USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1050 hydrogens (25 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 121 THR OG1 : rot -140:sc= 1.15 USER MOD Set 1.2: A 122 SER OG : rot 16:sc= 0.12 USER MOD Set 1.3: A 125 THR OG1 : rot 65:sc= 1.48 USER MOD Set 2.1: A 99 GLN : amide:sc= -0.789 K(o=-0.7,f=-4) USER MOD Set 2.2: A 109 LYS NZ :NH3+ -138:sc= 0.0891 (180deg=-0.00325) USER MOD Set 3.1: A 64 TYR OH : rot 68:sc= 0.528 USER MOD Set 3.2: A 71 CYS SG : rot -96:sc= 0.141 USER MOD Set 4.1: A 59 CYS SG : rot 178:sc= 0.00684 USER MOD Set 4.2: A 117 TYR OH : rot 20:sc= 0.00744 USER MOD Set 5.1: A 41 SER OG : rot -157:sc= 0.373 USER MOD Set 5.2: A 66 GLN : amide:sc= -2.28 K(o=-2.7,f=-9!) USER MOD Set 5.3: A 93 ASN : amide:sc= -0.819 K(o=-2.7,f=-5.2!) USER MOD Set 6.1: A 4 LYS NZ :NH3+ -167:sc= -0.266 (180deg=-0.0232) USER MOD Set 6.2: A 33 ASN : amide:sc= -0.0455 K(o=-0.31,f=-0.88) USER MOD Set 7.1: A 25 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.35) USER MOD Set 7.2: A 29 ASN :FLIP amide:sc= 0 F(o=-0.87,f=-0.16) USER MOD Set 8.1: A 3 LYS NZ :NH3+ -167:sc= -0.476 (180deg=-1.13) USER MOD Set 8.2: A 5 THR OG1 : rot 164:sc= 1.29 USER MOD Single : A 1 MET CE :methyl -169:sc= -0.167 (180deg=-0.288) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0.112 (180deg=0.099) USER MOD Single : A 13 SER OG : rot 110:sc= 0 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.0232 X(o=-0.023,f=-0.25) USER MOD Single : A 20 ASN : amide:sc= -0.0319 K(o=-0.032,f=-0.73) USER MOD Single : A 21 LYS NZ :NH3+ -149:sc= -0.411 (180deg=-1.25) USER MOD Single : A 26 SER OG : rot -60:sc= -2.18! USER MOD Single : A 28 THR OG1 : rot 77:sc= 0.0876 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0.0405 USER MOD Single : A 43 GLN :FLIP amide:sc= -1.73 F(o=-4.9!,f=-1.7) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 130:sc= -0.132 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -11:sc= 0.349 USER MOD Single : A 62 SER OG : rot 150:sc=-0.00749 USER MOD Single : A 72 LYS NZ :NH3+ -157:sc= 0.297 (180deg=0.0367) USER MOD Single : A 77 LYS NZ :NH3+ -176:sc= -0.686 (180deg=-0.719) USER MOD Single : A 78 CYS SG : rot 160:sc= -0.095 USER MOD Single : A 84 LYS NZ :NH3+ 177:sc= -0.188 (180deg=-0.213) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 169:sc= 0.108 (180deg=-0.0427) USER MOD Single : A 100 ASN : amide:sc= -0.0339 K(o=-0.034,f=-1.3!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 MET CE :methyl -140:sc= -0.0433 (180deg=-0.604) USER MOD Single : A 126 THR OG1 : rot -55:sc= 0.0108 USER MOD Single : A 130 MET CE :methyl 171:sc= -1.72 (180deg=-2.01) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 FOP N4 :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot -119:sc= 0.0466 USER MOD Single : A 139 DBI O5' : rot -86:sc= -0.0184 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.488 6.010 9.963 1.00 0.00 N ATOM 2 CA MET A 1 -1.399 4.795 10.740 1.00 0.00 C ATOM 3 C MET A 1 -2.836 4.282 10.849 1.00 0.00 C ATOM 4 O MET A 1 -3.194 3.267 10.266 1.00 0.00 O ATOM 5 CB MET A 1 -0.738 5.068 12.106 1.00 0.00 C ATOM 6 CG MET A 1 -0.623 3.811 12.975 1.00 0.00 C ATOM 7 SD MET A 1 0.144 4.159 14.565 1.00 0.00 S ATOM 8 CE MET A 1 0.360 2.456 15.108 1.00 0.00 C ATOM 0 H1 MET A 1 -0.531 6.364 9.761 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.981 5.815 9.068 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.016 6.727 10.500 1.00 0.00 H new ATOM 0 HA MET A 1 -0.765 4.039 10.276 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.256 5.485 11.946 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.317 5.821 12.640 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.615 3.389 13.136 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.038 3.058 12.447 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.644 2.443 16.160 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.575 1.911 14.978 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.142 1.981 14.515 1.00 0.00 H new ATOM 20 N GLU A 2 -3.626 5.055 11.630 1.00 0.00 N ATOM 21 CA GLU A 2 -5.029 4.752 11.873 1.00 0.00 C ATOM 22 C GLU A 2 -5.864 5.640 10.928 1.00 0.00 C ATOM 23 O GLU A 2 -7.063 5.807 11.122 1.00 0.00 O ATOM 24 CB GLU A 2 -5.368 5.037 13.349 1.00 0.00 C ATOM 25 CG GLU A 2 -4.544 4.174 14.315 1.00 0.00 C ATOM 26 CD GLU A 2 -4.940 4.439 15.776 1.00 0.00 C ATOM 27 OE1 GLU A 2 -4.433 5.397 16.359 1.00 0.00 O ATOM 28 OE2 GLU A 2 -5.748 3.684 16.316 1.00 0.00 O ATOM 0 H GLU A 2 -3.298 5.898 12.100 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.248 3.702 11.680 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -5.188 6.090 13.564 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.429 4.854 13.517 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -4.692 3.120 14.081 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.483 4.384 14.180 1.00 0.00 H new ATOM 35 N LYS A 3 -5.178 6.192 9.900 1.00 0.00 N ATOM 36 CA LYS A 3 -5.772 7.067 8.920 1.00 0.00 C ATOM 37 C LYS A 3 -6.545 6.179 7.933 1.00 0.00 C ATOM 38 O LYS A 3 -6.066 5.183 7.405 1.00 0.00 O ATOM 39 CB LYS A 3 -4.655 7.924 8.292 1.00 0.00 C ATOM 40 CG LYS A 3 -4.761 9.430 8.593 1.00 0.00 C ATOM 41 CD LYS A 3 -4.943 10.324 7.354 1.00 0.00 C ATOM 42 CE LYS A 3 -6.410 10.644 7.043 1.00 0.00 C ATOM 43 NZ LYS A 3 -7.205 9.471 6.729 1.00 0.00 N ATOM 0 H LYS A 3 -4.184 6.026 9.745 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.486 7.776 9.337 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.691 7.562 8.650 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.668 7.780 7.212 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.601 9.593 9.268 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.861 9.745 9.122 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.400 11.257 7.505 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.496 9.831 6.491 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.852 11.154 7.899 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.452 11.337 6.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.114 9.767 6.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.693 8.878 6.