C ATOM 568 C GLU A 36 -4.056 -0.922 8.346 1.00 0.00 C ATOM 569 O GLU A 36 -4.987 -1.146 7.594 1.00 0.00 O ATOM 570 CB GLU A 36 -3.059 -2.893 9.539 1.00 0.00 C ATOM 571 CG GLU A 36 -4.010 -3.998 9.073 1.00 0.00 C ATOM 572 CD GLU A 36 -4.275 -4.966 10.227 1.00 0.00 C ATOM 573 OE1 GLU A 36 -3.371 -5.708 10.572 1.00 0.00 O ATOM 574 OE2 GLU A 36 -5.379 -4.947 10.747 1.00 0.00 O ATOM 0 H GLU A 36 -1.155 -1.350 9.612 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.775 -2.372 7.431 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.102 -3.323 9.836 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.469 -2.392 10.416 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.948 -3.563 8.727 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.576 -4.533 8.228 1.00 0.00 H new ATOM 581 N LYS A 37 -4.060 0.136 9.138 1.00 0.00 N ATOM 582 CA LYS A 37 -5.233 1.078 9.109 1.00 0.00 C ATOM 583 C LYS A 37 -5.055 2.124 8.002 1.00 0.00 C ATOM 584 O LYS A 37 -6.011 2.486 7.339 1.00 0.00 O ATOM 585 CB LYS A 37 -5.281 1.757 10.487 1.00 0.00 C ATOM 586 CG LYS A 37 -6.018 0.852 11.476 1.00 0.00 C ATOM 587 CD LYS A 37 -6.553 1.694 12.637 1.00 0.00 C ATOM 588 CE LYS A 37 -7.874 1.101 13.132 1.00 0.00 C ATOM 589 NZ LYS A 37 -8.727 2.280 13.451 1.00 0.00 N ATOM 0 H LYS A 37 -3.316 0.383 9.790 1.00 0.00 H new ATOM 0 HA LYS A 37 -6.160 0.544 8.901 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.270 1.954 10.842 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.786 2.720 10.412 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.840 0.341 10.975 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.345 0.081 11.852 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.826 1.717 13.449 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -6.703 2.724 12.314 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.336 0.474 12.370 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -7.721 0.474 14.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.652 1.955 13.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -8.265 2.855 14.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -8.860 2.854 12.594 1.00 0.00 H new ATOM 603 N GLU A 38 -3.850 2.610 7.783 1.00 0.00 N ATOM 604 CA GLU A 38 -3.659 3.623 6.694 1.00 0.00 C ATOM 605 C GLU A 38 -3.869 2.940 5.333 1.00 0.00 C ATOM 606 O GLU A 38 -4.494 3.495 4.450 1.00 0.00 O ATOM 607 CB GLU A 38 -2.224 4.148 6.839 1.00 0.00 C ATOM 608 CG GLU A 38 -2.069 4.856 8.186 1.00 0.00 C ATOM 609 CD GLU A 38 -2.657 6.268 8.108 1.00 0.00 C ATOM 610 OE1 GLU A 38 -3.609 6.454 7.370 1.00 0.00 O ATOM 611 OE2 GLU A 38 -2.143 7.140 8.790 1.00 0.00 O ATOM 0 H GLU A 38 -3.009 2.354 8.300 1.00 0.00 H new ATOM 0 HA GLU A 38 -4.370 4.447 6.763 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.515 3.323 6.767 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.994 4.837 6.026 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.574 4.286 8.966 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.015 4.907 8.460 1.00 0.00 H new ATOM 618 N LEU A 39 -3.378 1.725 5.158 1.00 0.00 N ATOM 619 CA LEU A 39 -3.591 1.016 3.840 1.00 0.00 C ATOM 620 C LEU A 39 -5.095 0.940 3.521 1.00 0.00 C ATOM 621 O LEU A 39 -5.491 1.053 2.376 1.00 0.00 O ATOM 622 CB LEU A 39 -3.017 -0.405 3.990 1.00 0.00 C ATOM 623 CG LEU A 39 -1.614 -0.456 3.383 1.00 0.00 C ATOM 624 CD1 LEU A 39 -0.990 -1.827 3.657 1.00 0.00 C ATOM 625 CD2 LEU A 39 -1.702 -0.228 1.871 1.00 0.00 C ATOM 0 H LEU A 39 -2.849 1.202 5.856 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.098 1.552 3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -2.979 -0.684 5.043 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -3.666 -1.125 3.492 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.996 0.322 3.831 1.00 0.00 H new ATOM 0 HD11 LEU A 39 0.010 -1.865 3.225 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.927 -1.989 4.733 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.608 -2.604 3.209 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -0.702 -0.264 1.439 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.320 -1.005 1.421 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.146 0.748 1.675 1.00 0.00 H new ATOM 637 N LEU A 40 -5.943 0.759 4.521 1.00 0.00 N ATOM 638 CA LEU A 40 -7.425 0.690 4.241 1.00 0.00 C ATOM 639 C LEU A 40 -7.888 1.966 3.514 1.00 0.00 C ATOM 640 O LEU A 40 -8.737 1.908 2.645 1.00 0.00 O ATOM 641 CB LEU A 40 -8.129 0.576 5.603 1.00 0.00 C ATOM 642 CG LEU A 40 -9.616 0.294 5.388 1.00 0.00 C ATOM 643 CD1 LEU A 40 -10.142 -0.574 6.533 1.00 0.00 C ATOM 644 CD2 LEU A 40 -10.386 1.616 5.358 1.00 0.00 C ATOM 0 H LEU A 40 -5.678 0.658 5.501 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.662 -0.162 3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.678 -0.223 6.191 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.001 1.499 6.168 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.753 -0.230 4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.202 -0.775 6.380 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.594 -1.516 6.557 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.005 -0.050 7.479 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -11.446 1.416 5.205 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.248 2.139 6.305 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.012 2.236 4.543 1.00 0.00 H new ATOM 656 N ARG A 41 -7.337 3.117 3.856 1.00 0.00 N ATOM 657 CA ARG A 41 -7.766 4.387 3.160 1.00 0.00 C ATOM 658 C ARG A 41 -7.544 4.257 1.642 1.00 0.00 C ATOM 659 O ARG A 41 -8.358 4.705 0.857 1.00 0.00 O ATOM 660 CB ARG A 41 -6.893 5.520 3.723 1.00 0.00 C ATOM 661 CG ARG A 41 -7.540 6.871 3.405 1.00 0.00 C ATOM 662 CD ARG A 41 -7.308 7.837 4.569 1.00 0.00 C ATOM 663 NE ARG A 41 -8.448 7.602 5.498 1.00 0.00 N ATOM 664 CZ ARG A 41 -8.260 6.940 6.607 1.00 0.00 C ATOM 665 NH1 ARG A 41 -7.577 7.478 7.581 1.00 0.00 N ATOM 666 NH2 ARG A 41 -8.755 5.741 6.743 1.00 0.00 N ATOM 0 H ARG A 41 -6.621 3.232 4.574 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.824 4.587 3.329 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -6.779 5.404 4.801 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -5.894 5.473 3.290 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -7.117 7.282 2.488 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -8.609 6.743 3.233 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -6.354 7.643 5.058 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -7.286 8.871 4.225 1.00 0.00 H new ATOM 0 HE ARG A 41 -9.376 7.958 5.268 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -7.190 8.416 7.475 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -7.430 6.960 8.448 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -9.289 5.320 5.983 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -8.608 5.224 7.610 1.00 0.00 H new ATOM 680 N VAL A 42 -6.456 3.638 1.221 1.00 0.00 N ATOM 681 CA VAL A 42 -6.212 3.483 -0.261 1.00 0.00 C ATOM 682 C VAL A 42 -7.385 2.717 -0.905 1.00 0.00 C ATOM 683 O VAL A 42 -7.797 3.028 -2.008 1.00 0.00 O ATOM 684 CB VAL A 42 -4.896 2.693 -0.411 1.00 0.00 C ATOM 685 CG1 VAL A 42 -4.601 2.445 -1.894 1.00 0.00 C ATOM 686 CG2 VAL A 42 -3.749 3.501 0.201 1.00 0.00 C ATOM 0 H VAL A 42 -5.738 3.240 1.826 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.138 4.450 -0.759 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.992 1.736 0.102 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.670 1.887 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.416 1.872 -2.336 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.507 3.400 -2.411 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.817 2.946 0.097 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.662 4.457 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.951 3.676 1.258 1.00 0.00 H new ATOM 696 N GLY A 43 -7.930 1.726 -0.227 1.00 0.00 N ATOM 697 CA GLY A 43 -9.073 0.961 -0.809 1.00 0.00 C ATOM 698 C GLY A 43 -10.271 1.904 -0.997 1.00 0.00 C ATOM 699 O GLY A 43 -10.871 1.942 -2.056 1.00 0.00 O ATOM 0 H GLY A 43 -7.630 1.420 0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.785 0.525 -1.766 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.345 0.135 -0.152 1.00 0.00 H new ATOM 703 N GLN A 44 -10.625 2.674 0.017 1.00 0.00 N ATOM 704 CA GLN A 44 -11.793 3.620 -0.136 1.00 0.00 C ATOM 705 C GLN A 44 -11.538 4.583 -1.308 1.00 0.00 C ATOM 706 O GLN A 44 -12.440 4.896 -2.062 1.00 0.00 O ATOM 707 CB GLN A 44 -11.903 4.408 1.180 1.00 0.00 C ATOM 708 CG GLN A 44 -13.361 4.807 1.415 1.00 0.00 C ATOM 709 CD GLN A 44 -14.053 3.737 2.269 1.00 0.00 C ATOM 710 OE1 GLN A 44 -14.071 2.578 1.905 1.00 0.00 O ATOM 711 NE2 GLN A 44 -14.628 4.072 3.398 1.00 0.00 N ATOM 0 H GLN A 44 -10.166 2.690 0.928 1.00 0.00 H new ATOM 0 HA GLN A 44 -12.714 3.076 -0.343 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -11.542 3.801 2.011 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -11.274 5.297 1.138 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -13.408 5.774 1.916 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -13.877 4.916 0.461 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -14.616 5.044 3.708 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -15.088 3.361 3.967 1.00 0.00 H new ATOM 720 N ILE A 45 -10.313 5.048 -1.477 1.00 0.00 N ATOM 721 CA ILE A 45 -10.017 5.986 -2.625 1.00 0.00 C ATOM 722 C ILE A 45 -10.378 5.297 -3.954 1.00 0.00 C ATOM 723 O ILE A 45 -10.944 5.914 -4.836 1.00 0.00 O ATOM 724 CB ILE A 45 -8.504 6.300 -2.542 1.00 0.00 C ATOM 725 CG1 ILE A 45 -8.230 7.101 -1.265 1.00 0.00 C ATOM 726 CG2 ILE A 45 -8.046 7.126 -3.751 1.00 0.00 C ATOM 727 CD1 ILE A 45 -6.795 6.851 -0.791 1.00 0.00 C ATOM 0 H ILE A 45 -9.516 4.824 -0.881 1.00 0.00 H new ATOM 0 HA ILE A 45 -10.599 6.906 -2.572 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.955 5.358 -2.533 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -8.380 8.164 -1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.935 6.812 -0.486 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -6.979 7.333 -3.667 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -8.237 6.567 -4.667 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.597 8.066 -3.779 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.607 7.424 0.117 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.660 5.789 -0.585 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -6.096 7.162 -1.567 1.00 0.00 H new ATOM 739 N LEU A 46 -10.081 4.022 -4.095 1.00 0.00 N ATOM 740 CA LEU A 46 -10.447 3.311 -5.371 1.00 0.00 C ATOM 741 C LEU A 46 -11.951 2.986 -5.368 1.00 0.00 C ATOM 742 O LEU A 46 -12.594 3.025 -6.400 1.00 0.00 O ATOM 743 CB LEU A 46 -9.622 2.012 -5.403 1.00 0.00 C ATOM 744 CG LEU A 46 -9.440 1.523 -6.847 1.00 0.00 C ATOM 745 CD1 LEU A 46 -10.801 1.259 -7.497 1.00 0.00 C ATOM 746 CD2 LEU A 46 -8.685 2.578 -7.664 1.00 0.00 C ATOM 0 H LEU A 46 -9.609 3.450 -3.395 1.00 0.00 H new ATOM 0 HA LEU A 46 -10.238 3.927 -6.246 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.647 2.182 -4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.121 1.243 -4.813 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.868 0.596 -6.828 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -10.655 0.913 -8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -11.334 0.496 -6.929 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -11.385 2.179 -7.505 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.559 2.224 -8.687 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.252 3.509 -7.669 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.706 2.752 -7.218 1.00 0.00 H new ATOM 758 N LYS A 47 -12.523 2.678 -4.218 1.00 0.00 N ATOM 759 CA LYS A 47 -13.992 2.368 -4.177 1.00 0.00 C ATOM 760 C LYS A 47 -14.811 3.662 -4.301 1.00 0.00 C ATOM 761 O LYS A 47 -15.932 3.632 -4.776 1.00 0.00 O ATOM 762 CB LYS A 47 -14.263 1.693 -2.821 1.00 0.00 C ATOM 763 CG LYS A 47 -15.740 1.296 -2.727 1.00 0.00 C ATOM 764 CD LYS A 47 -16.515 2.381 -1.973 1.00 0.00 C ATOM 765 CE LYS A 47 -17.959 2.424 -2.480 1.00 0.00 C ATOM 766 NZ LYS A 47 -18.679 1.398 -1.675 1.00 0.00 N ATOM 0 H LYS A 47 -12.041 2.629 -3.320 1.00 0.00 H new ATOM 0 HA LYS A 47 -14.279 1.717 -5.003 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -13.632 0.811 -2.710 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -14.007 2.372 -2.008 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -16.156 1.165 -3.726 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -15.838 0.340 -2.212 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -16.500 2.176 -0.903 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -16.038 3.350 -2.118 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.397 3.413 -2.342 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -18.011 2.198 -3.