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.378 8.926 7.598 1.00 0.00 H new ATOM 56 N LYS A 4 -7.790 6.663 7.757 1.00 0.00 N ATOM 57 CA LYS A 4 -8.840 6.099 6.931 1.00 0.00 C ATOM 58 C LYS A 4 -8.591 6.538 5.493 1.00 0.00 C ATOM 59 O LYS A 4 -8.985 7.616 5.070 1.00 0.00 O ATOM 60 CB LYS A 4 -10.215 6.568 7.448 1.00 0.00 C ATOM 61 CG LYS A 4 -10.309 8.076 7.747 1.00 0.00 C ATOM 62 CD LYS A 4 -11.727 8.493 8.153 1.00 0.00 C ATOM 63 CE LYS A 4 -11.835 9.991 8.455 1.00 0.00 C ATOM 64 NZ LYS A 4 -11.615 10.822 7.277 1.00 0.00 N ATOM 0 H LYS A 4 -8.095 7.516 8.226 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.835 5.010 6.974 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -10.973 6.310 6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.454 6.015 8.357 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.613 8.331 8.546 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -10.003 8.640 6.866 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -12.421 8.236 7.352 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -12.031 7.926 9.033 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -12.822 10.204 8.865 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -11.107 10.256 9.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.480 11.811 7.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.768 10.492 6.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -12.440 10.757 6.647 1.00 0.00 H new ATOM 77 N THR A 5 -7.915 5.620 4.770 1.00 0.00 N ATOM 78 CA THR A 5 -7.577 5.829 3.370 1.00 0.00 C ATOM 79 C THR A 5 -6.662 4.639 3.041 1.00 0.00 C ATOM 80 O THR A 5 -5.525 4.555 3.494 1.00 0.00 O ATOM 81 CB THR A 5 -6.907 7.225 3.142 1.00 0.00 C ATOM 82 OG1 THR A 5 -6.322 7.848 4.331 1.00 0.00 O ATOM 83 CG2 THR A 5 -7.825 8.170 2.299 1.00 0.00 C ATOM 0 H THR A 5 -7.597 4.727 5.147 1.00 0.00 H new ATOM 0 HA THR A 5 -8.444 5.858 2.710 1.00 0.00 H new ATOM 0 HB THR A 5 -6.021 7.027 2.539 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.714 8.566 4.058 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.329 9.130 2.160 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.018 7.717 1.326 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.769 8.322 2.822 1.00 0.00 H new ATOM 91 N ILE A 6 -7.251 3.738 2.221 1.00 0.00 N ATOM 92 CA ILE A 6 -6.620 2.521 1.775 1.00 0.00 C ATOM 93 C ILE A 6 -6.903 2.463 0.283 1.00 0.00 C ATOM 94 O ILE A 6 -8.040 2.371 -0.162 1.00 0.00 O ATOM 95 CB ILE A 6 -7.118 1.241 2.506 1.00 0.00 C ATOM 96 CG1 ILE A 6 -8.488 1.426 3.275 1.00 0.00 C ATOM 97 CG2 ILE A 6 -6.491 -0.020 1.788 1.00 0.00 C ATOM 98 CD1 ILE A 6 -8.921 0.187 4.079 1.00 0.00 C ATOM 0 H ILE A 6 -8.196 3.859 1.856 1.00 0.00 H new ATOM 0 HA ILE A 6 -5.554 2.540 2.004 1.00 0.00 H new ATOM 0 HB ILE A 6 -6.782 0.921 3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -8.402 2.275 3.953 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.268 1.671 2.554 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.829 -0.928 2.287 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -6.807 -0.040 0.745 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -5.404 0.037 1.836 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -9.868 0.390 4.578 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.041 -0.661 3.405 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -8.161 -0.047 4.824 1.00 0.00 H new ATOM 110 N VAL A 7 -5.767 2.510 -0.438 1.00 0.00 N ATOM 111 CA VAL A 7 -5.735 2.461 -1.875 1.00 0.00 C ATOM 112 C VAL A 7 -5.407 1.027 -2.300 1.00 0.00 C ATOM 113 O VAL A 7 -4.509 0.401 -1.753 1.00 0.00 O ATOM 114 CB VAL A 7 -4.736 3.520 -2.437 1.00 0.00 C ATOM 115 CG1 VAL A 7 -3.338 3.355 -1.776 1.00 0.00 C ATOM 116 CG2 VAL A 7 -4.803 4.148 -3.834 1.00 0.00 C ATOM 0 H VAL A 7 -4.843 2.584 -0.013 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.706 2.722 -2.297 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.257 4.428 -2.132 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.654 4.102 -2.180 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -3.427 3.490 -0.698 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -2.952 2.358 -1.986 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.981 4.853 -3.956 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -4.724 3.366 -4.589 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.751 4.672 -3.952 1.00 0.00 H new ATOM 126 N LEU A 8 -6.204 0.543 -3.283 1.00 0.00 N ATOM 127 CA LEU A 8 -6.015 -0.824 -3.768 1.00 0.00 C ATOM 128 C LEU A 8 -5.819 -0.755 -5.282 1.00 0.00 C ATOM 129 O LEU A 8 -6.438 0.042 -5.980 1.00 0.00 O ATOM 130 CB LEU A 8 -7.239 -1.703 -3.431 1.00 0.00 C ATOM 131 CG LEU A 8 -7.101 -3.183 -3.922 1.00 0.00 C ATOM 132 CD1 LEU A 8 -5.980 -3.914 -3.135 1.00 0.00 C ATOM 133 CD2 LEU A 8 -8.125 -3.957 -4.796 1.00 0.00 C ATOM 0 H LEU A 8 -6.955 1.065 -3.735 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.147 -1.273 -3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.392 -1.700 -2.352 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.128 -1.261 -3.881 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.994 -3.083 -5.002 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.898 -4.942 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.032 -3.400 -3.290 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.223 -3.915 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.758 -4.967 -4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -9.082 -4.006 -4.277 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.254 -3.441 -5.748 1.00 0.00 H new ATOM 145 N GLY A 9 -4.922 -1.673 -5.731 1.00 0.00 N ATOM 146 CA GLY A 9 -4.682 -1.770 -7.166 1.00 0.00 C ATOM 147 C GLY A 9 -3.699 -2.887 -7.547 1.00 0.00 C ATOM 148 O GLY A 9 -3.065 -3.500 -6.703 1.00 0.00 O ATOM 0 H GLY A 9 -4.388 -2.316 -5.146 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.631 -1.942 -7.674 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.295 -0.817 -7.527 1.00 0.00 H new ATOM 152 N VAL A 10 -3.673 -3.071 -8.890 1.00 0.00 N ATOM 153 CA VAL A 10 -2.877 -3.982 -9.719 1.00 0.00 C ATOM 154 C VAL A 10 -3.574 -5.273 -10.186 1.00 0.00 C ATOM 155 O VAL A 10 -4.652 -5.225 -10.760 1.00 0.00 O ATOM 156 CB VAL A 10 -1.323 -4.043 -9.532 1.00 0.00 C ATOM 157 CG1 VAL A 10 -0.870 -4.607 -8.163 1.00 0.00 C ATOM 158 CG2 VAL A 10 -0.292 -3.953 -10.696 1.00 0.00 C ATOM 0 H VAL A 10 -4.288 -2.511 -9.480 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.869 -3.374 -10.624 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.172 -2.966 -9.602 1.00 0.00 H new ATOM 0 HG11 VAL A 10 0.219 -4.615 -8.115 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.264 -3.980 -7.363 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.246 -5.623 -8.046 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.719 -4.021 -10.293 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.460 -4.772 -11.395 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.412 -3.002 -11.216 1.00 0.00 H new ATOM 168 N ILE A 11 -2.867 -6.410 -9.964 1.00 0.00 N ATOM 169 CA ILE A 11 -3.225 -7.782 -10.372 1.00 0.00 C ATOM 170 C ILE A 11 -3.439 -7.774 -11.901 1.00 0.00 C ATOM 171 O ILE A 11 -4.477 -7.351 -12.397 1.00 0.00 O ATOM 172 CB ILE A 11 -4.390 -8.501 -9.604 1.00 0.00 C ATOM 173 CG1 ILE A 11 -3.890 -9.806 -8.855 1.00 0.00 C ATOM 174 CG2 ILE A 11 -5.618 -7.552 -9.371 1.00 0.00 C ATOM 175 CD1 ILE A 11 -4.782 -10.485 -7.785 1.00 0.00 C ATOM 0 H ILE A 11 -1.978 -6.386 -9.464 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.385 -8.410 -10.076 1.00 0.00 H new ATOM 0 HB ILE A 11 -5.163 -9.175 -9.974 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.676 -10.554 -9.618 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -2.942 -9.560 -8.376 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -6.399 -8.092 -8.836 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.305 -6.690 -8.782 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.004 -7.214 -10.333 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.270 -11.361 -7.387 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.980 -9.781 -6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.725 -10.791 -8.238 1.00 0.00 H new ATOM 187 N GLY A 12 -2.402 -8.286 -12.616 1.00 0.00 N ATOM 188 CA GLY A 12 -2.479 -8.316 -14.071 1.00 0.00 C ATOM 189 C GLY A 12 -1.418 -9.257 -14.636 1.00 0.00 C ATOM 190 O GLY A 12 -0.652 -8.923 -15.532 1.00 0.00 O ATOM 0 H GLY A 12 -1.544 -8.665 -12.215 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.470 -8.645 -14.383 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.335 -7.312 -14.471 1.00 0.00 H new ATOM 194 N SER A 13 -1.452 -10.455 -14.025 1.00 0.00 N ATOM 195 CA SER A 13 -0.565 -11.555 -14.340 1.00 0.00 C ATOM 196 C SER A 13 -1.482 -12.550 -15.048 1.00 0.00 C ATOM 197 O SER A 13 -1.599 -12.545 -16.267 1.00 0.00 O ATOM 198 CB SER A 13 0.047 -12.096 -13.011 1.00 0.00 C ATOM 199 OG SER A 13 0.584 -13.478 -12.940 1.00 0.00 O ATOM 0 H SER A 13 -2.117 -10.675 -13.284 1.00 0.00 H new ATOM 0 HA SER A 13 0.289 -11.307 -14.970 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.856 -11.421 -12.730 1.00 0.00 H new ATOM 0 HB3 SER A 13 -0.722 -12.009 -12.243 1.00 0.00 H new ATOM 0 HG SER A 13 1.561 -13.446 -12.864 1.00 0.00 H new ATOM 205 N ASP A 14 -2.135 -13.390 -14.210 1.00 0.00 N ATOM 206 CA ASP A 14 -3.068 -14.378 -14.701 1.00 0.00 C ATOM 207 C ASP A 14 -4.390 -13.606 -14.831 1.00 0.00 C ATOM 208 O ASP A 14 -5.107 -13.418 -13.855 1.00 0.00 O ATOM 209 CB ASP A 14 -3.163 -15.563 -13.718 1.00 0.00 C ATOM 210 CG ASP A 14 -4.297 -16.543 -14.079 1.00 0.00 C ATOM 211 OD1 ASP A 14 -4.185 -17.223 -15.098 1.00 0.00 O ATOM 212 OD2 ASP A 14 -5.277 -16.614 -13.337 1.00 0.00 O ATOM 0 H ASP A 14 -2.019 -13.387 -13.197 1.00 0.00 H new ATOM 0 HA ASP A 14 -2.774 -14.823 -15.651 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.214 -16.099 -13.708 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -3.324 -15.182 -12.710 1.00 0.00 H new ATOM 217 N CYS A 15 -4.654 -13.168 -16.090 1.00 0.00 N ATOM 218 CA CYS A 15 -5.846 -12.387 -16.404 1.00 0.00 C ATOM 219 C CYS A 15 -5.705 -11.071 -15.603 1.00 0.00 C ATOM 220 O CYS A 15 -4.647 -10.454 -15.599 1.00 0.00 O ATOM 221 CB CYS A 15 -7.139 -13.192 -16.150 1.00 0.00 C ATOM 222 SG CYS A 15 -7.152 -14.777 -17.024 1.00 0.00 S ATOM 0 H CYS A 15 -4.050 -13.350 -16.891 1.00 0.00 H new ATOM 0 HA CYS A 15 -5.929 -12.144 -17.463 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -7.248 -13.370 -15.080 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -7.999 -12.601 -16.464 1.00 0.00 H new ATOM 0 HG CYS A 15 -8.261 -15.405 -16.768 1.00 0.00 H new ATOM 228 N HIS A 16 -6.815 -10.698 -14.925 1.00 0.00 N ATOM 229 CA HIS A 16 -6.880 -9.499 -14.100 1.00 0.00 C ATOM 230 C HIS A 16 -7.854 -9.865 -12.972 1.00 0.00 C ATOM 231 O HIS A 16 -8.362 -10.977 -12.891 1.00 0.00 O ATOM 232 CB HIS A 16 -7.384 -8.281 -14.909 1.00 0.00 C ATOM 233 CG HIS A 16 -6.313 -7.789 -15.854 1.00 0.00 C ATOM 234 ND1 HIS A 16 -5.314 -6.960 -15.484 1.00 0.00 N ATOM 235 CD2 HIS A 16 -6.162 -8.085 -17.219 1.00 0.00 C ATOM 236 CE1 HIS A 16 -4.578 -6.758 -16.590 1.00 0.00 C ATOM 237 NE2 HIS A 16 -5.064 -7.424 -17.653 1.00 0.00 N ATOM 0 H HIS A 16 -7.685 -11.230 -14.944 1.00 0.00 H new ATOM 0 HA HIS A 16 -5.901 -9.206 -13.721 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -8.275 -8.556 -15.473 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -7.672 -7.480 -14.228 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -6.803 -8.721 -17.811 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -3.698 -6.133 -16.622 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -4.681 -7.430 -18.598 1.00 0.00 H new ATOM 245 N ALA A 17 -8.061 -8.844 -12.107 1.00 0.00 N ATOM 246 CA ALA A 17 -8.944 -8.906 -10.948 1.00 0.00 C ATOM 247 C ALA A 17 -8.247 -9.793 -9.909 1.00 0.00 C ATOM 248 O ALA A 17 -7.076 -10.124 -10.042 1.00 0.00 O ATOM 249 CB ALA A 17 -10.368 -9.373 -11.315 1.00 0.00 C ATOM 0 H ALA A 17 -7.602 -7.939 -12.210 1.00 0.00 H new ATOM 0 HA ALA A 17 -9.106 -7.913 -10.528 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.984 -9.402 -10.416 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -10.805 -8.679 -12.033 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.322 -10.369 -11.755 1.00 0.00 H new ATOM 255 N VAL A 18 -9.054 -10.151 -8.880 1.00 0.00 N ATOM 256 CA VAL A 18 -8.642 -10.986 -7.751 1.00 0.00 C ATOM 257 C VAL A 18 -7.903 -10.130 -6.677 1.00 0.00 C ATOM 258 O VAL A 18 -7.237 -10.645 -5.787 1.00 0.00 O ATOM 259 CB VAL A 18 -7.965 -12.334 -8.222 1.00 0.00 C ATOM 260 CG1 VAL A 18 -7.331 -13.097 -7.022 1.00 0.00 C ATOM 261 CG2 VAL A 18 -8.424 -13.058 -9.513 1.00 0.00 C ATOM 0 H VAL A 18 -10.028 -9.855 -8.821 1.00 0.00 H new ATOM 0 HA VAL A 18 -9.514 -11.360 -7.216 1.00 0.00 H new ATOM 0 HB VAL A 18 -7.119 -12.056 -8.850 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -6.873 -14.020 -7.378 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -6.570 -12.472 -6.554 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.105 -13.334 -6.292 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.831 -13.962 -9.654 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.477 -13.325 -9.426 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -8.287 -12.397 -10.369 1.00 0.00 H new ATOM 271 N GLY A 19 -8.076 -8.793 -6.805 1.00 0.00 N ATOM 272 CA GLY A 19 -7.490 -7.826 -5.876 1.00 0.00 C ATOM 273 C GLY A 19 -8.582 -7.307 -4.928 1.00 0.00 C ATOM 274 O GLY A 19 -8.385 -7.085 -3.734 1.00 0.00 O ATOM 0 H GLY A 19 -8.623 -8.367 -7.553 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.688 -8.293 -5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -7.047 -6.997 -6.428 1.00 0.00 H new ATOM 278 N ASN A 20 -9.772 -7.172 -5.568 1.00 0.00 N ATOM 279 CA ASN A 20 -11.007 -6.720 -4.940 1.00 0.00 C ATOM 280 C ASN A 20 -11.214 -7.545 -3.661 1.00 0.00 C ATOM 281 O ASN A 20 -11.679 -7.023 -2.656 1.00 0.00 O ATOM 282 CB ASN A 20 -12.186 -6.811 -5.934 1.00 0.00 C ATOM 283 CG ASN A 20 -12.334 -8.217 -6.549 1.00 0.00 C ATOM 284 OD1 ASN A 20 -11.640 -8.585 -7.489 1.00 0.00 O ATOM 285 ND2 ASN A 20 -13.283 -8.965 -5.957 1.00 0.00 N ATOM 0 H ASN A 20 -9.885 -7.384 -6.559 1.00 0.00 H new ATOM 0 HA ASN A 20 -10.948 -5.668 -4.660 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.110 -6.543 -5.422 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -12.041 -6.083 -6.732 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -13.466 -9.912 -6.288 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -13.819 -8.585 -5.177 1.00 0.00 H new ATOM 292 N LYS A 21 -10.793 -8.832 -3.828 1.00 0.00 N ATOM 293 CA LYS A 21 -10.686 -10.041 -3.031 1.00 0.00 C ATOM 294 C LYS A 21 -10.396 -9.638 -1.605 1.00 0.00 C ATOM 295 O LYS A 21 -9.326 -9.775 -1.031 1.00 0.00 O ATOM 296 CB LYS A 21 -9.633 -11.017 -3.591 1.00 0.00 C ATOM 297 CG LYS A 21 -9.532 -12.308 -2.755 1.00 0.00 C ATOM 298 CD LYS A 21 -8.797 -13.456 -3.455 1.00 0.00 C ATOM 299 CE LYS A 21 -9.679 -14.173 -4.485 1.00 0.00 C ATOM 300 NZ LYS A 21 -9.006 -15.312 -5.100 1.00 0.00 N ATOM 0 H LYS A 21 -10.445 -9.064 -4.758 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.628 -10.589 -3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.887 -11.272 -4.620 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.661 -10.525 -3.615 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.021 -12.082 -1.819 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.538 -12.640 -2.497 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.908 -13.066 -3.951 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -8.457 -14.174 -2.709 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.594 -14.514 -4.001 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.973 -13.467 -5.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -9.351 -15.435 -6.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -7.980 -15.143 -5.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.207 -16.172 -4.551 1.00 0.00 H new ATOM 313 N ILE A 22 -11.525 -9.132 -1.139 1.00 0.00 N ATOM 314 CA ILE A 22 -11.836 -8.646 0.180 1.00 0.00 C ATOM 315 C ILE A 22 -10.870 -7.534 0.629 1.00 0.00 C ATOM 316 O ILE A 22 -10.850 -7.237 1.817 1.00 0.00 O ATOM 317 CB ILE A 22 -11.990 -9.814 1.200 1.00 0.00 C ATOM 318 CG1 ILE A 22 -13.470 -10.383 1.248 1.00 0.00 C ATOM 319 CG2 ILE A 22 -10.608 -10.533 1.419 1.00 0.00 C ATOM 320 CD1 ILE A 22 -14.177 -10.710 -0.094 1.00 0.00 C ATOM 0 H ILE A 22 -12.334 -9.045 -1.754 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.814 -8.167 0.141 1.00 0.00 H new ATOM 0 HB ILE A 22 -12.088 -9.667 2.276 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -13.457 -11.294 1.847 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.087 -9.660 1.781 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -10.730 -11.347 2.134 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.252 -10.934 0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.883 -9.817 1.805 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -15.179 -11.089 0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -14.244 -9.806 -0.699 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -13.604 -11.465 -0.632 1.00 0.00 H new ATOM 332 N LEU A 23 -10.084 -6.907 -0.293 1.00 0.00 N ATOM 333 CA LEU A 23 -9.218 -5.830 0.207 1.00 0.00 C ATOM 334 C LEU A 23 -10.132 -4.613 0.418 1.00 0.00 C ATOM 335 O LEU A 23 -10.029 -3.898 1.411 1.00 0.00 O ATOM 336 CB LEU A 23 -8.016 -5.541 -0.718 1.00 0.00 C ATOM 337 CG LEU A 23 -6.753 -6.433 -0.452 1.00 0.00 C ATOM 338 CD1 LEU A 23 -7.079 -7.940 -0.626 1.00 0.00 C ATOM 339 CD2 LEU A 23 -5.299 -5.909 -0.519 1.00 0.00 C ATOM 0 H LEU A 23 -10.037 -7.110 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.744 -6.118 1.145 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.330 -5.679 -1.753 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.734 -4.494 -0.608 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.512 -6.228 0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.183 -8.531 -0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.860 -8.227 0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -7.423 -8.123 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.609 -6.722 -0.295 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -5.096 -5.526 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.166 -5.110 0.210 1.00 0.00 H new ATOM 351 N ASP A 24 -11.061 -4.446 -0.548 1.00 0.00 N ATOM 352 CA ASP A 24 -12.005 -3.352 -0.444 1.00 0.00 C ATOM 353 C ASP A 24 -13.111 -3.776 0.546 1.00 0.00 C ATOM 354 O ASP A 24 -14.015 -3.002 0.828 1.00 0.00 O ATOM 355 CB ASP A 24 -12.584 -3.006 -1.828 1.00 0.00 C ATOM 356 CG ASP A 24 -11.492 -2.462 -2.770 1.00 0.00 C ATOM 357 OD1 ASP A 24 -11.031 -1.341 -2.556 1.00 0.00 O ATOM 358 OD2 ASP