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.677 1.367 -1.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -18.244 0.466 -1.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -18.619 1.643 -0.666 1.00 0.00 H new ATOM 780 N GLU A 48 -14.280 4.805 -3.882 1.00 0.00 N ATOM 781 CA GLU A 48 -15.082 6.076 -4.000 1.00 0.00 C ATOM 782 C GLU A 48 -15.559 6.268 -5.454 1.00 0.00 C ATOM 783 O GLU A 48 -14.787 6.090 -6.370 1.00 0.00 O ATOM 784 CB GLU A 48 -14.151 7.229 -3.594 1.00 0.00 C ATOM 785 CG GLU A 48 -14.260 7.465 -2.086 1.00 0.00 C ATOM 786 CD GLU A 48 -15.545 8.234 -1.780 1.00 0.00 C ATOM 787 OE1 GLU A 48 -16.590 7.607 -1.726 1.00 0.00 O ATOM 788 OE2 GLU A 48 -15.464 9.439 -1.604 1.00 0.00 O ATOM 0 H GLU A 48 -13.350 4.907 -3.475 1.00 0.00 H new ATOM 0 HA GLU A 48 -15.964 6.042 -3.361 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -13.122 6.991 -3.862 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -14.420 8.136 -4.135 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -14.260 6.512 -1.557 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -13.395 8.026 -1.732 1.00 0.00 H new ATOM 795 N PRO A 49 -16.819 6.613 -5.631 1.00 0.00 N ATOM 796 CA PRO A 49 -17.357 6.805 -7.004 1.00 0.00 C ATOM 797 C PRO A 49 -16.789 8.078 -7.656 1.00 0.00 C ATOM 798 O PRO A 49 -16.569 8.110 -8.853 1.00 0.00 O ATOM 799 CB PRO A 49 -18.863 6.930 -6.790 1.00 0.00 C ATOM 800 CG PRO A 49 -19.011 7.410 -5.383 1.00 0.00 C ATOM 801 CD PRO A 49 -17.846 6.858 -4.604 1.00 0.00 C ATOM 0 HA PRO A 49 -17.089 5.988 -7.674 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -19.306 7.633 -7.496 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -19.364 5.973 -6.936 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -19.018 8.499 -5.346 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -19.955 7.070 -4.957 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -17.498 7.565 -3.851 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -18.114 5.941 -4.080 1.00 0.00 H new ATOM 809 N LYS A 50 -16.528 9.119 -6.890 1.00 0.00 N ATOM 810 CA LYS A 50 -15.949 10.365 -7.505 1.00 0.00 C ATOM 811 C LYS A 50 -14.446 10.162 -7.744 1.00 0.00 C ATOM 812 O LYS A 50 -13.895 10.658 -8.709 1.00 0.00 O ATOM 813 CB LYS A 50 -16.185 11.506 -6.503 1.00 0.00 C ATOM 814 CG LYS A 50 -17.583 12.089 -6.713 1.00 0.00 C ATOM 815 CD LYS A 50 -17.693 13.427 -5.979 1.00 0.00 C ATOM 816 CE LYS A 50 -19.164 13.834 -5.877 1.00 0.00 C ATOM 817 NZ LYS A 50 -19.601 13.363 -4.533 1.00 0.00 N ATOM 0 H LYS A 50 -16.687 9.161 -5.883 1.00 0.00 H new ATOM 0 HA LYS A 50 -16.415 10.595 -8.463 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.084 11.135 -5.483 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.432 12.283 -6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -17.774 12.229 -7.777 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -18.337 11.395 -6.342 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -17.258 13.344 -4.983 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -17.129 14.193 -6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -19.283 14.913 -5.975 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -19.757 13.375 -6.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -20.602 13.606 -4.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -19.483 12.332 -4.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -19.024 13.822 -3.800 1.00 0.00 H new ATOM 831 N MET A 51 -13.776 9.422 -6.879 1.00 0.00 N ATOM 832 CA MET A 51 -12.309 9.180 -7.076 1.00 0.00 C ATOM 833 C MET A 51 -12.076 7.951 -7.981 1.00 0.00 C ATOM 834 O MET A 51 -11.091 7.892 -8.692 1.00 0.00 O ATOM 835 CB MET A 51 -11.737 8.938 -5.674 1.00 0.00 C ATOM 836 CG MET A 51 -10.231 8.735 -5.765 1.00 0.00 C ATOM 837 SD MET A 51 -9.438 10.281 -6.270 1.00 0.00 S ATOM 838 CE MET A 51 -7.944 9.548 -6.983 1.00 0.00 C ATOM 0 H MET A 51 -14.182 8.981 -6.054 1.00 0.00 H new ATOM 0 HA MET A 51 -11.825 10.025 -7.566 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.961 9.786 -5.027 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.206 8.062 -5.225 1.00 0.00 H new ATOM 0 HG2 MET A 51 -9.839 8.412 -4.801 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.003 7.947 -6.482 1.00 0.00 H new ATOM 0 HE1 MET A 51 -7.063 10.013 -6.539 1.00 0.00 H new ATOM 0 HE2 MET A 51 -7.931 8.477 -6.779 1.00 0.00 H new ATOM 0 HE3 MET A 51 -7.937 9.712 -8.061 1.00 0.00 H new ATOM 848 N ALA A 52 -12.965 6.971 -7.971 1.00 0.00 N ATOM 849 CA ALA A 52 -12.755 5.763 -8.852 1.00 0.00 C ATOM 850 C ALA A 52 -12.622 6.188 -10.325 1.00 0.00 C ATOM 851 O ALA A 52 -11.863 5.597 -11.072 1.00 0.00 O ATOM 852 CB ALA A 52 -13.990 4.865 -8.677 1.00 0.00 C ATOM 0 H ALA A 52 -13.811 6.955 -7.402 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.841 5.238 -8.575 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.884 3.975 -9.297 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -14.080 4.570 -7.632 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -14.883 5.412 -8.978 1.00 0.00 H new ATOM 858 N ALA A 53 -13.348 7.203 -10.754 1.00 0.00 N ATOM 859 CA ALA A 53 -13.239 7.643 -12.195 1.00 0.00 C ATOM 860 C ALA A 53 -11.781 7.992 -12.538 1.00 0.00 C ATOM 861 O ALA A 53 -11.315 7.700 -13.622 1.00 0.00 O ATOM 862 CB ALA A 53 -14.126 8.890 -12.346 1.00 0.00 C ATOM 0 H ALA A 53 -14.001 7.739 -10.182 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.558 6.848 -12.869 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.080 9.247 -13.375 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.156 8.636 -12.096 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.772 9.672 -11.675 1.00 0.00 H new ATOM 868 N SER A 54 -11.054 8.610 -11.626 1.00 0.00 N ATOM 869 CA SER A 54 -9.620 8.962 -11.934 1.00 0.00 C ATOM 870 C SER A 54 -8.755 7.691 -11.947 1.00 0.00 C ATOM 871 O SER A 54 -8.064 7.422 -12.911 1.00 0.00 O ATOM 872 CB SER A 54 -9.149 9.911 -10.821 1.00 0.00 C ATOM 873 OG SER A 54 -9.861 11.138 -10.919 1.00 0.00 O ATOM 0 H SER A 54 -11.383 8.882 -10.699 1.00 0.00 H new ATOM 0 HA SER A 54 -9.533 9.433 -12.913 1.00 0.00 H new ATOM 0 HB2 SER A 54 -9.317 9.457 -9.844 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.078 10.091 -10.909 1.00 0.00 H new ATOM 0 HG SER A 54 -9.565 11.746 -10.210 1.00 0.00 H new ATOM 879 N LEU A 55 -8.786 6.904 -10.889 1.00 0.00 N ATOM 880 CA LEU A 55 -7.950 5.649 -10.870 1.00 0.00 C ATOM 881 C LEU A 55 -8.305 4.734 -12.060 1.00 0.00 C ATOM 882 O LEU A 55 -7.464 3.998 -12.542 1.00 0.00 O ATOM 883 CB LEU A 55 -8.257 4.934 -9.545 1.00 0.00 C ATOM 884 CG LEU A 55 -7.678 5.747 -8.383 1.00 0.00 C ATOM 885 CD1 LEU A 55 -8.599 5.634 -7.167 1.00 0.00 C ATOM 886 CD2 LEU A 55 -6.291 5.207 -8.024 1.00 0.00 C ATOM 0 H LEU A 55 -9.343 7.071 -10.051 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.891 5.893 -10.954 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.334 4.819 -9.422 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.828 3.932 -9.552 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.597 6.793 -8.679 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.185 6.213 -6.342 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.586 6.019 -7.421 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.683 4.589 -6.870 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.878 5.785 -7.197 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.373 4.161 -7.730 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.633 5.290 -8.889 1.00 0.00 H new ATOM 898 N LEU A 56 -9.534 4.768 -12.544 1.00 0.00 N ATOM 899 CA LEU A 56 -9.905 3.887 -13.706 1.00 0.00 C ATOM 900 C LEU A 56 -9.736 4.647 -15.036 1.00 0.00 C ATOM 901 O LEU A 56 -9.391 4.055 -16.040 1.00 0.00 O ATOM 902 CB LEU A 56 -11.383 3.502 -13.483 1.00 0.00 C ATOM 903 CG LEU A 56 -11.761 2.244 -14.288 1.00 0.00 C ATOM 904 CD1 LEU A 56 -11.652 2.525 -15.789 1.00 0.00 C ATOM 905 CD2 LEU A 56 -10.832 1.080 -13.918 1.00 0.00 C ATOM 0 H LEU A 56 -10.285 5.360 -12.189 1.00 0.00 H new ATOM 0 HA LEU A 56 -9.266 3.006 -13.763 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -11.559 3.324 -12.422 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.026 4.332 -13.778 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.789 1.975 -14.046 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -11.922 1.629 -16.347 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -12.328 3.337 -16.057 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.628 2.810 -16.032 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -11.109 0.197 -14.493 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -9.801 1.352 -14.144 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -10.926 0.864 -12.854 1.00 0.00 H new ATOM 917 N ASN A 57 -9.989 5.944 -15.065 1.00 0.00 N ATOM 918 CA ASN A 57 -9.848 6.709 -16.360 1.00 0.00 C ATOM 919 C ASN A 57 -8.490 6.440 -17.026 1.00 0.00 C ATOM 920 O ASN A 57 -7.509 6.213 -16.348 1.00 0.00 O ATOM 921 CB ASN A 57 -9.961 8.201 -16.004 1.00 0.00 C ATOM 922 CG ASN A 57 -11.412 8.665 -16.183 1.00 0.00 C ATOM 923 OD1 ASN A 57 -12.329 7.879 -16.045 1.00 0.00 O ATOM 924 ND2 ASN A 57 -11.667 9.914 -16.489 1.00 0.00 N ATOM 0 H ASN A 57 -10.283 6.499 -14.261 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.619 6.399 -17.065 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -9.641 8.365 -14.975 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.300 8.788 -16.641 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -12.632 10.223 -16.610 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.901 10.577 -16.606 1.00 0.00 H new ATOM 931 N PRO A 58 -8.464 6.505 -18.344 1.00 0.00 N ATOM 932 CA PRO A 58 -7.197 6.300 -19.080 1.00 0.00 C ATOM 933 C PRO A 58 -6.367 7.608 -19.149 1.00 0.00 C ATOM 934 O PRO A 58 -5.316 7.635 -19.759 1.00 0.00 O ATOM 935 CB PRO A 58 -7.659 5.894 -20.475 1.00 0.00 C ATOM 936 CG PRO A 58 -9.030 6.481 -20.636 1.00 0.00 C ATOM 937 CD PRO A 58 -9.587 6.760 -19.260 1.00 0.00 C ATOM 0 HA PRO A 58 -6.553 5.561 -18.603 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -6.979 6.273 -21.238 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -7.683 4.809 -20.579 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -8.984 7.399 -21.221 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.678 5.791 -21.176 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -9.940 7.788 -19.177 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -10.435 6.112 -19.037 1.00 0.00 H new ATOM 945 N TYR A 59 -6.820 8.693 -18.535 1.00 0.00 N ATOM 946 CA TYR A 59 -6.039 9.973 -18.585 1.00 0.00 C ATOM 947 C TYR A 59 -5.098 10.069 -17.373 1.00 0.00 C ATOM 948 O TYR A 59 -3.999 10.579 -17.484 1.00 0.00 O ATOM 949 CB TYR A 59 -7.083 11.101 -18.537 1.00 0.00 C ATOM 950 CG TYR A 59 -8.022 10.975 -19.715 1.00 0.00 C ATOM 951 CD1 TYR A 59 -7.720 11.620 -20.920 1.00 0.00 C ATOM 952 CD2 TYR A 59 -9.193 10.210 -19.604 1.00 0.00 C ATOM 953 CE1 TYR A 59 -8.587 11.503 -22.013 1.00 0.00 C ATOM 954 CE2 TYR A 59 -10.058 10.093 -20.697 1.00 0.00 C ATOM 955 CZ TYR A 59 -9.756 10.740 -21.901 1.00 0.00 C ATOM 956 OH TYR A 59 -10.610 10.625 -22.980 1.00 0.00 O ATOM 0 H TYR A 59 -7.692 8.739 -18.007 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.422 10.033 -19.481 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -7.645 11.050 -17.604 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -6.586 12.071 -18.558 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.818 12.208 -21.007 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.426 9.712 -18.675 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.354 12.001 -22.943 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.959 9.503 -20.612 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.373 10.060 -22.735 1.00 0.00 H new ATOM 966 N VAL A 60 -5.511 9.588 -16.210 1.00 0.00 N ATOM 967 CA VAL A 60 -4.601 9.677 -15.006 1.00 0.00 C ATOM 968 C VAL A 60 -3.232 9.022 -15.291 1.00 0.00 C ATOM 969 O VAL A 60 -2.242 9.386 -14.686 1.00 0.00 O ATOM 970 CB VAL A 60 -5.306 8.956 -13.844 1.00 0.00 C ATOM 971 CG1 VAL A 60 -6.622 9.668 -13.524 1.00 0.00 C ATOM 972 CG2 VAL A 60 -5.594 7.503 -14.229 1.00 0.00 C ATOM 0 H VAL A 60 -6.416 9.148 -16.045 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.411 10.721 -14.758 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.658 8.973 -12.968 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.121 9.157 -12.701 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.417 10.700 -13.240 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.266 9.655 -14.403 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.093 6.999 -13.401 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.237 7.480 -15.109 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.657 6.993 -14.452 1.00 0.00 H new ATOM 982 N LYS A 61 -3.150 8.064 -16.203 1.00 0.00 N ATOM 983 CA LYS A 61 -1.831 7.412 -16.509 1.00 0.00 C ATOM 984 C LYS A 61 -1.175 6.875 -15.224 1.00 0.00 C ATOM 985 O LYS A 61 -1.783 6.879 -14.171 1.00 0.00 O ATOM 986 CB LYS A 61 -0.967 8.513 -17.140 1.00 0.00 C ATOM 987 CG LYS A 61 -0.984 8.369 -18.663 1.00 0.00 C ATOM 988 CD LYS A 61 0.192 7.498 -19.108 1.00 0.00 C ATOM 989 CE LYS A 61 0.370 7.615 -20.623 1.00 0.00 C ATOM 990 NZ LYS A 61 -0.383 6.460 -21.189 1.00 0.00 N ATOM 0 H LYS A 61 -3.940 7.711 -16.743 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.949 6.558 -17.176 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.344 9.495 -16.853 1.00 0.00 H new ATOM 0 HB3 LYS A 61 0.056 8.444 -16.769 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.924 7.921 -18.986 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.921 9.351 -19.132 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.103 7.811 -18.599 1.00 0.00 H new ATOM 0 HD3 LYS A 61 0.014 6.459 -18.831 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.022 8.562 -20.995 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.423 7.574 -20.