A 24 -11.118 -3.164 -3.708 1.00 0.00 O ATOM 0 H ASP A 24 -11.164 -5.038 -1.372 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.512 -2.452 -0.076 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.037 -3.894 -2.268 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.376 -2.265 -1.719 1.00 0.00 H new ATOM 363 N HIS A 25 -13.017 -5.017 1.077 1.00 0.00 N ATOM 364 CA HIS A 25 -14.047 -5.448 2.020 1.00 0.00 C ATOM 365 C HIS A 25 -13.674 -4.882 3.387 1.00 0.00 C ATOM 366 O HIS A 25 -14.526 -4.505 4.177 1.00 0.00 O ATOM 367 CB HIS A 25 -14.154 -6.978 2.038 1.00 0.00 C ATOM 368 CG HIS A 25 -15.135 -7.480 3.073 1.00 0.00 C ATOM 369 ND1 HIS A 25 -16.476 -7.472 2.917 1.00 0.00 N ATOM 370 CD2 HIS A 25 -14.832 -8.062 4.314 1.00 0.00 C ATOM 371 CE1 HIS A 25 -16.973 -8.037 4.031 1.00 0.00 C ATOM 372 NE2 HIS A 25 -16.005 -8.403 4.892 1.00 0.00 N ATOM 0 H HIS A 25 -12.281 -5.695 0.878 1.00 0.00 H new ATOM 0 HA HIS A 25 -15.029 -5.078 1.727 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -14.460 -7.329 1.052 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -13.171 -7.405 2.237 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -13.846 -8.210 4.729 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -18.028 -8.181 4.214 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -16.132 -8.849 5.800 1.00 0.00 H new ATOM 380 N SER A 26 -12.348 -4.827 3.591 1.00 0.00 N ATOM 381 CA SER A 26 -11.768 -4.359 4.833 1.00 0.00 C ATOM 382 C SER A 26 -12.054 -2.872 5.028 1.00 0.00 C ATOM 383 O SER A 26 -12.156 -2.419 6.161 1.00 0.00 O ATOM 384 CB SER A 26 -10.239 -4.633 4.885 1.00 0.00 C ATOM 385 OG SER A 26 -9.359 -3.708 5.637 1.00 0.00 O ATOM 0 H SER A 26 -11.660 -5.108 2.893 1.00 0.00 H new ATOM 0 HA SER A 26 -12.232 -4.915 5.648 1.00 0.00 H new ATOM 0 HB2 SER A 26 -10.099 -5.630 5.303 1.00 0.00 H new ATOM 0 HB3 SER A 26 -9.877 -4.665 3.857 1.00 0.00 H new ATOM 0 HG SER A 26 -9.424 -2.809 5.252 1.00 0.00 H new ATOM 391 N PHE A 27 -12.190 -2.136 3.905 1.00 0.00 N ATOM 392 CA PHE A 27 -12.444 -0.695 4.039 1.00 0.00 C ATOM 393 C PHE A 27 -13.809 -0.492 4.693 1.00 0.00 C ATOM 394 O PHE A 27 -14.002 0.339 5.568 1.00 0.00 O ATOM 395 CB PHE A 27 -12.275 0.136 2.727 1.00 0.00 C ATOM 396 CG PHE A 27 -13.497 0.319 1.838 1.00 0.00 C ATOM 397 CD1 PHE A 27 -14.614 1.045 2.258 1.00 0.00 C ATOM 398 CD2 PHE A 27 -13.530 -0.229 0.562 1.00 0.00 C ATOM 399 CE1 PHE A 27 -15.735 1.181 1.452 1.00 0.00 C ATOM 400 CE2 PHE A 27 -14.649 -0.094 -0.254 1.00 0.00 C ATOM 401 CZ PHE A 27 -15.756 0.608 0.192 1.00 0.00 C ATOM 0 H PHE A 27 -12.132 -2.492 2.951 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.661 -0.292 4.681 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.911 1.126 3.002 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.495 -0.336 2.130 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.605 1.511 3.232 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -12.670 -0.771 0.196 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -16.592 1.734 1.808 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -14.654 -0.538 -1.238 1.00 0.00 H new ATOM 0 HZ PHE A 27 -16.628 0.708 -0.437 1.00 0.00 H new ATOM 411 N THR A 28 -14.725 -1.323 4.192 1.00 0.00 N ATOM 412 CA THR A 28 -16.120 -1.285 4.570 1.00 0.00 C ATOM 413 C THR A 28 -16.359 -1.800 5.984 1.00 0.00 C ATOM 414 O THR A 28 -17.284 -1.399 6.679 1.00 0.00 O ATOM 415 CB THR A 28 -16.869 -2.066 3.443 1.00 0.00 C ATOM 416 OG1 THR A 28 -16.162 -2.314 2.179 1.00 0.00 O ATOM 417 CG2 THR A 28 -18.273 -1.469 3.200 1.00 0.00 C ATOM 0 H THR A 28 -14.506 -2.045 3.506 1.00 0.00 H new ATOM 0 HA THR A 28 -16.507 -0.268 4.634 1.00 0.00 H new ATOM 0 HB THR A 28 -16.941 -3.071 3.858 1.00 0.00 H new ATOM 0 HG1 THR A 28 -15.521 -3.045 2.301 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.775 -2.029 2.411 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.858 -1.530 4.118 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.178 -0.426 2.900 1.00 0.00 H new ATOM 425 N ASN A 29 -15.459 -2.699 6.332 1.00 0.00 N ATOM 426 CA ASN A 29 -15.436 -3.422 7.569 1.00 0.00 C ATOM 427 C ASN A 29 -14.464 -2.753 8.539 1.00 0.00 C ATOM 428 O ASN A 29 -14.103 -3.371 9.534 1.00 0.00 O ATOM 429 CB ASN A 29 -15.102 -4.910 7.330 1.00 0.00 C ATOM 430 CG ASN A 29 -16.321 -5.702 6.819 1.00 0.00 C ATOM 431 OD1 ASN A 29 -16.833 -5.255 5.659 1.00 0.00 O flip ATOM 432 ND2 ASN A 29 -16.766 -6.654 7.448 1.00 0.00 N flip ATOM 0 H ASN A 29 -14.685 -2.952 5.718 1.00 0.00 H new ATOM 0 HA ASN A 29 -16.427 -3.397 8.023 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -14.291 -4.987 6.606 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -14.744 -5.355 8.259 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -16.325 -6.938 8.323 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -17.577 -7.163 7.097 1.00 0.00 H new ATOM 439 N ALA A 30 -14.053 -1.492 8.256 1.00 0.00 N ATOM 440 CA ALA A 30 -13.167 -0.825 9.174 1.00 0.00 C ATOM 441 C ALA A 30 -13.595 0.640 9.254 1.00 0.00 C ATOM 442 O ALA A 30 -12.950 1.421 9.944 1.00 0.00 O ATOM 443 CB ALA A 30 -11.701 -0.975 8.754 1.00 0.00 C ATOM 0 H ALA A 30 -14.320 -0.956 7.430 1.00 0.00 H new ATOM 0 HA ALA A 30 -13.237 -1.282 10.161 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.063 -0.459 9.471 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.436 -2.032 8.728 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.560 -0.541 7.764 1.00 0.00 H new ATOM 449 N GLY A 31 -14.696 0.993 8.541 1.00 0.00 N ATOM 450 CA GLY A 31 -15.151 2.380 8.531 1.00 0.00 C ATOM 451 C GLY A 31 -14.059 3.310 7.967 1.00 0.00 C ATOM 452 O GLY A 31 -13.959 4.479 8.322 1.00 0.00 O ATOM 0 H GLY A 31 -15.260 0.349 7.987 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.055 2.466 7.929 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.411 2.689 9.543 1.00 0.00 H new ATOM 456 N PHE A 32 -13.260 2.689 7.069 1.00 0.00 N ATOM 457 CA PHE A 32 -12.138 3.364 6.438 1.00 0.00 C ATOM 458 C PHE A 32 -12.621 3.790 5.058 1.00 0.00 C ATOM 459 O PHE A 32 -13.553 3.241 4.484 1.00 0.00 O ATOM 460 CB PHE A 32 -10.928 2.403 6.369 1.00 0.00 C ATOM 461 CG PHE A 32 -9.936 2.603 7.491 1.00 0.00 C ATOM 462 CD1 PHE A 32 -10.329 3.035 8.757 1.00 0.00 C ATOM 463 CD2 PHE