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.308 6.471 -22.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 0.016 5.572 -20.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.383 6.529 -20.913 1.00 0.00 H new ATOM 1004 N ARG A 62 0.059 6.413 -15.300 1.00 0.00 N ATOM 1005 CA ARG A 62 0.734 5.884 -14.072 1.00 0.00 C ATOM 1006 C ARG A 62 1.740 6.914 -13.538 1.00 0.00 C ATOM 1007 O ARG A 62 1.711 7.259 -12.372 1.00 0.00 O ATOM 1008 CB ARG A 62 1.453 4.603 -14.508 1.00 0.00 C ATOM 1009 CG ARG A 62 0.420 3.514 -14.807 1.00 0.00 C ATOM 1010 CD ARG A 62 0.125 2.720 -13.531 1.00 0.00 C ATOM 1011 NE ARG A 62 -1.156 3.280 -13.015 1.00 0.00 N ATOM 1012 CZ ARG A 62 -2.293 2.731 -13.346 1.00 0.00 C ATOM 1013 NH1 ARG A 62 -2.498 2.337 -14.573 1.00 0.00 N ATOM 1014 NH2 ARG A 62 -3.226 2.575 -12.448 1.00 0.00 N ATOM 0 H ARG A 62 0.619 6.381 -16.152 1.00 0.00 H new ATOM 0 HA ARG A 62 0.021 5.685 -13.272 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.059 4.797 -15.393 1.00 0.00 H new ATOM 0 HB3 ARG A 62 2.132 4.269 -13.723 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -0.497 3.964 -15.188 1.00 0.00 H new ATOM 0 HG3 ARG A 62 0.794 2.847 -15.584 1.00 0.00 H new ATOM 0 HD2 ARG A 62 0.033 1.654 -13.742 1.00 0.00 H new ATOM 0 HD3 ARG A 62 0.927 2.833 -12.802 1.00 0.00 H new ATOM 0 HE ARG A 62 -1.144 4.095 -12.401 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.769 2.458 -15.276 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -3.387 1.908 -14.829 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -3.067 2.882 -11.488 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -4.115 2.146 -12.705 1.00 0.00 H new ATOM 1028 N SER A 63 2.625 7.419 -14.377 1.00 0.00 N ATOM 1029 CA SER A 63 3.618 8.442 -13.882 1.00 0.00 C ATOM 1030 C SER A 63 2.866 9.666 -13.339 1.00 0.00 C ATOM 1031 O SER A 63 3.220 10.206 -12.306 1.00 0.00 O ATOM 1032 CB SER A 63 4.488 8.842 -15.082 1.00 0.00 C ATOM 1033 OG SER A 63 3.667 8.974 -16.235 1.00 0.00 O ATOM 0 H SER A 63 2.703 7.174 -15.364 1.00 0.00 H new ATOM 0 HA SER A 63 4.235 8.039 -13.079 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.000 9.782 -14.877 1.00 0.00 H new ATOM 0 HB3 SER A 63 5.258 8.090 -15.254 1.00 0.00 H new ATOM 0 HG SER A 63 4.220 9.231 -17.002 1.00 0.00 H new ATOM 1039 N VAL A 64 1.818 10.100 -14.014 1.00 0.00 N ATOM 1040 CA VAL A 64 1.044 11.283 -13.499 1.00 0.00 C ATOM 1041 C VAL A 64 0.287 10.870 -12.227 1.00 0.00 C ATOM 1042 O VAL A 64 0.243 11.613 -11.264 1.00 0.00 O ATOM 1043 CB VAL A 64 0.063 11.689 -14.616 1.00 0.00 C ATOM 1044 CG1 VAL A 64 -0.800 12.865 -14.147 1.00 0.00 C ATOM 1045 CG2 VAL A 64 0.855 12.110 -15.856 1.00 0.00 C ATOM 0 H VAL A 64 1.471 9.694 -14.883 1.00 0.00 H new ATOM 0 HA VAL A 64 1.694 12.120 -13.246 1.00 0.00 H new ATOM 0 HB VAL A 64 -0.579 10.842 -14.856 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -1.492 13.148 -14.941 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -1.364 12.572 -13.261 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.159 13.713 -13.905 1.00 0.00 H new ATOM 0 HG21 VAL A 64 0.164 12.398 -16.648 1.00 0.00 H new ATOM 0 HG22 VAL A 64 1.496 12.956 -15.608 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.470 11.276 -16.196 1.00 0.00 H new ATOM 1055 N LYS A 65 -0.297 9.687 -12.206 1.00 0.00 N ATOM 1056 CA LYS A 65 -1.029 9.246 -10.966 1.00 0.00 C ATOM 1057 C LYS A 65 -0.038 9.118 -9.797 1.00 0.00 C ATOM 1058 O LYS A 65 -0.368 9.436 -8.670 1.00 0.00 O ATOM 1059 CB LYS A 65 -1.662 7.880 -11.276 1.00 0.00 C ATOM 1060 CG LYS A 65 -2.683 7.532 -10.192 1.00 0.00 C ATOM 1061 CD LYS A 65 -3.966 8.334 -10.423 1.00 0.00 C ATOM 1062 CE LYS A 65 -4.600 8.686 -9.075 1.00 0.00 C ATOM 1063 NZ LYS A 65 -5.362 9.941 -9.326 1.00 0.00 N ATOM 0 H LYS A 65 -0.299 9.020 -12.978 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.794 9.969 -10.684 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.147 7.905 -12.252 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.890 7.112 -11.323 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.901 6.464 -10.212 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.274 7.756 -9.207 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -3.743 9.244 -10.980 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.666 7.755 -11.025 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.256 7.888 -8.727 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.840 8.832 -8.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -5.784 10.275 -8.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.719 10.669 -9.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -6.115 9.757 -10.019 1.00 0.00 H new ATOM 1077 N VAL A 66 1.182 8.665 -10.048 1.00 0.00 N ATOM 1078 CA VAL A 66 2.176 8.543 -8.918 1.00 0.00 C ATOM 1079 C VAL A 66 2.379 9.920 -8.262 1.00 0.00 C ATOM 1080 O VAL A 66 2.454 10.023 -7.051 1.00 0.00 O ATOM 1081 CB VAL A 66 3.496 8.034 -9.534 1.00 0.00 C ATOM 1082 CG1 VAL A 66 4.568 7.925 -8.446 1.00 0.00 C ATOM 1083 CG2 VAL A 66 3.270 6.655 -10.168 1.00 0.00 C ATOM 0 H VAL A 66 1.525 8.381 -10.966 1.00 0.00 H new ATOM 0 HA VAL A 66 1.825 7.855 -8.149 1.00 0.00 H new ATOM 0 HB VAL A 66 3.828 8.736 -10.298 1.00 0.00 H new ATOM 0 HG11 VAL A 66 5.498 7.565 -8.886 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.734 8.905 -7.999 1.00 0.00 H new ATOM 0 HG13 VAL A 66 4.237 7.227 -7.677 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.203 6.297 -10.603 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.933 5.954 -9.404 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.513 6.733 -10.948 1.00 0.00 H new ATOM 1093 N LYS A 67 2.451 10.980 -9.046 1.00 0.00 N ATOM 1094 CA LYS A 67 2.630 12.342 -8.429 1.00 0.00 C ATOM 1095 C LYS A 67 1.367 12.703 -7.630 1.00 0.00 C ATOM 1096 O LYS A 67 1.454 13.245 -6.544 1.00 0.00 O ATOM 1097 CB LYS A 67 2.833 13.335 -9.584 1.00 0.00 C ATOM 1098 CG LYS A 67 4.305 13.337 -10.003 1.00 0.00 C ATOM 1099 CD LYS A 67 4.407 13.569 -11.512 1.00 0.00 C ATOM 1100 CE LYS A 67 4.572 15.065 -11.791 1.00 0.00 C ATOM 1101 NZ LYS A 67 6.041 15.274 -11.914 1.00 0.00 N ATOM 0 H LYS A 67 2.395 10.962 -10.064 1.00 0.00 H new ATOM 0 HA LYS A 67 3.483 12.367 -7.751 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.204 13.059 -10.430 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.531 14.336 -9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.845 14.117 -9.467 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.771 12.388 -9.738 1.00 0.00 H new ATOM 0 HD2 LYS A 67 5.255 13.017 -11.919 1.00 0.00 H new ATOM 0 HD3 LYS A 67 3.513 13.192 -12.009 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.054 15.356 -12.705 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.154 15.666 -10.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 6.234 16.278 -12.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.507 14.995 -11.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.410 14.695 -12.695 1.00 0.00 H new ATOM 1115 N SER A 68 0.193 12.396 -8.150 1.00 0.00 N ATOM 1116 CA SER A 68 -1.067 12.723 -7.389 1.00 0.00 C ATOM 1117 C SER A 68 -1.059 12.004 -6.028 1.00 0.00 C ATOM 1118 O SER A 68 -1.508 12.551 -5.038 1.00 0.00 O ATOM 1119 CB SER A 68 -2.244 12.225 -8.241 1.00 0.00 C ATOM 1120 OG SER A 68 -2.419 13.095 -9.351 1.00 0.00 O ATOM 0 H SER A 68 0.053 11.941 -9.052 1.00 0.00 H new ATOM 0 HA SER A 68 -1.146 13.794 -7.203 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.054 11.209 -8.587 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.154 12.193 -7.642 1.00 0.00 H new ATOM 0 HG SER A 68 -3.168 12.780 -9.899 1.00 0.00 H new ATOM 1126 N LEU A 69 -0.548 10.785 -5.961 1.00 0.00 N ATOM 1127 CA LEU A 69 -0.522 10.060 -4.637 1.00 0.00 C ATOM 1128 C LEU A 69 0.273 10.882 -3.613 1.00 0.00 C ATOM 1129 O LEU A 69 -0.156 11.055 -2.487 1.00 0.00 O ATOM 1130 CB LEU A 69 0.168 8.706 -4.876 1.00 0.00 C ATOM 1131 CG LEU A 69 -0.888 7.643 -5.185 1.00 0.00 C ATOM 1132 CD1 LEU A 69 -1.427 7.854 -6.600 1.00 0.00 C ATOM 1133 CD2 LEU A 69 -0.255 6.253 -5.083 1.00 0.00 C ATOM 0 H LEU A 69 -0.156 10.271 -6.749 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.530 9.916 -4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.872 8.786 -5.704 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.743 8.418 -3.996 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.706 7.725 -4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.179 7.096 -6.820 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.877 8.844 -6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.610 7.772 -7.317 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.006 5.494 -5.303 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.563 6.172 -5.799 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.129 6.101 -4.074 1.00 0.00 H new ATOM 1145 N SER A 70 1.425 11.402 -3.995 1.00 0.00 N ATOM 1146 CA SER A 70 2.223 12.226 -3.018 1.00 0.00 C ATOM 1147 C SER A 70 1.431 13.490 -2.659 1.00 0.00 C ATOM 1148 O SER A 70 1.358 13.870 -1.505 1.00 0.00 O ATOM 1149 CB SER A 70 3.539 12.602 -3.718 1.00 0.00 C ATOM 1150 OG SER A 70 4.341 11.438 -3.867 1.00 0.00 O ATOM 0 H SER A 70 1.840 11.295 -4.921 1.00 0.00 H new ATOM 0 HA SER A 70 2.423 11.675 -2.099 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.332 13.043 -4.693 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.072 13.353 -3.135 1.00 0.00 H new ATOM 0 HG SER A 70 5.180 11.674 -4.315 1.00 0.00 H new ATOM 1156 N ASP A 71 0.817 14.135 -3.632 1.00 0.00 N ATOM 1157 CA ASP A 71 0.008 15.366 -3.312 1.00 0.00 C ATOM 1158 C ASP A 71 -1.274 14.991 -2.542 1.00 0.00 C ATOM 1159 O ASP A 71 -1.840 15.823 -1.854 1.00 0.00 O ATOM 1160 CB ASP A 71 -0.347 16.027 -4.653 1.00 0.00 C ATOM 1161 CG ASP A 71 0.902 16.685 -5.245 1.00 0.00 C ATOM 1162 OD1 ASP A 71 1.131 17.846 -4.950 1.00 0.00 O ATOM 1163 OD2 ASP A 71 1.607 16.016 -5.983 1.00 0.00 O ATOM 0 H ASP A 71 0.839 13.869 -4.616 1.00 0.00 H new ATOM 0 HA ASP A 71 0.577 16.047 -2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.741 15.282 -5.345 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.129 16.772 -4.507 1.00 0.00 H new ATOM 1168 N MET A 72 -1.725 13.749 -2.610 1.00 0.00 N ATOM 1169 CA MET A 72 -2.946 13.359 -1.831 1.00 0.00 C ATOM 1170 C MET A 72 -2.478 12.917 -0.445 1.00 0.00 C ATOM 1171 O MET A 72 -3.025 13.320 0.564 1.00 0.00 O ATOM 1172 CB MET A 72 -3.602 12.193 -2.587 1.00 0.00 C ATOM 1173 CG MET A 72 -4.934 11.839 -1.923 1.00 0.00 C ATOM 1174 SD MET A 72 -5.622 10.358 -2.704 1.00 0.00 S ATOM 1175 CE MET A 72 -4.361 9.193 -2.130 1.00 0.00 C ATOM 0 H MET A 72 -1.304 13.003 -3.164 1.00 0.00 H new ATOM 0 HA MET A 72 -3.663 14.173 -1.723 1.00 0.00 H new ATOM 0 HB2 MET A 72 -3.765 12.467 -3.629 1.00 0.00 H new ATOM 0 HB3 MET A 72 -2.941 11.326 -2.585 1.00 0.00 H new ATOM 0 HG2 MET A 72 -4.787 11.666 -0.857 1.00 0.00 H new ATOM 0 HG3 MET A 72 -5.632 12.671 -2.017 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.629 8.184 -2.442 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.396 9.461 -2.559 1.00 0.00 H new ATOM 0 HE3 MET A 72 -4.298 9.231 -1.042 1.00 0.00 H new ATOM 1185 N THR A 73 -1.429 12.117 -0.388 1.00 0.00 N ATOM 1186 CA THR A 73 -0.883 11.682 0.943 1.00 0.00 C ATOM 1187 C THR A 73 -0.521 12.942 1.771 1.00 0.00 C ATOM 1188 O THR A 73 -0.720 12.970 2.971 1.00 0.00 O ATOM 1189 CB THR A 73 0.363 10.814 0.609 1.00 0.00 C ATOM 1190 OG1 THR A 73 -0.058 9.484 0.343 1.00 0.00 O ATOM 1191 CG2 THR A 73 1.366 10.798 1.761 1.00 0.00 