A 32 -8.582 2.389 7.253 1.00 0.00 C ATOM 464 CE1 PHE A 32 -9.393 3.271 9.752 1.00 0.00 C ATOM 465 CE2 PHE A 32 -7.642 2.628 8.244 1.00 0.00 C ATOM 466 CZ PHE A 32 -8.048 3.072 9.493 1.00 0.00 C ATOM 0 H PHE A 32 -13.384 1.720 6.775 1.00 0.00 H new ATOM 0 HA PHE A 32 -11.805 4.238 6.998 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.289 1.375 6.392 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.419 2.540 5.415 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.378 3.188 8.965 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -8.260 2.033 6.286 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -9.712 3.609 10.727 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.593 2.468 8.043 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.315 3.262 10.263 1.00 0.00 H new ATOM 476 N ASN A 33 -11.904 4.834 4.587 1.00 0.00 N ATOM 477 CA ASN A 33 -12.177 5.440 3.298 1.00 0.00 C ATOM 478 C ASN A 33 -11.494 4.548 2.265 1.00 0.00 C ATOM 479 O ASN A 33 -10.393 4.048 2.465 1.00 0.00 O ATOM 480 CB ASN A 33 -11.609 6.871 3.231 1.00 0.00 C ATOM 481 CG ASN A 33 -12.223 7.789 4.301 1.00 0.00 C ATOM 482 OD1 ASN A 33 -13.206 7.463 4.955 1.00 0.00 O ATOM 483 ND2 ASN A 33 -11.570 8.958 4.429 1.00 0.00 N ATOM 0 H ASN A 33 -11.132 5.265 5.095 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.249 5.519 3.118 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -10.527 6.837 3.361 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.799 7.290 2.243 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.888 9.648 5.110 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.757 9.155 3.845 1.00 0.00 H new ATOM 490 N VAL A 34 -12.237 4.401 1.150 1.00 0.00 N ATOM 491 CA VAL A 34 -11.799 3.603 0.018 1.00 0.00 C ATOM 492 C VAL A 34 -11.241 4.567 -1.036 1.00 0.00 C ATOM 493 O VAL A 34 -11.788 5.628 -1.311 1.00 0.00 O ATOM 494 CB VAL A 34 -12.953 2.745 -0.574 1.00 0.00 C ATOM 495 CG1 VAL A 34 -14.264 3.638 -0.629 1.00 0.00 C ATOM 496 CG2 VAL A 34 -12.230 1.756 -1.583 1.00 0.00 C ATOM 0 H VAL A 34 -13.151 4.835 1.022 1.00 0.00 H new ATOM 0 HA VAL A 34 -11.034 2.898 0.343 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.548 1.958 -0.110 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -15.086 3.053 -1.042 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -14.523 3.967 0.377 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.085 4.508 -1.260 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.971 1.108 -2.051 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -11.715 2.333 -2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -11.507 1.147 -1.040 1.00 0.00 H new ATOM 506 N VAL A 35 -10.105 4.100 -1.580 1.00 0.00 N ATOM 507 CA VAL A 35 -9.371 4.794 -2.621 1.00 0.00 C ATOM 508 C VAL A 35 -9.058 3.735 -3.682 1.00 0.00 C ATOM 509 O VAL A 35 -7.919 3.388 -3.965 1.00 0.00 O ATOM 510 CB VAL A 35 -8.091 5.440 -2.008 1.00 0.00 C ATOM 511 CG1 VAL A 35 -7.378 6.283 -3.096 1.00 0.00 C ATOM 512 CG2 VAL A 35 -7.945 5.807 -0.522 1.00 0.00 C ATOM 0 H VAL A 35 -9.676 3.219 -1.298 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.933 5.611 -3.073 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.477 4.590 -1.711 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.482 6.738 -2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.100 5.640 -3.931 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -8.050 7.065 -3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.960 6.242 -0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.714 6.530 -0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.057 4.910 0.087 1.00 0.00 H new ATOM 522 N ASN A 36 -10.170 3.232 -4.249 1.00 0.00 N ATOM 523 CA ASN A 36 -9.993 2.190 -5.258 1.00 0.00 C ATOM 524 C ASN A 36 -9.660 2.911 -6.574 1.00 0.00 C ATOM 525 O ASN A 36 -10.435 3.724 -7.063 1.00 0.00 O ATOM 526 CB ASN A 36 -11.262 1.323 -5.368 1.00 0.00 C ATOM 527 CG ASN A 36 -11.055 0.159 -6.352 1.00 0.00 C ATOM 528 OD1 ASN A 36 -11.497 0.195 -7.493 1.00 0.00 O ATOM 529 ND2 ASN A 36 -10.352 -0.864 -5.830 1.00 0.00 N ATOM 0 H ASN A 36 -11.130 3.508 -4.043 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.187 1.504 -4.996 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -11.524 0.930 -4.386 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -12.099 1.938 -5.699 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -10.153 -1.688 -6.397 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -10.019 -0.815 -4.867 1.00 0.00 H new ATOM 536 N ILE A 37 -8.463 2.555 -7.108 1.00 0.00 N ATOM 537 CA ILE A 37 -8.015 3.147 -8.364 1.00 0.00 C ATOM 538 C ILE A 37 -8.555 2.214 -9.458 1.00 0.00 C ATOM 539 O ILE A 37 -9.563 2.490 -10.097 1.00 0.00 O ATOM 540 CB ILE A 37 -6.458 3.321 -8.460 1.00 0.00 C ATOM 541 CG1 ILE A 37 -5.661 3.397 -7.136 1.00 0.00 C ATOM 542 CG2 ILE A 37 -6.118 3.919 -9.865 1.00 0.00 C ATOM 543 CD1 ILE A 37 -4.125 3.567 -7.264 1.00 0.00 C ATOM 0 H ILE A 37 -7.819 1.881 -6.693 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.391 4.165 -8.463 1.00 0.00 H new ATOM 0 HB ILE A 37 -5.773 2.475 -8.509 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.049 4.231 -6.551 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -5.858 2.489 -6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.039 4.049 -9.954 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.467 3.241 -10.643 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.610 4.885 -9.978 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.679 3.607 -6.270 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.710 2.722 -7.814 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.904 4.491 -7.798 1.00 0.00 H new ATOM 555 N GLY A 38 -7.811 1.101 -9.623 1.00 0.00 N ATOM 556 CA GLY A 38 -8.163 0.100 -10.617 1.00 0.00 C ATOM 557 C GLY A 38 -7.123 -1.021 -10.587 1.00 0.00 C ATOM 558 O GLY A 38 -6.412 -1.200 -9.606 1.00 0.00 O ATOM 0 H GLY A 38 -6.974 0.886 -9.081 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.155 -0.302 -10.411 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.201 0.551 -11.608 1.00 0.00 H new ATOM 562 N VAL A 39 -7.059 -1.753 -11.722 1.00 0.00 N ATOM 563 CA VAL A 39 -6.110 -2.859 -11.831 1.00 0.00 C ATOM 564 C VAL A 39 -4.754 -2.345 -12.362 