C ATOM 0 H THR A 73 -0.933 11.751 -1.200 1.00 0.00 H new ATOM 0 HA THR A 73 -1.591 11.108 1.541 1.00 0.00 H new ATOM 0 HB THR A 73 0.855 11.247 -0.262 1.00 0.00 H new ATOM 0 HG1 THR A 73 0.722 8.930 0.130 1.00 0.00 H new ATOM 0 HG21 THR A 73 2.222 10.181 1.489 1.00 0.00 H new ATOM 0 HG22 THR A 73 1.701 11.815 1.965 1.00 0.00 H new ATOM 0 HG23 THR A 73 0.891 10.387 2.652 1.00 0.00 H new ATOM 1199 N ALA A 74 -0.006 13.987 1.139 1.00 0.00 N ATOM 1200 CA ALA A 74 0.339 15.233 1.921 1.00 0.00 C ATOM 1201 C ALA A 74 -0.921 15.772 2.623 1.00 0.00 C ATOM 1202 O ALA A 74 -0.860 16.216 3.753 1.00 0.00 O ATOM 1203 CB ALA A 74 0.862 16.265 0.909 1.00 0.00 C ATOM 0 H ALA A 74 0.186 14.030 0.138 1.00 0.00 H new ATOM 0 HA ALA A 74 1.088 15.024 2.685 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.125 17.185 1.431 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.744 15.868 0.407 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.088 16.475 0.170 1.00 0.00 H new ATOM 1209 N LYS A 75 -2.067 15.722 1.968 1.00 0.00 N ATOM 1210 CA LYS A 75 -3.326 16.221 2.624 1.00 0.00 C ATOM 1211 C LYS A 75 -3.977 15.089 3.440 1.00 0.00 C ATOM 1212 O LYS A 75 -4.538 15.331 4.493 1.00 0.00 O ATOM 1213 CB LYS A 75 -4.258 16.670 1.490 1.00 0.00 C ATOM 1214 CG LYS A 75 -3.734 17.972 0.881 1.00 0.00 C ATOM 1215 CD LYS A 75 -4.201 19.158 1.729 1.00 0.00 C ATOM 1216 CE LYS A 75 -4.460 20.364 0.823 1.00 0.00 C ATOM 1217 NZ LYS A 75 -5.930 20.358 0.584 1.00 0.00 N ATOM 0 H LYS A 75 -2.182 15.362 1.021 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.121 17.044 3.309 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.315 15.896 0.725 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.268 16.816 1.872 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.645 17.951 0.834 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.095 18.078 -0.142 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.109 18.895 2.271 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.445 19.406 2.474 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.141 21.291 1.299 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.908 20.280 -0.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.185 21.157 -0.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.203 19.466 0.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -6.430 20.446 1.492 1.00 0.00 H new ATOM 1231 N GLU A 76 -3.903 13.853 2.974 1.00 0.00 N ATOM 1232 CA GLU A 76 -4.521 12.722 3.759 1.00 0.00 C ATOM 1233 C GLU A 76 -3.840 12.553 5.134 1.00 0.00 C ATOM 1234 O GLU A 76 -4.406 11.949 6.025 1.00 0.00 O ATOM 1235 CB GLU A 76 -4.329 11.448 2.920 1.00 0.00 C ATOM 1236 CG GLU A 76 -5.465 10.467 3.214 1.00 0.00 C ATOM 1237 CD GLU A 76 -6.759 10.979 2.579 1.00 0.00 C ATOM 1238 OE1 GLU A 76 -6.833 10.994 1.361 1.00 0.00 O ATOM 1239 OE2 GLU A 76 -7.655 11.346 3.320 1.00 0.00 O ATOM 0 H GLU A 76 -3.450 13.583 2.101 1.00 0.00 H new ATOM 0 HA GLU A 76 -5.575 12.926 3.948 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.315 11.697 1.859 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.368 10.988 3.152 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -5.219 9.481 2.820 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.595 10.356 4.291 1.00 0.00 H new ATOM 1246 N LYS A 77 -2.629 13.065 5.329 1.00 0.00 N ATOM 1247 CA LYS A 77 -1.938 12.907 6.651 1.00 0.00 C ATOM 1248 C LYS A 77 -1.685 11.421 6.933 1.00 0.00 C ATOM 1249 O LYS A 77 -1.905 10.950 8.033 1.00 0.00 O ATOM 1250 CB LYS A 77 -2.874 13.512 7.708 1.00 0.00 C ATOM 1251 CG LYS A 77 -2.045 14.069 8.866 1.00 0.00 C ATOM 1252 CD LYS A 77 -2.735 15.310 9.437 1.00 0.00 C ATOM 1253 CE LYS A 77 -1.976 15.792 10.676 1.00 0.00 C ATOM 1254 NZ LYS A 77 -0.869 16.636 10.145 1.00 0.00 N ATOM 0 H LYS A 77 -2.100 13.582 4.626 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.971 13.409 6.661 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -3.477 14.304 7.264 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.565 12.753 8.074 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.932 13.313 9.643 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.043 14.323 8.521 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.766 16.100 8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.768 15.077 9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.625 16.364 11.339 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.590 14.952 11.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.313 17.017 10.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.254 16.059 9.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.266 17.421 9.591 1.00 0.00 H new ATOM 1268 N PHE A 78 -1.221 10.674 5.947 1.00 0.00 N ATOM 1269 CA PHE A 78 -0.951 9.207 6.182 1.00 0.00 C ATOM 1270 C PHE A 78 0.050 9.033 7.331 1.00 0.00 C ATOM 1271 O PHE A 78 0.391 9.990 8.003 1.00 0.00 O ATOM 1272 CB PHE A 78 -0.390 8.634 4.863 1.00 0.00 C ATOM 1273 CG PHE A 78 -1.515 7.975 4.096 1.00 0.00 C ATOM 1274 CD1 PHE A 78 -2.299 6.991 4.714 1.00 0.00 C ATOM 1275 CD2 PHE A 78 -1.782 8.353 2.773 1.00 0.00 C ATOM 1276 CE1 PHE A 78 -3.346 6.387 4.011 1.00 0.00 C ATOM 1277 CE2 PHE A 78 -2.831 7.747 2.071 1.00 0.00 C ATOM 1278 CZ PHE A 78 -3.614 6.765 2.691 1.00 0.00 C ATOM 0 H PHE A 78 -1.020 11.009 5.005 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.861 8.678 6.466 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.057 9.429 4.267 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.398 7.911 5.072 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.094 6.699 5.734 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.179 9.111 2.295 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -3.948 5.628 4.488 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -3.036 8.037 1.051 1.00 0.00 H new ATOM 0 HZ PHE A 78 -4.425 6.300 2.150 1.00 0.00 H new ATOM 1288 N SER A 79 0.522 7.829 7.576 1.00 0.00 N ATOM 1289 CA SER A 79 1.484 7.625 8.689 1.00 0.00 C ATOM 1290 C SER A 79 2.884 7.401 8.108 1.00 0.00 C ATOM 1291 O SER A 79 3.083 7.619 6.928 1.00 0.00 O ATOM 1292 CB SER A 79 0.957 6.396 9.437 1.00 0.00 C ATOM 1293 OG SER A 79 1.519 5.220 8.871 1.00 0.00 O ATOM 0 H SER A 79 0.279 6.989 7.051 1.00 0.00 H new ATOM 0 HA SER A 79 1.566 8.478 9.363 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.214 6.462 10.494 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.131 6.358 9.375 1.00 0.00 H new ATOM 0 HG SER A 79 0.959 4.448 9.097 1.00 0.00 H new ATOM 1299 N PRO A 80 3.826 6.983 8.931 1.00 0.00 N ATOM 1300 CA PRO A 80 5.193 6.764 8.416 1.00 0.00 C ATOM 1301 C PRO A 80 5.318 5.457 7.609 1.00 0.00 C ATOM 1302 O PRO A 80 6.366 5.192 7.049 1.00 0.00 O ATOM 1303 CB PRO A 80 6.049 6.726 9.669 1.00 0.00 C ATOM 1304 CG PRO A 80 5.134 6.314 10.776 1.00 0.00 C ATOM 1305 CD PRO A 80 3.731 6.681 10.371 1.00 0.00 C ATOM 0 HA PRO A 80 5.495 7.544 7.716 1.00 0.00 H new ATOM 0 HB2 PRO A 80 6.872 6.020 9.559 1.00 0.00 H new ATOM 0 HB3 PRO A 80 6.491 7.702 9.870 1.00 0.00 H new ATOM 0 HG2 PRO A 80 5.212 5.242 10.957 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.407 6.815 11.705 1.00 0.00 H new ATOM 0 HD2 PRO A 80 3.037 5.862 10.559 1.00 0.00 H new ATOM 0 HD3 PRO A 80 3.368 7.541 10.933 1.00 0.00 H new ATOM 1313 N LEU A 81 4.278 4.646 7.507 1.00 0.00 N ATOM 1314 CA LEU A 81 4.393 3.405 6.700 1.00 0.00 C ATOM 1315 C LEU A 81 3.336 3.386 5.587 1.00 0.00 C ATOM 1316 O LEU A 81 3.060 2.340 5.028 1.00 0.00 O ATOM 1317 CB LEU A 81 4.161 2.264 7.687 1.00 0.00 C ATOM 1318 CG LEU A 81 5.502 1.871 8.325 1.00 0.00 C ATOM 1319 CD1 LEU A 81 5.306 1.561 9.813 1.00 0.00 C ATOM 1320 CD2 LEU A 81 6.070 0.640 7.610 1.00 0.00 C ATOM 0 H LEU A 81 3.371 4.799 7.947 1.00 0.00 H new ATOM 0 HA LEU A 81 5.363 3.325 6.209 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.454 2.571 8.457 1.00 0.00 H new ATOM 0 HB3 LEU A 81 3.723 1.407 7.175 1.00 0.00 H new ATOM 0 HG LEU A 81 6.201 2.702 8.226 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.263 1.283 10.256 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.914 2.443 10.320 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.602 0.736 9.923 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.021 0.362 8.064 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.369 -0.190 7.701 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.224 0.870 6.556 1.00 0.00 H new ATOM 1332 N THR A 82 2.738 4.521 5.247 1.00 0.00 N ATOM 1333 CA THR A 82 1.719 4.511 4.166 1.00 0.00 C ATOM 1334 C THR A 82 2.035 5.520 3.042 1.00 0.00 C ATOM 1335 O THR A 82 1.201 5.746 2.183 1.00 0.00 O ATOM 1336 CB THR A 82 0.389 4.837 4.849 1.00 0.00 C ATOM 1337 OG1 THR A 82 0.340 4.184 6.111 1.00 0.00 O ATOM 1338 CG2 THR A 82 -0.744 4.314 3.957 1.00 0.00 C ATOM 0 H THR A 82 2.918 5.430 5.673 1.00 0.00 H new ATOM 0 HA THR A 82 1.695 3.540 3.671 1.00 0.00 H new ATOM 0 HB THR A 82 0.287 5.912 4.998 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.759 4.753 6.790 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.705 4.534 4.422 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.693 4.799 2.982 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.640 3.236 3.832 1.00 0.00 H new ATOM 1346 N SER A 83 3.227 6.096 2.992 1.00 0.00 N ATOM 1347 CA SER A 83 3.547 7.028 1.868 1.00 0.00 C ATOM 1348 C SER A 83 4.698 6.433 1.037 1.00 0.00 C ATOM 1349 O SER A 83 5.552 7.135 0.534 1.00 0.00 O ATOM 1350 CB SER A 83 3.949 8.350 2.520 1.00 0.00 C ATOM 1351 OG SER A 83 4.384 9.256 1.515 1.00 0.00 O ATOM 0 H SER A 83 3.974 5.958 3.673 1.00 0.00 H new ATOM 0 HA SER A 83 2.705 7.181 1.193 1.00 0.00 H new ATOM 0 HB2 SER A 83 3.104 8.772 3.065 1.00 0.00 H new ATOM 0 HB3 SER A 83 4.745 8.184 3.245 1.00 0.00 H new ATOM 0 HG SER A 83 4.934 8.778 0.859 1.00 0.00 H new ATOM 1357 N ASN A 84 4.689 5.133 0.877 1.00 0.00 N ATOM 1358 CA ASN A 84 5.730 4.430 0.063 1.00 0.00 C ATOM 1359 C ASN A 84 5.008 3.281 -0.639 1.00 0.00 C ATOM 1360 O ASN A 84 4.884 3.259 -1.849 1.00 0.00 O ATOM 1361 CB ASN A 84 6.762 3.910 1.065 1.00 0.00 C ATOM 1362 CG ASN A 84 8.019 4.787 1.008 1.00 0.00 C ATOM 1363 OD1 ASN A 84 8.540 5.045 -0.060 1.00 0.00 O ATOM 1364 ND2 ASN A 84 8.538 5.262 2.115 1.00 0.00 N ATOM 0 H ASN A 84 3.988 4.515 1.286 1.00 0.00 H new ATOM 0 HA ASN A 84 6.226 5.055 -0.680 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.344 3.920 2.072 1.00 0.00 H new ATOM 0 HB3 ASN A 84 7.017 2.875 0.836 1.00 0.00 H new ATOM 0 HD21 ASN A 84 9.374 5.845 2.077 1.00 0.00 H new ATOM 0 HD22 ASN A 84 8.105 5.049 3.014 1.00 0.00 H new ATOM 1371 N LEU A 85 4.439 2.368 0.135 1.00 0.00 N ATOM 1372 CA LEU A 85 3.620 1.282 -0.487 1.00 0.00 C ATOM 1373 C LEU A 85 2.475 1.941 -1.296 1.00 0.00 C ATOM 1374 O LEU A 85 2.003 1.375 -2.264 1.00 0.00 O ATOM 1375 CB LEU A 85 3.057 0.431 0.679 1.00 0.00 C ATOM 1376 CG LEU A 85 2.032 -0.586 0.158 1.00 0.00 C ATOM 1377 CD1 LEU A 85 2.705 -1.541 -0.831 1.00 0.00 C ATOM 1378 CD2 LEU A 85 1.472 -1.391 1.334 1.00 0.00 C ATOM 0 H LEU A 85 4.510 2.335 1.152 1.00 0.00 H new ATOM 0 HA LEU A 85 4.200 0.653 -1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.871 -0.090 1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.589 1.081 1.418 1.00 0.00 H new ATOM 0 HG LEU A 85 1.224 -0.055 -0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.973 -2.261 -1.197 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.106 -0.973 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.516 -2.071 -0.331 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.744 -2.114 0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.285 -1.917 1.835 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.988 -0.716 2.040 1.00 0.00 H new ATOM 1390 N ILE A 86 2.031 3.147 -0.923 1.00 0.00 N ATOM 1391 CA ILE A 86 0.933 3.800 -1.716 1.00 0.00 C ATOM 1392 C ILE A 86 1.394 4.002 -3.172 1.00 0.00 C ATOM 1393 O ILE A 86 0.617 3.831 -4.094 1.00 0.00 O ATOM 1394 CB ILE A 86 0.615 5.153 -1.035 1.00 0.00 C ATOM 1395 CG1 ILE A 86 -0.612 5.778 -1.703 1.00 0.00 C ATOM 1396 CG2 ILE A 86 1.802 6.119 -1.159 1.00 0.00 C ATOM 1397 CD1 ILE A 86 -1.442 6.520 -0.654 1.00 0.00 C ATOM 0 H ILE A 86 2.378 3.682 -0.127 1.00 0.00 H new ATOM 0 HA ILE A 86 0.037 3.179 -1.740 1.00 0.00 H new ATOM 0 HB ILE A 86 0.420 4.973 0.022 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.300 6.466 -2.489 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.215 5.004 -2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.555 7.063 -0.673 1.00 0.00 H new ATOM 0 HG22 ILE A 86 2.678 5.682 -0.680 1.00 0.00 H new ATOM 0 HG23 ILE A 86 2.017 6.298 -2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.316 6.965 -1.130 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.765 5.820 0.116 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.837 7.305 -0.200 1.00 0.00 H new ATOM 1409 N ASN A 87 2.652 4.347 -3.392 1.00 0.00 N ATOM 1410 CA ASN A 87 3.125 4.529 -4.809 1.00 0.00 C ATOM 1411 C ASN A 87 3.104 3.167 -5.515 1.00 0.00 C ATOM 1412 O ASN A 87 2.585 3.039 -6.606 1.00 0.00 O ATOM 1413 CB ASN A 87 4.562 5.072 -4.735 1.00 0.00 C ATOM 1414 CG ASN A 87 4.527 6.601 -4.633 1.00 0.00 C ATOM 1415 OD1 ASN A 87 3.586 7.160 -4.106 1.00 0.00 O ATOM 1416 ND2 ASN A 87 5.518 7.312 -5.114 1.00 0.00 N ATOM 0 H ASN A 87 3.354 4.506 -2.669 1.00 0.00 H new ATOM 0 HA ASN A 87 2.488 5.217 -5.365 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.077 4.651 -3.871 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.123 4.769 -5.619 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.496 8.329 -5.045 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.311 6.848 -5.557 1.00 0.00 H new ATOM 1423 N LEU A 88 3.655 2.138 -4.892 1.00 0.00 N ATOM 1424 CA LEU A 88 3.654 0.769 -5.532 1.00 0.00 C ATOM 1425 C LEU A 88 2.237 0.396 -5.992 1.00 0.00 C ATOM 1426 O LEU A 88 2.058 -0.169 -7.056 1.00 0.00 O ATOM 1427 CB LEU A 88 4.123 -0.225 -4.455 1.00 0.00 C ATOM 1428 CG LEU A 88 5.625 -0.471 -4.599 1.00 0.00 C ATOM 1429 CD1 LEU A 88 6.215 -0.825 -3.232 1.00 0.00 C ATOM 1430 CD2 LEU A 88 5.858 -1.630 -5.569 1.00 0.00 C ATOM 0 H LEU A 88 4.101 2.186 -3.976 1.00 0.00 H new ATOM 0 HA LEU A 88 4.307 0.751 -6.404 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.903 0.169 -3.463 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.580 -1.165 -4.553 1.00 0.00 H new ATOM 0 HG LEU A 88 6.108 0.428 -4.982 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.286 -1.001 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.046 -0.001 -2.538 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.734 -1.725 -2.850 1.00 0.00 H new ATOM 0 HD21 LEU A 88 6.928 -1.807 -5.673 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.377 -2.529 -5.184 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.435 -1.381 -6.542 1.00 0.00 H new ATOM 1442 N LEU A 89 1.225 0.713 -5.206 1.00 0.00 N ATOM 1443 CA LEU A 89 -0.175 0.369 -5.636 1.00 0.00 C ATOM 1444 C LEU A 89 -0.523 1.148 -6.909 1.00 0.00 C ATOM 1445 O LEU A 89 -1.135 0.613 -7.815 1.00 0.00 O ATOM 1446 CB LEU A 89 -1.107 0.768 -4.484 1.00 0.00 C ATOM 1447 CG LEU A 89 -0.854 -0.155 -3.290 1.00 0.00 C ATOM 1448 CD1 LEU A 89 -1.705 0.301 -2.103 1.00 0.00 C ATOM 1449 CD2 LEU A 89 -1.227 -1.594 -3.668 1.00 0.00 C ATOM 0 H LEU A 89 1.305 1.185 -4.305 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.278 -0.694 -5.855 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.931 1.806 -4.201 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.148 0.696 -4.801 1.00 0.00 H new ATOM 0 HG LEU A 89 0.200 -0.115 -3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.525 -0.356 -1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.437 1.323 -1.835 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.760 0.262 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -1.047 -2.252 -2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.281 -1.636 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.619 -1.918 -4.512 1.00 0.00 H new ATOM 1461 N ALA A 90 -0.122 2.400 -7.001 1.00 0.00 N ATOM 1462 CA ALA A 90 -0.420 3.185 -8.238 1.00 0.00 C ATOM 1463 C ALA A 90 0.857 3.353 -9.084 1.00 0.00 C ATOM 1464 O ALA A 90 0.996 4.328 -9.799 1.00 0.00 O ATOM 1465 CB ALA A 90 -0.925 4.546 -7.748 1.00 0.00 C ATOM 0 H ALA A 90 0.393 2.903 -6.278 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.156 2.687 -8.869 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -1.163 5.176 -8.605 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.819 4.405 -7.141 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.152 5.027 -7.149 1.00 0.00 H new ATOM 1471 N GLU A 91 1.791 2.415 -9.022 1.00 0.00 N ATOM 1472 CA GLU A 91 3.040 2.558 -9.845 1.00 0.00 C ATOM 1473 C GLU A 91 2.962 1.672 -11.099 1.00 0.00 C ATOM 1474 O GLU A 91 3.286 2.112 -12.186 1.00 0.00 O ATOM 1475 CB GLU A 91 4.196 2.109 -8.939 1.00 0.00 C ATOM 1476 CG GLU A 91 5.524 2.237 -9.691 1.00 0.00 C ATOM 1477 CD GLU A 91 6.642 1.595 -8.865 1.00 0.00 C ATOM 1478 OE1 GLU A 91 6.923 2.102 -7.791 1.00 0.00 O ATOM 1479 OE2 GLU A 91 7.197 0.609 -9.320 1.00 0.00 O ATOM 0 H GLU A 91 1.739 1.574 -8.447 1.00 0.00 H new ATOM 0 HA GLU A 91 3.178 3.584 -10.188 1.00 0.00 H new ATOM 0 HB2 GLU A 91 4.219 2.718 -8.035 1.00 0.00 H new ATOM 0 HB3 GLU A 91 4.044 1.077 -8.624 1.00 0.00 H new ATOM 0 HG2 GLU A 91 5.451 1.751 -10.664 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.750 3.287 -9.875 1.00 0.00 H new ATOM 1486 N ASN A 92 2.545 0.428 -10.965 1.00 0.00 N ATOM 1487 CA ASN A 92 2.467 -0.462 -12.166 1.00 0.00 C ATOM 1488 C ASN A 92 1.012 -0.870 -12.475 1.00 0.00 C ATOM 1489 O ASN A 92 0.778 -1.926 -13.031 1.00 0.00 O ATOM 1490 CB ASN A 92 3.299 -1.691 -11.798 1.00 0.00 C ATOM 1491 CG ASN A 92 4.770 -1.285 -11.647 1.00 0.00 C ATOM 1492 OD1 ASN A 92 5.340 -0.696 -12.543 1.00 0.00 O ATOM 1493 ND2 ASN A 92 5.419 -1.575 -10.546 1.00 0.00 N ATOM 0 H ASN A 92 2.260 -0.001 -10.085 1.00 0.00 H new ATOM 0 HA ASN A 92 2.835 0.041 -13.060 1.00 0.00 H new ATOM 0 HB2 ASN A 92 2.933 -2.126 -10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 92 3.199 -2.455 -12.568 1.00 0.00 H new ATOM 0 HD21 ASN A 92 6.398 -1.306 -10.445 1.00 0.00 H new ATOM 0 HD22 ASN A 92 4.945 -2.070 -9.790 1.00 0.00 H new ATOM 1500 N GLY A 93 0.033 -0.055 -12.128 1.00 0.00 N ATOM 1501 CA GLY A 93 -1.382 -0.423 -12.417 1.00 0.00 C ATOM 1502 C GLY A 93 -1.855 -1.436 -11.375 1.00 0.00 C ATOM 1503 O GLY A 93 -2.359 -2.490 -11.716 1.00 0.00 O ATOM 0 H GLY A 93 0.161 0.842 -11.660 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.014 0.465 -12.393 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -1.464 -0.846 -13.418 1.00 0.00 H new ATOM 1507 N ARG A 94 -1.695 -1.134 -10.102 1.00 0.00 N ATOM 1508 CA ARG A 94 -2.138 -2.098 -9.054 1.00 0.00 C ATOM 1509 C ARG A 94 -3.336 -1.540 -8.264 1.00 0.00 C ATOM 1510 O ARG A 94 -3.486 -1.828 -7.091 1.00 0.00 O ATOM 1511 CB ARG A 94 -0.922 -2.289 -8.136 1.00 0.00 C ATOM 1512 CG ARG A 94 -0.651 -3.784 -7.940 1.00 0.00 C ATOM 1513 CD ARG A 94 0.849 -4.009 -7.724 1.00 0.00 C ATOM 1514 NE ARG A 94 1.165 -5.249 -8.487 1.00 0.00 N ATOM 1515 CZ ARG A 94 1.892 -5.181 -9.569 1.00 0.00 C ATOM 1516 NH1 ARG A 94 1.681 -4.232 -10.439 1.00 0.00 N ATOM 1517 NH2 ARG A 94 2.830 -6.063 -9.780 1.00 0.00 N ATOM 0 H ARG A 94 -1.281 -0.270 -9.754 1.00 0.00 H new ATOM 0 HA ARG A 94 -2.469 -3.041 -9.489 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -0.047 -1.805 -8.570 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -1.104 -1.813 -7.172 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -1.212 -4.157 -7.083 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.991 -4.343 -8.812 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.432 -3.162 -8.087 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.082 -4.126 -6.666 1.00 0.00 H new ATOM 0 HE ARG A 94 0.814 -6.150 -8.164 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.948 -3.543 -10.274 1.00 0.00 H new ATOM 0 HH12 ARG A 94 2.249 -4.179 -11.284 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.995 -6.805 -9.100 1.00 0.00 H new ATOM 0 HH22 ARG A 94 3.399 -6.011 -10.625 1.00 0.00 H new ATOM 1531 N LEU A 95 -4.207 -0.768 -8.891 1.00 0.00 N ATOM 1532 CA LEU A 95 -5.397 -0.240 -8.147 1.00 0.00 C ATOM 1533 C LEU A 95 -6.672 -1.001 -8.564 1.00 0.00 C ATOM 1534 O LEU A 95 -7.768 -0.484 -8.464 1.00 0.00 O ATOM 1535 CB LEU A 95 -5.495 1.243 -8.520 1.00 0.00 C ATOM 1536 CG LEU A 95 -4.299 1.996 -7.932 1.00 0.00 C ATOM 1537 CD1 LEU A 95 -4.005 3.233 -8.783 1.00 0.00 C ATOM 1538 CD2 LEU A 95 -4.622 2.429 -6.500 1.00 0.00 C ATOM 0 H LEU A 95 -4.143 -0.488 -9.870 1.00 0.00 H new ATOM 0 HA LEU A 95 -5.293 -0.370 -7.070 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -5.513 1.356 -9.604 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.426 1.664 -8.140 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.427 1.342 -7.927 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.153 3.769 -8.364 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.774 2.926 -9.803 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.877 3.886 -8.789 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.770 2.965 -6.081 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.495 3.082 -6.505 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.831 1.549 -5.892 1.00 0.00 H new ATOM 1550 N THR A 96 -6.540 -2.243 -8.992 1.00 0.00 N ATOM 1551 CA THR A 96 -7.740 -3.052 -9.368 1.00 0.00 C ATOM 1552 C THR A 96 -7.945 -4.098 -8.269 1.00 0.00 C ATOM 1553 O THR A 96 -8.999 -4.178 -7.667 1.00 0.00 O ATOM 1554 CB THR A 96 -7.398 -3.715 -10.706 1.00 0.00 C ATOM 1555 OG1 THR A 96 -6.235 -4.516 -10.551 1.00 0.00 O ATOM 1556 CG2 THR A 96 -7.140 -2.634 -11.757 1.00 0.00 C ATOM 0 H THR A 96 -5.648 -2.726 -9.095 1.00 0.00 H new ATOM 0 HA THR A 96 -8.652 -2.464 -9.466 1.00 0.00 H new ATOM 0 HB THR A 96 -8.230 -4.342 -11.028 1.00 0.00 H new ATOM 0 HG1 THR A 96 -6.498 -5.440 -10.356 1.00 0.00 H new ATOM 0 HG21 THR A 96 -6.896 -3.104 -12.710 1.00 0.00 H new ATOM 0 HG22 THR A 96 -8.032 -2.019 -11.873 1.00 0.00 H new ATOM 0 HG23 THR A 96 -6.307 -2.008 -11.438 1.00 0.00 H new ATOM 1564 N ASN A 97 -6.914 -4.866 -7.961 1.00 0.00 N ATOM 1565 CA ASN A 97 -7.023 -5.857 -6.856 1.00 0.00 C ATOM 1566 C ASN A 97 -6.283 -5.304 -5.621 1.00 0.00 C ATOM 1567 O ASN A 97 -5.655 -6.047 -4.890 1.00 0.00 O ATOM 1568 CB ASN A 97 -6.336 -7.127 -7.372 1.00 0.00 C ATOM 1569 CG ASN A 97 -7.084 -7.651 -8.604 1.00 0.00 C ATOM 1570 OD1 ASN A 97 -6.603 -7.429 -9.803 1.00 0.00 O flip ATOM 1571 ND2 ASN A 97 -8.121 -8.271 -8.476 1.00 0.00 N flip ATOM 0 H ASN A 97 -6.010 -4.841 -8.432 1.00 0.00 H new ATOM 0 HA ASN A 97 -8.055 -6.059 -6.569 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.298 -6.913 -7.628 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -6.322 -7.888 -6.592 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -8.499 -8.446 -7.545 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -8.614 -8.616 -9.300 1.00 0.00 H new ATOM 1578 N THR A 98 -6.348 -3.997 -5.379 1.00 0.00 N ATOM 1579 CA THR A 98 -5.637 -3.422 -4.188 1.00 0.00 C ATOM 1580 C THR A 98 -6.262 -3.850 -2.834 1.00 0.00 C ATOM 1581 O THR A 98 -5.524 -3.976 -1.874 1.00 0.00 O ATOM 1582 CB THR A 98 -5.645 -1.884 -4.342 1.00 0.00 C ATOM 1583 OG1 THR A 98 -4.810 -1.312 -3.345 1.00 0.00 O ATOM 1584 CG2 THR A 98 -7.062 -1.329 -4.190 1.00 0.00 C ATOM 0 H THR A 98 -6.856 -3.322 -5.950 1.00 0.00 H new ATOM 0 HA THR A 98 -4.619 -3.810 -4.165 1.00 0.00 H new ATOM 0 HB THR A 98 -5.277 -1.631 -5.336 1.00 0.00 H new ATOM 0 HG1 THR A 98 -4.810 -0.336 -3.439 1.00 0.00 H new ATOM 0 HG21 THR A 98 -7.042 -0.245 -4.302 1.00 0.00 H new ATOM 0 HG22 THR A 98 -7.706 -1.761 -4.956 1.00 0.00 H new ATOM 0 HG23 THR A 98 -7.449 -1.585 -3.204 1.00 0.00 H new ATOM 1592 N PRO A 99 -7.577 -4.068 -2.747 1.00 0.00 N ATOM 1593 CA PRO A 99 -8.153 -4.478 -1.437 1.00 0.00 C ATOM 1594 C PRO A 99 -7.627 -5.865 -1.031 1.00 0.00 C ATOM 1595 O PRO A 99 -7.392 -6.118 0.136 1.00 0.00 O ATOM 1596 CB PRO A 99 -9.661 -4.487 -1.677 1.00 0.00 C ATOM 1597 CG PRO A 99 -9.808 -4.671 -3.146 1.00 0.00 C ATOM 1598 CD PRO A 99 -8.632 -3.979 -3.782 1.00 0.00 C ATOM 0 HA PRO A 99 -7.880 -3.810 -0.620 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -10.145 -5.294 -1.126 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -10.120 -3.555 -1.347 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.822 -5.730 -3.405 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -10.747 -4.244 -3.499 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.329 -4.470 -4.707 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.863 -2.943 -4.032 1.00 0.00 H new ATOM 1606 N ALA A 100 -7.416 -6.765 -1.977 1.00 0.00 N ATOM 1607 CA ALA A 100 -6.875 -8.124 -1.606 1.00 0.00 C ATOM 1608 C ALA A 100 -5.529 -7.969 -0.871 1.00 0.00 C ATOM 1609 O ALA A 100 -5.241 -8.704 0.056 1.00 0.00 O ATOM 1610 CB ALA A 100 -6.669 -8.894 -2.921 1.00 0.00 C ATOM 0 H ALA A 100 -7.591 -6.621 -2.971 1.00 0.00 H new ATOM 0 HA ALA A 100 -7.562 -8.654 -0.945 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.277 -9.888 -2.703 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.622 -8.986 -3.442 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.962 -8.355 -3.551 1.00 0.00 H new ATOM 1616 N VAL A 101 -4.706 -7.014 -1.268 1.00 0.00 N ATOM 1617 CA VAL A 101 -3.383 -6.827 -0.565 1.00 0.00 C ATOM 1618 C VAL A 101 -3.627 -6.391 0.890 1.00 0.00 C ATOM 1619 O VAL A 101 -2.950 -6.844 1.794 1.00 0.00 O ATOM 1620 CB VAL A 101 -2.621 -5.725 -1.328 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -1.252 -5.497 -0.680 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -2.430 -6.147 -2.791 1.00 0.00 C ATOM 0 H VAL A 101 -4.888 -6.367 -2.035 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.810 -7.754 -0.549 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.197 -4.801 -1.289 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.718 -4.717 -1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -1.387 -5.190 0.357 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.676 -6.422 -0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.891 -5.366 -3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.859 -7.075 -2.831 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.404 -6.300 -3.256 1.00 0.00 H new ATOM 1632 N ILE A 102 -4.586 -5.516 1.126 1.00 0.00 N ATOM 1633 CA ILE A 102 -4.852 -5.068 2.540 1.00 0.00 C ATOM 1634 C ILE A 102 -5.349 -6.259 3.378 1.00 0.00 C ATOM 1635 O ILE A 102 -4.962 -6.414 4.521 1.00 0.00 O ATOM 1636 CB ILE A 102 -5.929 -3.971 2.465 1.00 0.00 C ATOM 1637 CG1 ILE A 102 -5.405 -2.800 1.620 1.00 0.00 C ATOM 1638 CG2 ILE A 102 -6.261 -3.469 3.874 1.00 0.00 C ATOM 1639 CD1 ILE A 102 -6.538 -2.230 0.760 1.00 0.00 C ATOM 0 H ILE A 102 -5.186 -5.099 0.415 1.00 0.00 H new ATOM 0 HA ILE A 102 -3.948 -4.685 3.013 1.00 0.00 H new ATOM 0 HB ILE A 102 -6.829 -4.383 2.008 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.003 -2.022 2.270 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -4.587 -3.137 0.983 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -7.024 -2.693 3.813 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.633 -4.297 4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -5.362 -3.059 4.335 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.160 -1.400 0.163 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -6.920 -3.008 0.099 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.342 -1.876 1.405 1.00 0.00 H new ATOM 1651 N SER A 103 -6.197 -7.106 2.824 1.00 0.00 N ATOM 1652 CA SER A 103 -6.694 -8.287 3.622 1.00 0.00 C ATOM 1653 C SER A 103 -5.505 -9.171 4.023 1.00 0.00 C ATOM 1654 O SER A 103 -5.395 -9.580 5.164 1.00 0.00 O ATOM 1655 CB SER A 103 -7.658 -9.068 2.714 1.00 0.00 C ATOM 1656 OG SER A 103 -6.918 -9.692 1.671 1.00 0.00 O ATOM 0 H SER A 103 -6.561 -7.035 1.874 1.00 0.00 H new ATOM 0 HA SER A 103 -7.200 -7.967 4.533 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.195 -9.818 3.294 1.00 0.00 H new ATOM 0 HB3 SER A 103 -8.405 -8.395 2.293 1.00 0.00 H new ATOM 0 HG SER A 103 -6.438 -9.010 1.157 1.00 0.00 H new ATOM 1662 N ALA A 104 -4.601 -9.455 3.105 1.00 0.00 N ATOM 1663 CA ALA A 104 -3.408 -10.303 3.470 1.00 0.00 C ATOM 1664 C ALA A 104 -2.637 -9.652 4.638 1.00 0.00 C ATOM 1665 O ALA A 104 -2.096 -10.340 5.482 1.00 0.00 O ATOM 1666 CB ALA A 104 -2.514 -10.378 2.221 1.00 0.00 C ATOM 0 H ALA A 104 -4.635 -9.143 2.135 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.717 -11.299 3.787 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -1.635 -10.984 2.439 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.072 -10.830 1.401 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -2.201 -9.373 1.937 1.00 0.00 H new ATOM 1672 N PHE A 105 -2.593 -8.331 4.701 1.00 0.00 N ATOM 1673 CA PHE A 105 -1.860 -7.655 5.837 1.00 0.00 C ATOM 1674 C PHE A 105 -2.417 -8.137 7.186 1.00 0.00 C ATOM 1675 O PHE A 105 -1.672 -8.334 8.128 1.00 0.00 O ATOM 1676 CB PHE A 105 -2.108 -6.143 5.677 1.00 0.00 C ATOM 1677 CG PHE A 105 -1.140 -5.364 6.537 1.00 0.00 C ATOM 1678 CD1 PHE A 105 -1.244 -5.405 7.931 1.00 0.00 C ATOM 1679 CD2 PHE A 105 -0.137 -4.597 5.937 1.00 0.00 C ATOM 1680 CE1 PHE A 105 -0.347 -4.680 8.717 1.00 0.00 C ATOM 1681 CE2 PHE A 105 0.760 -3.876 6.725 1.00 0.00 C ATOM 1682 CZ PHE A 105 0.654 -3.916 8.115 1.00 0.00 C ATOM 0 H PHE A 105 -3.026 -7.700 4.026 1.00 0.00 H new ATOM 0 HA PHE A 105 -0.795 -7.888 5.813 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -1.990 -5.856 4.632 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -3.133 -5.903 5.960 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -2.017 -5.997 8.399 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -0.056 -4.563 4.861 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -0.428 -4.710 9.794 1.00 0.00 H new ATOM 0 HE2 PHE A 105 1.536 -3.287 6.259 1.00 0.00 H new ATOM 0 HZ PHE A 105 1.347 -3.356 8.726 1.00 0.00 H new ATOM 1692 N SER A 106 -3.718 -8.338 7.290 1.00 0.00 N ATOM 1693 CA SER A 106 -4.289 -8.818 8.599 1.00 0.00 C ATOM 1694 C SER A 106 -3.977 -10.309 8.830 1.00 0.00 C ATOM 1695 O SER A 106 -4.013 -10.771 9.955 1.00 0.00 O ATOM 1696 CB SER A 106 -5.806 -8.590 8.533 1.00 0.00 C ATOM 1697 OG SER A 106 -6.076 -7.198 8.636 1.00 0.00 O ATOM 0 H SER A 106 -4.396 -8.194 6.542 1.00 0.00 H new ATOM 0 HA SER A 106 -3.845 -8.271 9.431 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.204 -8.981 7.597 1.00 0.00 H new ATOM 0 HB3 SER A 106 -6.302 -9.129 9.340 1.00 0.00 H new ATOM 0 HG SER A 106 -7.044 -7.048 8.593 1.00 0.00 H new ATOM 1703 N THR A 107 -3.655 -11.069 7.799 1.00 0.00 N ATOM 1704 CA THR A 107 -3.322 -12.514 8.025 1.00 0.00 C ATOM 1705 C THR A 107 -1.818 -12.655 8.289 1.00 0.00 C ATOM 1706 O THR A 107 -1.409 -13.484 9.082 1.00 0.00 O ATOM 1707 CB THR A 107 -3.723 -13.268 6.747 1.00 0.00 C ATOM 1708 OG1 THR A 107 -5.073 -12.961 6.419 1.00 0.00 O ATOM 1709 CG2 THR A 107 -3.585 -14.774 6.980 1.00 0.00 C ATOM 0 H THR A 107 -3.610 -10.755 6.830 1.00 0.00 H new ATOM 0 HA THR A 107 -3.852 -12.919 8.887 1.00 0.00 H new ATOM 0 HB THR A 107 -3.072 -12.965 5.927 1.00 0.00 H new ATOM 0 HG1 THR A 107 -5.329 -13.440 5.603 1.00 0.00 H new ATOM 0 HG21 THR A 107 -3.869 -15.310 6.074 1.00 0.00 H new ATOM 0 HG22 THR A 107 -2.551 -15.010 7.232 1.00 0.00 H new ATOM 0 HG23 THR A 107 -4.236 -15.077 7.800 1.00 0.00 H new ATOM 1717 N MET A 108 -0.987 -11.845 7.658 1.00 0.00 N ATOM 1718 CA MET A 108 0.483 -11.954 7.930 1.00 0.00 C ATOM 1719 C MET A 108 0.801 -11.352 9.306 1.00 0.00 C ATOM 1720 O MET A 108 1.692 -11.826 9.988 1.00 0.00 O ATOM 1721 CB MET A 108 1.205 -11.184 6.817 1.00 0.00 C ATOM 1722 CG MET A 108 1.179 -12.009 5.527 1.00 0.00 C ATOM 1723 SD MET A 108 2.221 -13.479 5.724 1.00 0.00 S ATOM 1724 CE MET A 108 1.088 -14.669 4.965 1.00 0.00 C ATOM 0 H MET A 108 -1.259 -11.131 6.983 1.00 0.00 H new ATOM 0 HA MET A 108 0.809 -12.994 7.942 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.723 -10.220 6.655 1.00 0.00 H new ATOM 0 HB3 MET A 108 2.235 -10.980 7.110 1.00 0.00 H new ATOM 0 HG2 MET A 108 0.156 -12.305 5.293 1.00 0.00 H new ATOM 0 HG3 MET A 108 1.536 -11.407 4.691 1.00 0.00 H new ATOM 0 HE1 MET A 108 1.066 -15.581 5.561 1.00 0.00 H new ATOM 0 HE2 MET A 108 0.087 -14.240 4.920 1.00 0.00 H new ATOM 0 HE3 MET A 108 1.428 -14.903 3.956 1.00 0.00 H new ATOM 1734 N MET A 109 0.079 -10.326 9.744 1.00 0.00 N ATOM 1735 CA MET A 109 0.380 -9.754 11.104 1.00 0.00 C ATOM 1736 C MET A 109 0.207 -10.844 12.178 1.00 0.00 C ATOM 1737 O MET A 109 0.918 -10.847 13.160 1.00 0.00 O ATOM 1738 CB MET A 109 -0.589 -8.575 11.341 1.00 0.00 C ATOM 1739 CG MET A 109 -2.041 -9.063 11.370 1.00 0.00 C ATOM 1740 SD MET A 109 -2.512 -9.481 13.066 1.00 0.00 S ATOM 1741 CE MET A 109 -3.846 -8.269 13.236 1.00 0.00 C ATOM 0 H MET A 109 -0.681 -9.877 9.232 1.00 0.00 H new ATOM 0 HA MET A 109 1.409 -9.399 11.161 1.00 0.00 H new ATOM 0 HB2 MET A 109 -0.347 -8.083 12.283 1.00 0.00 H new ATOM 0 HB3 MET A 109 -0.466 -7.833 10.553 1.00 0.00 H new ATOM 0 HG2 MET A 109 -2.702 -8.290 10.979 1.00 0.00 H new ATOM 0 HG3 MET A 109 -2.154 -9.935 10.726 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.288 -8.351 14.229 1.00 0.00 H new ATOM 0 HE2 MET A 109 -3.445 -7.265 13.100 1.00 0.00 H new ATOM 0 HE3 MET A 109 -4.609 -8.460 12.482 1.00 0.00 H new ATOM 1751 N SER A 110 -0.700 -11.790 12.007 1.00 0.00 N ATOM 1752 CA SER A 110 -0.828 -12.863 13.061 1.00 0.00 C ATOM 1753 C SER A 110 0.481 -13.666 13.140 1.00 0.00 C ATOM 1754 O SER A 110 0.866 -14.111 14.207 1.00 0.00 O ATOM 1755 CB SER A 110 -1.991 -13.772 12.641 1.00 0.00 C ATOM 1756 OG SER A 110 -3.219 -13.079 12.824 1.00 0.00 O ATOM 0 H SER A 110 -1.336 -11.866 11.213 1.00 0.00 H new ATOM 0 HA SER A 110 -1.018 -12.432 14.044 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.879 -14.067 11.598 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.985 -14.687 13.233 1.00 0.00 H new ATOM 0 HG SER A 110 -3.045 -12.117 12.892 1.00 0.00 H new ATOM 1762 N VAL A 111 1.183 -13.843 12.035 1.00 0.00 N ATOM 1763 CA VAL A 111 2.477 -14.606 12.095 1.00 0.00 C ATOM 1764 C VAL A 111 3.622 -13.723 12.644 1.00 0.00 C ATOM 1765 O VAL A 111 4.690 -14.230 12.933 1.00 0.00 O ATOM 1766 CB VAL A 111 2.789 -15.061 10.658 1.00 0.00 C ATOM 1767 CG1 VAL A 111 4.076 -15.890 10.645 1.00 0.00 C ATOM 1768 CG2 VAL A 111 1.633 -15.918 10.132 1.00 0.00 C ATOM 0 H VAL A 111 0.920 -13.498 11.112 1.00 0.00 H new ATOM 0 HA VAL A 111 2.387 -15.458 12.768 1.00 0.00 H new ATOM 0 HB VAL A 111 2.916 -14.183 10.024 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.293 -16.210 9.626 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.902 -15.285 11.019 1.00 0.00 H new ATOM 0 HG13 VAL A 111 3.951 -16.766 11.281 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.853 -16.241 9.114 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.508 -16.792 10.771 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.714 -15.332 10.136 1.00 0.00 H new ATOM 1778 N HIS A 112 3.425 -12.422 12.815 1.00 0.00 N ATOM 1779 CA HIS A 112 4.523 -11.578 13.368 1.00 0.00 C ATOM 1780 C HIS A 112 4.437 -11.567 14.918 1.00 0.00 C ATOM 1781 O HIS A 112 5.430 -11.354 15.588 1.00 0.00 O ATOM 1782 CB HIS A 112 4.327 -10.178 12.717 1.00 0.00 C ATOM 1783 CG HIS A 112 3.783 -9.165 13.690 1.00 0.00 C ATOM 1784 ND1 HIS A 112 2.518 -9.247 14.233 1.00 0.00 N ATOM 1785 CD2 HIS A 112 4.350 -8.063 14.233 1.00 0.00 C ATOM 1786 CE1 HIS A 112 2.366 -8.213 15.069 1.00 0.00 C ATOM 1787 NE2 HIS A 112 3.460 -7.451 15.110 1.00 0.00 N ATOM 0 H HIS A 112 2.561 -11.927 12.595 1.00 0.00 H new ATOM 0 HA HIS A 112 5.522 -11.949 13.140 1.00 0.00 H new ATOM 0 HB2 HIS A 112 5.281 -9.826 12.325 1.00 0.00 H new ATOM 0 HB3 HIS A 112 3.647 -10.266 11.870 1.00 0.00 H new ATOM 0 HD1 HIS A 112 1.823 -9.966 14.033 1.00 0.00 H new ATOM 0 HD2 HIS A 112 5.348 -7.710 14.017 1.00 0.00 H new ATOM 0 HE1 HIS A 112 1.469 -8.020 15.639 1.00 0.00 H new ATOM 1795 N ARG A 113 3.261 -11.794 15.494 1.00 0.00 N ATOM 1796 CA ARG A 113 3.156 -11.791 16.990 1.00 0.00 C ATOM 1797 C ARG A 113 3.314 -13.217 17.545 1.00 0.00 C ATOM 1798 O ARG A 113 3.874 -13.406 18.609 1.00 0.00 O ATOM 1799 CB ARG A 113 1.759 -11.241 17.315 1.00 0.00 C ATOM 1800 CG ARG A 113 1.756 -10.657 18.729 1.00 0.00 C ATOM 1801 CD ARG A 113 0.816 -9.450 18.780 1.00 0.00 C ATOM 1802 NE ARG A 113 0.157 -9.535 20.113 1.00 0.00 N ATOM 1803 CZ ARG A 113 -1.059 -10.001 20.211 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -1.329 -11.210 19.803 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -2.003 -9.256 20.717 1.00 0.00 N ATOM 0 H ARG A 113 2.390 -11.977 14.995 1.00 0.00 H new ATOM 0 HA ARG A 113 3.940 -11.184 17.442 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.482 -10.473 16.593 1.00 0.00 H new ATOM 0 HB3 ARG A 113 1.017 -12.035 17.237 1.00 0.00 H new ATOM 0 HG2 ARG A 113 1.434 -11.413 19.446 1.00 0.00 H new ATOM 0 HG3 ARG A 113 2.765 -10.358 19.013 1.00 0.00 H new ATOM 0 HD2 ARG A 113 1.366 -8.516 18.670 1.00 0.00 H new ATOM 0 HD3 ARG A 113 0.083 -9.485 17.974 1.00 0.00 H new ATOM 0 HE ARG A 113 0.655 -9.229 20.949 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -0.590 -11.792 19.407 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -2.279 -11.574 19.880 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -1.791 -8.311 21.036 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -2.953 -9.619 20.794 1.00 0.00 H new ATOM 1819 N GLY A 114 2.830 -14.227 16.842 1.00 0.00 N ATOM 1820 CA GLY A 114 2.966 -15.626 17.351 1.00 0.00 C ATOM 1821 C GLY A 114 4.454 -15.982 17.488 1.00 0.00 C ATOM 1822 O GLY A 114 4.855 -16.607 18.452 1.00 0.00 O ATOM 0 H GLY A 114 2.352 -14.136 15.946 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.468 -15.723 18.316 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.477 -16.321 16.669 1.00 0.00 H new ATOM 1826 N GLU A 115 5.278 -15.593 16.536 1.00 0.00 N ATOM 1827 CA GLU A 115 6.733 -15.915 16.626 1.00 0.00 C ATOM 1828 C GLU A 115 7.558 -14.620 16.716 1.00 0.00 C ATOM 1829 O GLU A 115 8.315 -14.300 15.817 1.00 0.00 O ATOM 1830 CB GLU A 115 7.050 -16.673 15.335 1.00 0.00 C ATOM 1831 CG GLU A 115 8.497 -17.170 15.376 1.00 0.00 C ATOM 1832 CD GLU A 115 8.614 -18.466 14.571 1.00 0.00 C ATOM 1833 OE1 GLU A 115 7.726 -19.295 14.688 1.00 0.00 O ATOM 1834 OE2 GLU A 115 9.590 -18.609 13.854 1.00 0.00 O ATOM 0 H GLU A 115 5.001 -15.069 15.706 1.00 0.00 H new ATOM 0 HA GLU A 115 6.975 -16.504 17.511 1.00 0.00 H new ATOM 0 HB2 GLU A 115 6.368 -17.516 15.219 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.902 -16.022 14.473 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.165 -16.413 14.965 1.00 0.00 H new ATOM 0 HG3 GLU A 115 8.805 -17.341 16.408 1.00 0.00 H new ATOM 1841 N VAL A 116 7.421 -13.869 17.791 1.00 0.00 N ATOM 1842 CA VAL A 116 8.211 -12.592 17.916 1.00 0.00 C ATOM 1843 C VAL A 116 9.687 -12.873 18.274 1.00 0.00 C ATOM 1844 O VAL A 116 10.566 -12.265 17.693 1.00 0.00 O ATOM 1845 CB VAL A 116 7.531 -11.747 19.009 1.00 0.00 C ATOM 1846 CG1 VAL A 116 8.259 -10.406 19.152 1.00 0.00 C ATOM 1847 CG2 VAL A 116 6.072 -11.488 18.620 1.00 0.00 C ATOM 0 H VAL A 116 6.806 -14.080 18.577 1.00 0.00 H new ATOM 0 HA VAL A 116 8.222 -12.060 16.965 1.00 0.00 H new ATOM 0 HB VAL A 116 7.570 -12.286 19.956 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.775 -9.810 19.926 1.00 0.00 H new ATOM 0 HG12 VAL A 116 9.299 -10.584 19.427 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.221 -9.869 18.204 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.590 -10.890 19.393 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.038 -10.951 17.672 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.549 -12.439 18.518 1.00 0.00 H new ATOM 1857 N PRO A 117 9.940 -13.771 19.212 1.00 0.00 N ATOM 1858 CA PRO A 117 11.342 -14.068 19.592 1.00 0.00 C ATOM 1859 C PRO A 117 11.993 -14.997 18.555 1.00 0.00 C ATOM 1860 O PRO A 117 11.312 -15.749 17.881 1.00 0.00 O ATOM 1861 CB PRO A 117 11.215 -14.767 20.940 1.00 0.00 C ATOM 1862 CG PRO A 117 9.844 -15.366 20.950 1.00 0.00 C ATOM 1863 CD PRO A 117 8.986 -14.578 19.991 1.00 0.00 C ATOM 0 HA PRO A 117 11.967 -13.177 19.640 1.00 0.00 H new ATOM 0 HB2 PRO A 117 11.980 -15.535 21.058 1.00 0.00 H new ATOM 0 HB3 PRO A 117 11.342 -14.062 21.762 1.00 0.00 H new ATOM 0 HG2 PRO A 117 9.884 -16.414 20.653 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.421 -15.335 21.954 1.00 0.00 H new ATOM 0 HD2 PRO A 117 8.406 -15.237 19.346 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.275 -13.946 20.523 1.00 0.00 H new ATOM 1871 N CYS A 118 13.303 -14.956 18.419 1.00 0.00 N ATOM 1872 CA CYS A 118 13.982 -15.840 17.425 1.00 0.00 C ATOM 1873 C CYS A 118 15.084 -16.662 18.111 1.00 0.00 C ATOM 1874 O CYS A 118 15.621 -16.254 19.124 1.00 0.00 O ATOM 1875 CB CYS A 118 14.586 -14.887 16.393 1.00 0.00 C ATOM 1876 SG CYS A 118 13.300 -14.357 15.235 1.00 0.00 S ATOM 0 H CYS A 118 13.924 -14.349 18.954 1.00 0.00 H new ATOM 0 HA CYS A 118 13.294 -16.551 16.968 1.00 0.00 H new ATOM 0 HB2 CYS A 118 15.020 -14.021 16.892 1.00 0.00 H new ATOM 0 HB3 CYS A 118 15.394 -15.382 15.854 1.00 0.00 H new ATOM 0 HG CYS A 118 13.813 -13.545 14.359 1.00 0.00 H new ATOM 1882 N THR A 119 15.427 -17.814 17.573 1.00 0.00 N ATOM 1883 CA THR A 119 16.494 -18.647 18.205 1.00 0.00 C ATOM 1884 C THR A 119 17.678 -18.818 17.239 1.00 0.00 C ATOM 1885 O THR A 119 17.611 -19.601 16.309 1.00 0.00 O ATOM 1886 CB THR A 119 15.829 -19.997 18.483 1.00 0.00 C ATOM 1887 OG1 THR A 119 15.140 -20.431 17.318 1.00 0.00 O ATOM 1888 CG2 THR A 119 14.839 -19.854 19.641 1.00 0.00 C ATOM 0 H THR A 119 15.013 -18.207 16.728 1.00 0.00 H new ATOM 0 HA THR A 119 16.889 -18.192 19.113 1.00 0.00 H new ATOM 0 HB THR A 119 16.591 -20.729 18.750 1.00 0.00 H new ATOM 0 HG1 THR A 119 15.710 -20.298 16.532 1.00 0.00 H new ATOM 0 HG21 THR A 119 14.367 -20.817 19.837 1.00 0.00 H new ATOM 0 HG22 THR A 119 15.369 -19.521 20.534 1.00 0.00 H new ATOM 0 HG23 THR A 119 14.075 -19.122 19.378 1.00 0.00 H new ATOM 1896 N VAL A 120 18.759 -18.095 17.448 1.00 0.00 N ATOM 1897 CA VAL A 120 19.936 -18.226 16.535 1.00 0.00 C ATOM 1898 C VAL A 120 21.151 -18.736 17.317 1.00 0.00 C ATOM 1899 O VAL A 120 21.601 -18.028 18.201 1.00 0.00 O ATOM 1900 CB VAL A 120 20.190 -16.811 16.002 1.00 0.00 C ATOM 1901 CG1 VAL A 120 21.377 -16.827 15.036 1.00 0.00 C ATOM 1902 CG2 VAL A 120 18.946 -16.310 15.260 1.00 0.00 C ATOM 1903 OXT VAL A 120 21.607 -19.827 17.017 1.00 0.00 O ATOM 0 H VAL A 120 18.872 -17.425 18.208 1.00 0.00 H new ATOM 0 HA VAL A 120 19.757 -18.935 15.726 1.00 0.00 H new ATOM 0 HB VAL A 120 20.410 -16.149 16.840 1.00 0.00 H new ATOM 0 HG11 VAL A 120 21.554 -15.819 14.660 1.00 0.00 H new ATOM 0 HG12 VAL A 120 22.266 -17.181 15.558 1.00 0.00 H new ATOM 0 HG13 VAL A 120 21.158 -17.493 14.201 1.00 0.00 H new ATOM 0 HG21 VAL A 120 19.128 -15.304 14.882 1.00 0.00 H new ATOM 0 HG22 VAL A 120 18.726 -16.977 14.426 1.00 0.00 H new ATOM 0 HG23 VAL A 120 18.097 -16.292 15.944 1.00 0.00 H new TER 1913 VAL A 120 ATOM 1914 N GLN B 1 -0.478 -5.103 -23.458 1.00 0.00 N ATOM 1915 CA GLN B 1 0.539 -4.603 -22.488 1.00 0.00 C ATOM 1916 C GLN B 1 1.023 -5.749 -21.588 1.00 0.00 C ATOM 1917 O GLN B 1 0.231 -6.402 -20.934 1.00 0.00 O ATOM 1918 CB GLN B 1 -0.191 -3.542 -21.662 1.00 0.00 C ATOM 1919 CG GLN B 1 -0.087 -2.187 -22.365 1.00 0.00 C ATOM 1920 CD GLN B 1 -0.701 -1.100 -21.473 1.00 0.00 C ATOM 1921 OE1 GLN B 1 -0.060 -0.109 -21.183 1.00 0.00 O ATOM 1922 NE2 GLN B 1 -1.924 -1.237 -21.022 1.00 0.00 N ATOM 0 H1 GLN B 1 -0.798 -4.318 -24.061 1.00 0.00 H new ATOM 0 H2 GLN B 1 -0.056 -5.846 -24.051 1.00 0.00 H new ATOM 0 H3 GLN B 1 -1.290 -5.494 -22.939 1.00 0.00 H new ATOM 0 HA GLN B 1 1.420 -4.198 -22.985 1.00 0.00 H new ATOM 0 HB2 GLN B 1 -1.238 -3.820 -21.537 1.00 0.00 H new ATOM 0 HB3 GLN B 1 0.243 -3.480 -20.664 1.00 0.00 H new ATOM 0 HG2 GLN B 1 0.957 -1.953 -22.575 1.00 0.00 H new ATOM 0 HG3 GLN B 1 -0.605 -2.222 -23.323 1.00 0.00 H new ATOM 0 HE21 GLN B 1 -2.466 -2.067 -21.262 1.00 0.00 H new ATOM 0 HE22 GLN B 1 -2.333 -0.514 -20.431 1.00 0.00 H new ATOM 1933 N LYS B 2 2.316 -6.003 -21.546 1.00 0.00 N ATOM 1934 CA LYS B 2 2.834 -7.108 -20.685 1.00 0.00 C ATOM 1935 C LYS B 2 4.028 -6.617 -19.852 1.00 0.00 C ATOM 1936 O LYS B 2 5.048 -6.232 -20.394 1.00 0.00 O ATOM 1937 CB LYS B 2 3.274 -8.198 -21.663 1.00 0.00 C ATOM 1938 CG LYS B 2 2.103 -9.144 -21.936 1.00 0.00 C ATOM 1939 CD LYS B 2 2.585 -10.322 -22.785 1.00 0.00 C ATOM 1940 CE LYS B 2 1.611 -11.492 -22.634 1.00 0.00 C ATOM 1941 NZ LYS B 2 2.069 -12.219 -21.416 1.00 0.00 N ATOM 0 H LYS B 2 3.026 -5.492 -22.070 1.00 0.00 H new ATOM 0 HA LYS B 2 2.084 -7.470 -19.981 1.00 0.00 H new ATOM 0 HB2 LYS B 2 3.616 -7.748 -22.595 1.00 0.00 H new ATOM 0 HB3 LYS B 2 4.115 -8.754 -21.249 1.00 0.00 H new ATOM 0 HG2 LYS B 2 1.687 -9.506 -20.996 1.00 0.00 H new ATOM 0 HG3 LYS B 2 1.305 -8.612 -22.453 1.00 0.00 H new ATOM 0 HD2 LYS B 2 2.654 -10.025 -23.832 1.00 0.00 H new ATOM 0 HD3 LYS B 2 3.585 -10.624 -22.473 1.00 0.00 H new ATOM 0 HE2 LYS B 2 0.586 -11.140 -22.522 1.00 0.00 H new ATOM 0 HE3 LYS B 2 1.632 -12.139 -23.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 1.288 -12.793 -21.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 2.867 -12.839 -21.661 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 2.372 -11.533 -20.696 1.00 0.00 H new ATOM 1955 N THR B 3 3.915 -6.625 -18.538 1.00 0.00 N ATOM 1956 CA THR B 3 5.048 -6.156 -17.686 1.00 0.00 C ATOM 1957 C THR B 3 5.471 -7.264 -16.708 1.00 0.00 C ATOM 1958 O THR B 3 4.803 -8.273 -16.586 1.00 0.00 O ATOM 1959 CB THR B 3 4.497 -4.950 -16.923 1.00 0.00 C ATOM 1960 OG1 THR B 3 3.153 -5.208 -16.543 1.00 0.00 O ATOM 1961 CG2 THR B 3 4.548 -3.711 -17.818 1.00 0.00 C ATOM 0 H THR B 3 3.088 -6.936 -18.027 1.00 0.00 H new ATOM 0 HA THR B 3 5.928 -5.899 -18.275 1.00 0.00 H new ATOM 0 HB THR B 3 5.100 -4.776 -16.032 1.00 0.00 H new ATOM 0 HG1 THR B 3 2.798 -4.437 -16.052 1.00 0.00 H new ATOM 0 HG21 THR B 3 4.155 -2.852 -17.273 1.00 0.00 H new ATOM 0 HG22 THR B 3 5.580 -3.515 -18.109 1.00 0.00 H new ATOM 0 HG23 THR B 3 3.945 -3.881 -18.710 1.00 0.00 H new ATOM 1969 N GLY B 4 6.575 -7.087 -16.007 1.00 0.00 N ATOM 1970 CA GLY B 4 7.026 -8.134 -15.044 1.00 0.00 C ATOM 1971 C GLY B 4 7.229 -7.504 -13.659 1.00 0.00 C ATOM 1972 O GLY B 4 7.407 -6.305 -13.544 1.00 0.00 O ATOM 0 H GLY B 4 7.175 -6.264 -16.065 1.00 0.00 H new ATOM 0 HA2 GLY B 4 6.287 -8.933 -14.987 1.00 0.00 H new ATOM 0 HA3 GLY B 4 7.956 -8.585 -15.390 1.00 0.00 H new ATOM 1976 N THR B 5 7.205 -8.295 -12.605 1.00 0.00 N ATOM 1977 CA THR B 5 7.397 -7.726 -11.238 1.00 0.00 C ATOM 1978 C THR B 5 8.503 -8.491 -10.493 1.00 0.00 C ATOM 1979 O THR B 5 8.764 -9.643 -10.786 1.00 0.00 O ATOM 1980 CB THR B 5 6.050 -7.915 -10.539 1.00 0.00 C ATOM 1981 OG1 THR B 5 5.003 -7.769 -11.488 1.00 0.00 O ATOM 1982 CG2 THR B 5 5.892 -6.866 -9.437 1.00 0.00 C ATOM 0 H THR B 5 7.061 -9.304 -12.638 1.00 0.00 H new ATOM 0 HA THR B 5 7.700 -6.679 -11.265 1.00 0.00 H new ATOM 0 HB THR B 5 6.006 -8.911 -10.097 1.00 0.00 H new ATOM 0 HG1 THR B 5 4.139 -7.891 -11.043 1.00 0.00 H new ATOM 0 HG21 THR B 5 4.932 -7.002 -8.940 1.00 0.00 H new ATOM 0 HG22 THR B 5 6.696 -6.978 -8.710 1.00 0.00 H new ATOM 0 HG23 THR B 5 5.936 -5.869 -9.875 1.00 0.00 H new ATOM 1990 N ALA B 6 9.154 -7.864 -9.534 1.00 0.00 N ATOM 1991 CA ALA B 6 10.237 -8.566 -8.782 1.00 0.00 C ATOM 1992 C ALA B 6 10.136 -8.244 -7.284 1.00 0.00 C ATOM 1993 O ALA B 6 11.139 -8.048 -6.624 1.00 0.00 O ATOM 1994 CB ALA B 6 11.543 -8.016 -9.358 1.00 0.00 C ATOM 0 H ALA B 6 8.979 -6.902 -9.245 1.00 0.00 H new ATOM 0 HA ALA B 6 10.171 -9.649 -8.882 1.00 0.00 H new ATOM 0 HB1 ALA B 6 12.389 -8.485 -8.855 1.00 0.00 H new ATOM 0 HB2 ALA B 6 11.590 -8.233 -10.425 1.00 0.00 H new ATOM 0 HB3 ALA B 6 11.582 -6.938 -9.205 1.00 0.00 H new ATOM 2000 N GLU B 7 8.935 -8.173 -6.733 1.00 0.00 N ATOM 2001 CA GLU B 7 8.784 -7.848 -5.276 1.00 0.00 C ATOM 2002 C GLU B 7 9.460 -6.501 -4.981 1.00 0.00 C ATOM 2003 O GLU B 7 10.275 -6.391 -4.084 1.00 0.00 O ATOM 2004 CB GLU B 7 9.470 -8.997 -4.516 1.00 0.00 C ATOM 2005 CG GLU B 7 8.482 -9.632 -3.533 1.00 0.00 C ATOM 2006 CD GLU B 7 9.216 -10.641 -2.649 1.00 0.00 C ATOM 2007 OE1 GLU B 7 10.243 -10.280 -2.098 1.00 0.00 O ATOM 2008 OE2 GLU B 7 8.740 -11.759 -2.538 1.00 0.00 O ATOM 0 H GLU B 7 8.059 -8.327 -7.233 1.00 0.00 H new ATOM 0 HA GLU B 7 7.741 -7.757 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU B 7 9.829 -9.747 -5.220 1.00 0.00 H new ATOM 0 HB3 GLU B 7 10.341 -8.621 -3.979 1.00 0.00 H new ATOM 0 HG2 GLU B 7 8.020 -8.861 -2.916 1.00 0.00 H new ATOM 0 HG3 GLU B 7 7.679 -10.127 -4.078 1.00 0.00 H new ATOM 2015 N VAL B 8 9.125 -5.469 -5.735 1.00 0.00 N ATOM 2016 CA VAL B 8 9.761 -4.122 -5.487 1.00 0.00 C ATOM 2017 C VAL B 8 9.530 -3.706 -4.026 1.00 0.00 C ATOM 2018 O VAL B 8 10.426 -3.202 -3.376 1.00 0.00 O ATOM 2019 CB VAL B 8 9.090 -3.124 -6.448 1.00 0.00 C ATOM 2020 CG1 VAL B 8 9.667 -1.723 -6.226 1.00 0.00 C ATOM 2021 CG2 VAL B 8 9.359 -3.555 -7.892 1.00 0.00 C ATOM 0 H VAL B 8 8.450 -5.499 -6.499 1.00 0.00 H new ATOM 0 HA VAL B 8 10.837 -4.151 -5.660 1.00 0.00 H new ATOM 0 HB VAL B 8 8.017 -3.108 -6.259 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.189 -1.020 -6.908 1.00 0.00 H new ATOM 0 HG12 VAL B 8 9.483 -1.412 -5.198 1.00 0.00 H new ATOM 0 HG13 VAL B 8 10.741 -1.738 -6.414 1.00 0.00 H new ATOM 0 HG21 VAL B 8 8.885 -2.851 -8.576 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.434 -3.570 -8.073 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.950 -4.552 -8.056 1.00 0.00 H new ATOM 2031 N SER B 9 8.343 -3.935 -3.494 1.00 0.00 N ATOM 2032 CA SER B 9 8.092 -3.565 -2.053 1.00 0.00 C ATOM 2033 C SER B 9 9.117 -4.287 -1.161 1.00 0.00 C ATOM 2034 O SER B 9 9.629 -3.719 -0.213 1.00 0.00 O ATOM 2035 CB SER B 9 6.670 -4.035 -1.711 1.00 0.00 C ATOM 2036 OG SER B 9 6.309 -3.544 -0.427 1.00 0.00 O ATOM 0 H SER B 9 7.552 -4.353 -3.983 1.00 0.00 H new ATOM 0 HA SER B 9 8.190 -2.491 -1.892 1.00 0.00 H new ATOM 0 HB2 SER B 9 5.966 -3.676 -2.461 1.00 0.00 H new ATOM 0 HB3 SER B 9 6.622 -5.124 -1.723 1.00 0.00 H new ATOM 0 HG SER B 9 5.525 -4.032 -0.099 1.00 0.00 H new ATOM 2042 N SER B 10 9.439 -5.532 -1.470 1.00 0.00 N ATOM 2043 CA SER B 10 10.455 -6.268 -0.639 1.00 0.00 C ATOM 2044 C SER B 10 11.829 -5.610 -0.819 1.00 0.00 C ATOM 2045 O SER B 10 12.551 -5.404 0.140 1.00 0.00 O ATOM 2046 CB SER B 10 10.489 -7.709 -1.167 1.00 0.00 C ATOM 2047 OG SER B 10 11.443 -8.459 -0.429 1.00 0.00 O ATOM 0 H SER B 10 9.047 -6.060 -2.250 1.00 0.00 H new ATOM 0 HA SER B 10 10.201 -6.246 0.421 1.00 0.00 H new ATOM 0 HB2 SER B 10 9.503 -8.165 -1.076 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.746 -7.714 -2.226 1.00 0.00 H new ATOM 0 HG SER B 10 11.399 -9.400 -0.699 1.00 0.00 H new ATOM 2053 N ILE B 11 12.194 -5.266 -2.039 1.00 0.00 N ATOM 2054 CA ILE B 11 13.529 -4.603 -2.256 1.00 0.00 C ATOM 2055 C ILE B 11 13.508 -3.210 -1.609 1.00 0.00 C ATOM 2056 O ILE B 11 14.466 -2.806 -0.978 1.00 0.00 O ATOM 2057 CB ILE B 11 13.727 -4.497 -3.779 1.00 0.00 C ATOM 2058 CG1 ILE B 11 13.706 -5.900 -4.394 1.00 0.00 C ATOM 2059 CG2 ILE B 11 15.071 -3.832 -4.082 1.00 0.00 C ATOM 2060 CD1 ILE B 11 13.020 -5.852 -5.762 1.00 0.00 C ATOM 0 H ILE B 11 11.636 -5.412 -2.880 1.00 0.00 H new ATOM 0 HA ILE B 11 14.345 -5.170 -1.807 1.00 0.00 H new ATOM 0 HB ILE B 11 12.923 -3.896 -4.205 1.00 0.00 H new ATOM 0 HG12 ILE B 11 14.723 -6.277 -4.499 1.00 0.00 H new ATOM 0 HG13 ILE B 11 13.177 -6.589 -3.735 1.00 0.00 H new ATOM 0 HG21 ILE B 11 15.206 -3.760 -5.161 1.00 0.00 H new ATOM 0 HG22 ILE B 11 15.089 -2.833 -3.646 1.00 0.00 H new ATOM 0 HG23 ILE B 11 15.877 -4.429 -3.655 1.00 0.00 H new ATOM 0 HD11 ILE B 11 13.006 -6.851 -6.197 1.00 0.00 H new ATOM 0 HD12 ILE B 11 11.997 -5.494 -5.644 1.00 0.00 H new ATOM 0 HD13 ILE B 11 13.567 -5.177 -6.420 1.00 0.00 H new ATOM 2072 N LEU B 12 12.418 -2.478 -1.745 1.00 0.00 N ATOM 2073 CA LEU B 12 12.356 -1.115 -1.106 1.00 0.00 C ATOM 2074 C LEU B 12 12.508 -1.247 0.420 1.00 0.00 C ATOM 2075 O LEU B 12 13.120 -0.409 1.054 1.00 0.00 O ATOM 2076 CB LEU B 12 10.979 -0.523 -1.451 1.00 0.00 C ATOM 2077 CG LEU B 12 11.046 1.004 -1.374 1.00 0.00 C ATOM 2078 CD1 LEU B 12 11.321 1.575 -2.766 1.00 0.00 C ATOM 2079 CD2 LEU B 12 9.712 1.547 -0.857 1.00 0.00 C ATOM 0 H LEU B 12 11.584 -2.759 -2.261 1.00 0.00 H new ATOM 0 HA LEU B 12 13.158 -0.472 -1.470 1.00 0.00 H new ATOM 0 HB2 LEU B 12 10.678 -0.834 -2.451 1.00 0.00 H new ATOM 0 HB3 LEU B 12 10.226 -0.900 -0.759 1.00 0.00 H new ATOM 0 HG LEU B 12 11.847 1.298 -0.696 1.00 0.00 H new ATOM 0 HD11 LEU B 12 11.369 2.663 -2.710 1.00 0.00 H new ATOM 0 HD12 LEU B 12 12.271 1.189 -3.137 1.00 0.00 H new ATOM 0 HD13 LEU B 12 10.520 1.281 -3.445 1.00 0.00 H new ATOM 0 HD21 LEU B 12 9.759 2.635 -0.802 1.00 0.00 H new ATOM 0 HD22 LEU B 12 8.912 1.252 -1.536 1.00 0.00 H new ATOM 0 HD23 LEU B 12 9.514 1.142 0.135 1.00 0.00 H new ATOM 2091 N GLU B 13 11.960 -2.292 1.021 1.00 0.00 N ATOM 2092 CA GLU B 13 12.096 -2.449 2.515 1.00 0.00 C ATOM 2093 C GLU B 13 13.582 -2.472 2.913 1.00 0.00 C ATOM 2094 O GLU B 13 13.960 -1.918 3.928 1.00 0.00 O ATOM 2095 CB GLU B 13 11.432 -3.785 2.886 1.00 0.00 C ATOM 2096 CG GLU B 13 10.928 -3.721 4.328 1.00 0.00 C ATOM 2097 CD GLU B 13 11.005 -5.111 4.960 1.00 0.00 C ATOM 2098 OE1 GLU B 13 10.644 -6.065 4.290 1.00 0.00 O ATOM 2099 OE2 GLU B 13 11.424 -5.198 6.102 1.00 0.00 O ATOM 0 H GLU B 13 11.435 -3.029 0.550 1.00 0.00 H new ATOM 0 HA GLU B 13 11.623 -1.618 3.038 1.00 0.00 H new ATOM 0 HB2 GLU B 13 10.603 -3.992 2.209 1.00 0.00 H new ATOM 0 HB3 GLU B 13 12.146 -4.601 2.775 1.00 0.00 H new ATOM 0 HG2 GLU B 13 11.528 -3.015 4.903 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.901 -3.357 4.349 1.00 0.00 H new ATOM 2106 N GLU B 14 14.432 -3.104 2.123 1.00 0.00 N ATOM 2107 CA GLU B 14 15.898 -3.139 2.485 1.00 0.00 C ATOM 2108 C GLU B 14 16.449 -1.707 2.603 1.00 0.00 C ATOM 2109 O GLU B 14 17.254 -1.422 3.470 1.00 0.00 O ATOM 2110 CB GLU B 14 16.618 -3.888 1.351 1.00 0.00 C ATOM 2111 CG GLU B 14 18.044 -4.227 1.788 1.00 0.00 C ATOM 2112 CD GLU B 14 18.527 -5.470 1.039 1.00 0.00 C ATOM 2113 OE1 GLU B 14 17.791 -6.444 1.013 1.00 0.00 O ATOM 2114 OE2 GLU B 14 19.622 -5.428 0.504 1.00 0.00 O ATOM 0 H GLU B 14 14.182 -3.588 1.261 1.00 0.00 H new ATOM 0 HA GLU B 14 16.052 -3.636 3.443 1.00 0.00 H new ATOM 0 HB2 GLU B 14 16.076 -4.800 1.102 1.00 0.00 H new ATOM 0 HB3 GLU B 14 16.639 -3.274 0.451 1.00 0.00 H new ATOM 0 HG2 GLU B 14 18.707 -3.386 1.584 1.00 0.00 H new ATOM 0 HG3 GLU B 14 18.074 -4.403 2.863 1.00 0.00 H new ATOM 2121 N ARG B 15 16.023 -0.800 1.743 1.00 0.00 N ATOM 2122 CA ARG B 15 16.539 0.615 1.831 1.00 0.00 C ATOM 2123 C ARG B 15 16.237 1.214 3.217 1.00 0.00 C ATOM 2124 O ARG B 15 17.021 1.984 3.740 1.00 0.00 O ATOM 2125 CB ARG B 15 15.811 1.421 0.743 1.00 0.00 C ATOM 2126 CG ARG B 15 16.685 2.598 0.299 1.00 0.00 C ATOM 2127 CD ARG B 15 17.397 2.249 -1.012 1.00 0.00 C ATOM 2128 NE ARG B 15 18.282 1.099 -0.675 1.00 0.00 N ATOM 2129 CZ ARG B 15 19.577 1.256 -0.661 1.00 0.00 C ATOM 2130 NH1 ARG B 15 20.109 2.237 0.018 1.00 0.00 N ATOM 2131 NH2 ARG B 15 20.342 0.433 -1.324 1.00 0.00 N ATOM 0 H ARG B 15 15.351 -0.974 0.995 1.00 0.00 H new ATOM 0 HA ARG B 15 17.619 0.641 1.688 1.00 0.00 H new ATOM 0 HB2 ARG B 15 15.588 0.780 -0.110 1.00 0.00 H new ATOM 0 HB3 ARG B 15 14.858 1.787 1.125 1.00 0.00 H new ATOM 0 HG2 ARG B 15 16.071 3.488 0.164 1.00 0.00 H new ATOM 0 HG3 ARG B 15 17.418 2.830 1.071 1.00 0.00 H new ATOM 0 HD2 ARG B 15 16.682 1.982 -1.791 1.00 0.00 H new ATOM 0 HD3 ARG B 15 17.974 3.095 -1.385 1.00 0.00 H new ATOM 0 HE ARG B 15 17.876 0.190 -0.455 1.00 0.00 H new ATOM 0 HH11 ARG B 15 19.512 2.880 0.537 1.00 0.00 H new ATOM 0 HH12 ARG B 15 21.122 2.360 0.029 1.00 0.00 H new ATOM 0 HH21 ARG B 15 19.928 -0.334 -1.854 1.00 0.00 H new ATOM 0 HH22 ARG B 15 21.354 0.556 -1.313 1.00 0.00 H new ATOM 2145 N ILE B 16 15.113 0.873 3.820 1.00 0.00 N ATOM 2146 CA ILE B 16 14.792 1.441 5.174 1.00 0.00 C ATOM 2147 C ILE B 16 15.257 0.476 6.276 1.00 0.00 C ATOM 2148 O ILE B 16 15.836 0.894 7.262 1.00 0.00 O ATOM 2149 CB ILE B 16 13.266 1.611 5.222 1.00 0.00 C ATOM 2150 CG1 ILE B 16 12.809 2.505 4.064 1.00 0.00 C ATOM 2151 CG2 ILE B 16 12.863 2.259 6.549 1.00 0.00 C ATOM 2152 CD1 ILE B 16 11.287 2.426 3.927 1.00 0.00 C ATOM 0 H ILE B 16 14.415 0.235 3.438 1.00 0.00 H new ATOM 0 HA ILE B 16 15.299 2.392 5.336 1.00 0.00 H new ATOM 0 HB ILE B 16 12.794 0.632 5.135 1.00 0.00 H new ATOM 0 HG12 ILE B 16 13.115 3.536 4.244 1.00 0.00 H new ATOM 0 HG13 ILE B 16 13.285 2.188 3.136 1.00 0.00 H new ATOM 0 HG21 ILE B 16 11.780 2.379 6.581 1.00 0.00 H new ATOM 0 HG22 ILE B 16 13.183 1.625 7.376 1.00 0.00 H new ATOM 0 HG23 ILE B 16 13.339 3.236 6.636 1.00 0.00 H new ATOM 0 HD11 ILE B 16 10.962 3.062 3.103 1.00 0.00 H new ATOM 0 HD12 ILE B 16 10.993 1.396 3.728 1.00 0.00 H new ATOM 0 HD13 ILE B 16 10.820 2.764 4.852 1.00 0.00 H new ATOM 2164 N LEU B 17 15.012 -0.810 6.124 1.00 0.00 N ATOM 2165 CA LEU B 17 15.446 -1.784 7.170 1.00 0.00 C ATOM 2166 C LEU B 17 16.233 -2.938 6.530 1.00 0.00 C ATOM 2167 O LEU B 17 15.688 -3.996 6.278 1.00 0.00 O ATOM 2168 CB LEU B 17 14.148 -2.301 7.794 1.00 0.00 C ATOM 2169 CG LEU B 17 13.852 -1.527 9.080 1.00 0.00 C ATOM 2170 CD1 LEU B 17 13.115 -0.231 8.738 1.00 0.00 C ATOM 2171 CD2 LEU B 17 12.979 -2.383 9.999 1.00 0.00 C ATOM 0 H LEU B 17 14.532 -1.220 5.323 1.00 0.00 H new ATOM 0 HA LEU B 17 16.101 -1.327 7.912 1.00 0.00 H new ATOM 0 HB2 LEU B 17 13.323 -2.186 7.090 1.00 0.00 H new ATOM 0 HB3 LEU B 17 14.236 -3.366 8.011 1.00 0.00 H new ATOM 0 HG LEU B 17 14.788 -1.289 9.585 1.00 0.00 H new ATOM 0 HD11 LEU B 17 12.904 0.320 9.654 1.00 0.00 H new ATOM 0 HD12 LEU B 17 13.737 0.379 8.082 1.00 0.00 H new ATOM 0 HD13 LEU B 17 12.178 -0.467 8.233 1.00 0.00 H new ATOM 0 HD21 LEU B 17 12.767 -1.833 10.916 1.00 0.00 H new ATOM 0 HD22 LEU B 17 12.043 -2.621 9.494 1.00 0.00 H new ATOM 0 HD23 LEU B 17 13.504 -3.306 10.243 1.00 0.00 H new ATOM 2183 N GLY B 18 17.510 -2.748 6.266 1.00 0.00 N ATOM 2184 CA GLY B 18 18.317 -3.840 5.646 1.00 0.00 C ATOM 2185 C GLY B 18 19.588 -4.070 6.476 1.00 0.00 C ATOM 2186 O GLY B 18 20.661 -4.249 5.931 1.00 0.00 O ATOM 0 H GLY B 18 18.021 -1.885 6.455 1.00 0.00 H new ATOM 0 HA2 GLY B 18 17.731 -4.757 5.597 1.00 0.00 H new ATOM 0 HA3 GLY B 18 18.581 -3.575 4.622 1.00 0.00 H new ATOM 2190 N ALA B 19 19.481 -4.067 7.790 1.00 0.00 N ATOM 2191 CA ALA B 19 20.689 -4.285 8.641 1.00 0.00 C ATOM 2192 C ALA B 19 20.445 -5.442 9.624 1.00 0.00 C ATOM 2193 O ALA B 19 20.411 -5.244 10.825 1.00 0.00 O ATOM 2194 CB ALA B 19 20.884 -2.968 9.393 1.00 0.00 C ATOM 0 H ALA B 19 18.611 -3.923 8.302 1.00 0.00 H new ATOM 0 HA ALA B 19 21.568 -4.552 8.054 1.00 0.00 H new ATOM 0 HB1 ALA B 19 21.755 -3.046 10.043 1.00 0.00 H new ATOM 0 HB2 ALA B 19 21.036 -2.160 8.678 1.00 0.00 H new ATOM 0 HB3 ALA B 19 20.000 -2.758 9.995 1.00 0.00 H new ATOM 2200 N ASP B 20 20.273 -6.652 9.129 1.00 0.00 N ATOM 2201 CA ASP B 20 20.032 -7.809 10.043 1.00 0.00 C ATOM 2202 C ASP B 20 20.776 -9.052 9.534 1.00 0.00 C ATOM 2203 O ASP B 20 21.690 -9.534 10.177 1.00 0.00 O ATOM 2204 CB ASP B 20 18.521 -8.036 10.006 1.00 0.00 C ATOM 2205 CG ASP B 20 17.845 -7.147 11.052 1.00 0.00 C ATOM 2206 OD1 ASP B 20 17.807 -7.547 12.205 1.00 0.00 O ATOM 2207 OD2 ASP B 20 17.376 -6.083 10.683 1.00 0.00 O ATOM 0 H ASP B 20 20.290 -6.881 8.135 1.00 0.00 H new ATOM 0 HA ASP B 20 20.390 -7.617 11.054 1.00 0.00 H new ATOM 0 HB2 ASP B 20 18.133 -7.808 9.014 1.00 0.00 H new ATOM 0 HB3 ASP B 20 18.295 -9.084 10.203 1.00 0.00 H new ATOM 2212 N THR B 21 20.396 -9.580 8.387 1.00 0.00 N ATOM 2213 CA THR B 21 21.088 -10.791 7.853 1.00 0.00 C ATOM 2214 C THR B 21 21.398 -10.614 6.358 1.00 0.00 C ATOM 2215 O THR B 21 20.666 -11.094 5.512 1.00 0.00 O ATOM 2216 CB THR B 21 20.098 -11.937 8.062 1.00 0.00 C ATOM 2217 OG1 THR B 21 18.813 -11.537 7.603 1.00 0.00 O ATOM 2218 CG2 THR B 21 20.024 -12.292 9.548 1.00 0.00 C ATOM 0 H THR B 21 19.639 -9.222 7.805 1.00 0.00 H new ATOM 0 HA THR B 21 22.039 -10.975 8.353 1.00 0.00 H new ATOM 0 HB THR B 21 20.431 -12.811 7.502 1.00 0.00 H new ATOM 0 HG1 THR B 21 18.877 -11.237 6.672 1.00 0.00 H new ATOM 0 HG21 THR B 21 19.317 -13.109 9.692 1.00 0.00 H new ATOM 0 HG22 THR B 21 21.010 -12.599 9.898 1.00 0.00 H new ATOM 0 HG23 THR B 21 19.692 -11.421 10.114 1.00 0.00 H new ATOM 2226 N SER B 22 22.473 -9.931 6.019 1.00 0.00 N ATOM 2227 CA SER B 22 22.812 -9.734 4.578 1.00 0.00 C ATOM 2228 C SER B 22 24.331 -9.844 4.367 1.00 0.00 C ATOM 2229 O SER B 22 25.049 -10.288 5.244 1.00 0.00 O ATOM 2230 CB SER B 22 22.325 -8.326 4.244 1.00 0.00 C ATOM 2231 OG SER B 22 20.999 -8.160 4.729 1.00 0.00 O ATOM 0 H SER B 22 23.124 -9.506 6.679 1.00 0.00 H new ATOM 0 HA SER B 22 22.349 -10.487 3.940 1.00 0.00 H new ATOM 0 HB2 SER B 22 22.985 -7.584 4.694 1.00 0.00 H new ATOM 0 HB3 SER B 22 22.353 -8.165 3.166 1.00 0.00 H new ATOM 0 HG SER B 22 20.684 -7.256 4.517 1.00 0.00 H new ATOM 2237 N VAL B 23 24.830 -9.445 3.214 1.00 0.00 N ATOM 2238 CA VAL B 23 26.300 -9.533 2.962 1.00 0.00 C ATOM 2239 C VAL B 23 26.885 -8.124 2.765 1.00 0.00 C ATOM 2240 O VAL B 23 27.769 -7.712 3.493 1.00 0.00 O ATOM 2241 CB VAL B 23 26.438 -10.362 1.680 1.00 0.00 C ATOM 2242 CG1 VAL B 23 27.919 -10.522 1.324 1.00 0.00 C ATOM 2243 CG2 VAL B 23 25.822 -11.748 1.899 1.00 0.00 C ATOM 0 H VAL B 23 24.280 -9.065 2.443 1.00 0.00 H new ATOM 0 HA VAL B 23 26.837 -9.987 3.795 1.00 0.00 H new ATOM 0 HB VAL B 23 25.921 -9.852 0.867 1.00 0.00 H new ATOM 0 HG11 VAL B 23 28.012 -11.112 0.412 1.00 0.00 H new ATOM 0 HG12 VAL B 23 28.364 -9.539 1.168 1.00 0.00 H new ATOM 0 HG13 VAL B 23 28.436 -11.029 2.139 1.00 0.00 H new ATOM 0 HG21 VAL B 23 25.920 -12.338 0.988 1.00 0.00 H new ATOM 0 HG22 VAL B 23 26.340 -12.252 2.715 1.00 0.00 H new ATOM 0 HG23 VAL B 23 24.767 -11.642 2.151 1.00 0.00 H new ATOM 2253 N ASP B 24 26.404 -7.382 1.786 1.00 0.00 N ATOM 2254 CA ASP B 24 26.942 -6.006 1.557 1.00 0.00 C ATOM 2255 C ASP B 24 25.826 -5.070 1.069 1.00 0.00 C ATOM 2256 O ASP B 24 25.456 -4.135 1.753 1.00 0.00 O ATOM 2257 CB ASP B 24 28.011 -6.174 0.476 1.00 0.00 C ATOM 2258 CG ASP B 24 29.384 -6.332 1.133 1.00 0.00 C ATOM 2259 OD1 ASP B 24 29.892 -5.346 1.640 1.00 0.00 O ATOM 2260 OD2 ASP B 24 29.903 -7.436 1.116 1.00 0.00 O ATOM 0 H ASP B 24 25.667 -7.673 1.143 1.00 0.00 H new ATOM 0 HA ASP B 24 27.347 -5.566 2.468 1.00 0.00 H new ATOM 0 HB2 ASP B 24 27.788 -7.046 -0.138 1.00 0.00 H new ATOM 0 HB3 ASP B 24 28.011 -5.309 -0.187 1.00 0.00 H new ATOM 2265 N LEU B 25 25.284 -5.311 -0.109 1.00 0.00 N ATOM 2266 CA LEU B 25 24.195 -4.428 -0.627 1.00 0.00 C ATOM 2267 C LEU B 25 23.117 -5.269 -1.318 1.00 0.00 C ATOM 2268 O LEU B 25 23.346 -5.683 -2.442 1.00 0.00 O ATOM 2269 CB LEU B 25 24.880 -3.503 -1.634 1.00 0.00 C ATOM 2270 CG LEU B 25 24.092 -2.197 -1.748 1.00 0.00 C ATOM 2271 CD1 LEU B 25 25.037 -1.061 -2.138 1.00 0.00 C ATOM 2272 CD2 LEU B 25 23.009 -2.348 -2.819 1.00 0.00 C ATOM 2273 OXT LEU B 25 22.082 -5.485 -0.709 1.00 0.00 O ATOM 0 H LEU B 25 25.551 -6.078 -0.726 1.00 0.00 H new ATOM 0 HA LEU B 25 23.702 -3.870 0.169 1.00 0.00 H new ATOM 0 HB2 LEU B 25 25.902 -3.296 -1.317 1.00 0.00 H new ATOM 0 HB3 LEU B 25 24.940 -3.989 -2.608 1.00 0.00 H new ATOM 0 HG LEU B 25 23.628 -1.969 -0.789 1.00 0.00 H new ATOM 0 HD11 LEU B 25 24.474 -0.131 -2.219 1.00 0.00 H new ATOM 0 HD12 LEU B 25 25.809 -0.953 -1.377 1.00 0.00 H new ATOM 0 HD13 LEU B 25 25.502 -1.288 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU B 25 22.447 -1.418 -2.901 1.00 0.00 H new ATOM 0 HD22 LEU B 25 23.475 -2.577 -3.778 1.00 0.00 H new ATOM 0 HD23 LEU B 25 22.333 -3.157 -2.542 1.00 0.00 H new TER 2285 LEU B 25