1.00 0.00 C ATOM 565 O VAL A 39 -4.245 -2.767 -13.393 1.00 0.00 O ATOM 566 CB VAL A 39 -6.739 -4.009 -12.694 1.00 0.00 C ATOM 567 CG1 VAL A 39 -7.714 -4.820 -11.781 1.00 0.00 C ATOM 568 CG2 VAL A 39 -6.905 -3.972 -14.233 1.00 0.00 C ATOM 0 H VAL A 39 -7.639 -1.597 -12.547 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.904 -3.286 -10.850 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.902 -4.611 -13.049 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.166 -5.627 -12.358 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.161 -5.240 -10.941 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.496 -4.160 -11.407 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.369 -4.898 -14.571 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.536 -3.128 -14.511 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.927 -3.864 -14.702 1.00 0.00 H new ATOM 578 N LEU A 40 -4.209 -1.409 -11.555 1.00 0.00 N ATOM 579 CA LEU A 40 -2.932 -0.787 -11.834 1.00 0.00 C ATOM 580 C LEU A 40 -2.535 -0.095 -10.525 1.00 0.00 C ATOM 581 O LEU A 40 -3.267 0.719 -9.973 1.00 0.00 O ATOM 582 CB LEU A 40 -3.033 0.208 -13.021 1.00 0.00 C ATOM 583 CG LEU A 40 -1.882 1.284 -13.075 1.00 0.00 C ATOM 584 CD1 LEU A 40 -0.314 1.263 -13.153 1.00 0.00 C ATOM 585 CD2 LEU A 40 -2.334 2.305 -14.129 1.00 0.00 C ATOM 0 H LEU A 40 -4.654 -1.076 -10.699 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.179 -1.512 -12.142 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.028 -0.357 -13.953 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.992 0.723 -12.966 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.842 1.332 -11.987 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.063 2.286 -13.169 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.087 0.742 -12.284 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.002 0.747 -14.061 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.581 3.088 -14.223 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.460 1.805 -15.089 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.282 2.748 -13.823 1.00 0.00 H new ATOM 597 N SER A 41 -1.319 -0.488 -10.083 1.00 0.00 N ATOM 598 CA SER A 41 -0.692 0.033 -8.876 1.00 0.00 C ATOM 599 C SER A 41 0.219 1.134 -9.414 1.00 0.00 C ATOM 600 O SER A 41 1.401 0.947 -9.678 1.00 0.00 O ATOM 601 CB SER A 41 0.084 -1.116 -8.167 1.00 0.00 C ATOM 602 OG SER A 41 0.990 -0.863 -7.019 1.00 0.00 O ATOM 0 H SER A 41 -0.751 -1.183 -10.568 1.00 0.00 H new ATOM 0 HA SER A 41 -1.380 0.421 -8.125 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.661 -1.835 -7.826 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.679 -1.613 -8.933 1.00 0.00 H new ATOM 0 HG SER A 41 1.640 -1.593 -6.948 1.00 0.00 H new ATOM 608 N SER A 42 -0.459 2.289 -9.567 1.00 0.00 N ATOM 609 CA SER A 42 0.123 3.509 -10.087 1.00 0.00 C ATOM 610 C SER A 42 0.889 4.124 -8.917 1.00 0.00 C ATOM 611 O SER A 42 0.345 4.392 -7.853 1.00 0.00 O ATOM 612 CB SER A 42 -1.060 4.371 -10.623 1.00 0.00 C ATOM 613 OG SER A 42 -2.363 3.702 -10.875 1.00 0.00 O ATOM 0 H SER A 42 -1.445 2.385 -9.323 1.00 0.00 H new ATOM 0 HA SER A 42 0.822 3.389 -10.915 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.233 5.178 -9.910 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.738 4.834 -11.556 1.00 0.00 H new ATOM 0 HG SER A 42 -3.010 4.360 -11.205 1.00 0.00 H new ATOM 619 N GLN A 43 2.193 4.318 -9.206 1.00 0.00 N ATOM 620 CA GLN A 43 3.111 4.837 -8.219 1.00 0.00 C ATOM 621 C GLN A 43 2.958 6.358 -8.157 1.00 0.00 C ATOM 622 O GLN A 43 2.101 6.870 -7.454 1.00 0.00 O ATOM 623 CB GLN A 43 4.544 4.354 -8.538 1.00 0.00 C ATOM 624 CG GLN A 43 5.634 4.888 -7.588 1.00 0.00 C ATOM 625 CD GLN A 43 5.220 4.831 -6.108 1.00 0.00 C ATOM 626 OE1 GLN A 43 4.849 3.608 -5.690 1.00 0.00 O flip ATOM 627 NE2 GLN A 43 5.239 5.830 -5.401 1.00 0.00 N flip ATOM 0 H GLN A 43 2.614 4.119 -10.114 1.00 0.00 H new ATOM 0 HA GLN A 43 2.886 4.459 -7.222 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.560 3.264 -8.510 1.00 0.00 H new ATOM 0 HB3 GLN A 43 4.793 4.650 -9.557 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.546 4.308 -7.727 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.868 5.919 -7.855 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.533 6.725 -5.791 1.00 0.00 H new ATOM 0 HE22 GLN A 43 4.960 5.767 -4.422 1.00 0.00 H new ATOM 636 N GLU A 44 3.836 7.032 -8.931 1.00 0.00 N ATOM 637 CA GLU A 44 3.964 8.477 -9.011 1.00 0.00 C ATOM 638 C GLU A 44 2.650 9.141 -9.448 1.00 0.00 C ATOM 639 O GLU A 44 2.486 10.341 -9.265 1.00 0.00 O ATOM 640 CB GLU A 44 5.114 8.834 -9.975 1.00 0.00 C ATOM 641 CG GLU A 44 4.881 8.340 -11.416 1.00 0.00 C ATOM 642 CD GLU A 44 6.078 8.694 -12.313 1.00 0.00 C ATOM 643 OE1 GLU A 44 7.007 7.891 -12.402 1.00 0.00 O ATOM 644 OE2 GLU A 44 6.069 9.768 -12.915 1.00 0.00 O ATOM 0 H GLU A 44 4.498 6.549 -9.539 1.00 0.00 H new ATOM 0 HA GLU A 44 4.194 8.862 -8.017 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.246 9.916 -9.987 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.042 8.404 -9.597 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.728 7.261 -11.415 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.973 8.791 -11.818 1.00 0.00 H new ATOM 651 N ASP A 45 1.729 8.341 -10.025 1.00 0.00 N ATOM 652 CA ASP A 45 0.482 8.914 -10.495 1.00 0.00 C ATOM 653 C ASP A 45 -0.489 8.951 -9.329 1.00 0.00 C ATOM 654 O ASP A 45 -1.093 9.989 -9.087 1.00 0.00 O ATOM 655 CB ASP A 45 -0.066 8.114 -11.692 1.00 0.00 C ATOM 656 CG ASP A 45 0.973 8.043 -12.827 1.00 0.00 C ATOM 657 OD1 ASP A 45 1.091 9.010 -13.579 1.00 0.00 O ATOM 658 OD2 ASP A 45 1.652 7.023 -12.944 1.00 0.00 O ATOM 0 H ASP A 45 1.831 7.336 -10.167 1.00 0.00 H new ATOM 0 HA ASP A 45 0.637 9.931 -10.855 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.329 7.106 -11.371 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.980 8.581 -12.059 1.00 0.00 H new ATOM 663 N PHE A 46 -0.625 7.807 -8.610 1.00 0.00 N ATOM 664 CA PHE A 46 -1.570 7.842 -7.502 1.00 0.00 C ATOM 665 C PHE A 46 -0.865 8.411 -6.261 1.00 0.00 C ATOM 666 O PHE A 46 -1.482 8.524 -5.212 1.00 0.00 O ATOM 667 CB PHE A 46 -2.333 6.522 -7.262 1.00 0.00 C ATOM 668 CG PHE A 46 -3.770 6.841 -6.914 1.00 0.00 C ATOM 669 CD1 PHE A 46 -4.135 7.199 -5.620 1.00 0.00 C ATOM 670 CD2 PHE A 46 -4.747 6.840 -7.908 1.00 0.00 C ATOM 671 CE1 PHE A 46 -5.435 7.585 -5.333 1.00 0.00 C ATOM 672 CE2 PHE A 46 -6.055 7.205 -7.618 1.00 0.00 C ATOM 673 CZ PHE A 46 -6.400 7.583 -6.329 1.00 0.00 C ATOM 0 H PHE A 46 -0.133 6.928 -8.768 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.383 8.517 -7.770 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.291 5.896 -8.153 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.866 5.959 -6.454 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.398 7.176 -4.831 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -4.484 6.552 -8.915 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.697 7.888 -4.330 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.804 7.195 -8.396 1.00 0.00 H new ATOM 0 HZ PHE A 46 -7.415 7.874 -6.102 1.00 0.00 H new ATOM 683 N ILE A 47 0.434 8.773 -6.400 1.00 0.00 N ATOM 684 CA ILE A 47 1.131 9.388 -5.278 1.00 0.00 C ATOM 685 C ILE A 47 0.753 10.877 -5.376 1.00 0.00 C ATOM 686 O ILE A 47 0.700 11.581 -4.374 1.00 0.00 O ATOM 687 CB ILE A 47 2.667 9.078 -5.253 1.00 0.00 C ATOM 688 CG1 ILE A 47 3.106 7.985 -4.243 1.00 0.00 C ATOM 689 CG2 ILE A 47 3.505 10.230 -5.892 1.00 0.00 C ATOM 690 CD1 ILE A 47 2.348 6.636 -4.277 1.00 0.00 C ATOM 0 H ILE A 47 0.989 8.651 -7.247 1.00 0.00 H new ATOM 0 HA ILE A 47 0.829 8.979 -4.314 1.00 0.00 H new ATOM 0 HB ILE A 47 3.152 8.379 -5.935 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.164 7.781 -4.407 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.013 8.398 -3.239 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.564 9.974 -5.854 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.202 10.368 -6.930 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.335 11.154 -5.339 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.759 5.969 -3.520 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.291 6.807 -4.075 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.460 6.181 -5.261 1.00 0.00 H new ATOM 702 N ASN A 48 0.468 11.304 -6.641 1.00 0.00 N ATOM 703 CA ASN A 48 0.051 12.673 -6.869 1.00 0.00 C ATOM 704 C ASN A 48 -1.423 12.752 -6.411 1.00 0.00 C ATOM 705 O ASN A 48 -1.883 13.799 -5.970 1.00 0.00 O ATOM 706 CB ASN A 48 0.233 13.034 -8.355 1.00 0.00 C ATOM 707 CG ASN A 48 -0.119 14.505 -8.627 1.00 0.00 C ATOM 708 OD1 ASN A 48 -1.157 14.824 -9.193 1.00 0.00 O ATOM 709 ND2 ASN A 48 0.814 15.368 -8.185 1.00 0.00 N ATOM 0 H ASN A 48 0.524 10.723 -7.477 1.00 0.00 H new ATOM 0 HA ASN A 48 0.649 13.393 -6.311 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.265 12.845 -8.652 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -0.398 12.389 -8.967 1.00 0.00 H new ATOM 0 HD21 ASN A 48 0.682 16.371 -8.313 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.653 15.019 -7.722 1.00 0.00 H new ATOM 716 N ALA A 49 -2.131 11.594 -6.521 1.00 0.00 N ATOM 717 CA ALA A 49 -3.523 11.551 -6.106 1.00 0.00 C ATOM 718 C ALA A 49 -3.575 11.058 -4.645 1.00 0.00 C ATOM 719 O ALA A 49 -4.652 10.807 -4.125 1.00 0.00 O ATOM 720 CB ALA A 49 -4.351 10.667 -7.045 1.00 0.00 C ATOM 0 H ALA A 49 -1.759 10.716 -6.883 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.964 12.546 -6.162 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.388 10.653 -6.711 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.301 11.066 -8.058 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.953 9.652 -7.035 1.00 0.00 H new ATOM 726 N ALA A 50 -2.389 10.911 -4.002 1.00 0.00 N ATOM 727 CA ALA A 50 -2.348 10.499 -2.603 1.00 0.00 C ATOM 728 C ALA A 50 -2.384 11.789 -1.789 1.00 0.00 C ATOM 729 O ALA A 50 -2.733 11.778 -0.620 1.00 0.00 O ATOM 730 CB ALA A 50 -1.104 9.667 -2.263 1.00 0.00 C ATOM 0 H ALA A 50 -1.477 11.070 -4.430 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.192 9.848 -2.376 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.129 9.390 -1.209 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.091 8.765 -2.875 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.208 10.254 -2.463 1.00 0.00 H new ATOM 736 N ILE A 51 -2.003 12.900 -2.453 1.00 0.00 N ATOM 737 CA ILE A 51 -2.047 14.205 -1.816 1.00 0.00 C ATOM 738 C ILE A 51 -3.538 14.601 -1.841 1.00 0.00 C ATOM 739 O ILE A 51 -4.074 15.170 -0.898 1.00 0.00 O ATOM 740 CB ILE A 51 -1.173 15.220 -2.624 1.00 0.00 C ATOM 741 CG1 ILE A 51 0.039 14.638 -3.385 1.00 0.00 C ATOM 742 CG2 ILE A 51 -1.356 16.652 -2.025 1.00 0.00 C ATOM 743 CD1 ILE A 51 0.949 15.656 -4.103 1.00 0.00 C ATOM 0 H ILE A 51 -1.668 12.907 -3.416 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.652 14.197 -0.800 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.445 15.494 -3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.648 14.074 -2.678 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -0.331 13.928 -4.125 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.748 17.362 -2.586 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.405 16.942 -2.090 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -1.043 16.652 -0.981 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.763 15.129 -4.600 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.367 16.206 -4.843 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.361 16.354 -3.374 1.00 0.00 H new ATOM 755 N GLU A 52 -4.151 14.226 -2.989 1.00 0.00 N ATOM 756 CA GLU A 52 -5.540 14.475 -3.310 1.00 0.00 C ATOM 757 C GLU A 52 -6.458 13.804 -2.271 1.00 0.00 C ATOM 758 O GLU A 52 -7.120 14.497 -1.508 1.00 0.00 O ATOM 759 CB GLU A 52 -5.841 13.982 -4.739 1.00 0.00 C ATOM 760 CG GLU A 52 -7.273 14.280 -5.210 1.00 0.00 C ATOM 761 CD GLU A 52 -7.504 13.693 -6.613 1.00 0.00 C ATOM 762 OE1 GLU A 52 -7.748 12.490 -6.713 1.00 0.00 O ATOM 763 OE2 GLU A 52 -7.437 14.441 -7.588 1.00 0.00 O ATOM 0 H GLU A 52 -3.658 13.726 -3.729 1.00 0.00 H new ATOM 0 HA GLU A 52 -5.735 15.547 -3.274 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.137 14.447 -5.429 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.670 12.907 -4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.990 13.855 -4.508 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.442 15.357 -5.226 1.00 0.00 H new ATOM 770 N THR A 53 -6.488 12.442 -2.275 1.00 0.00 N ATOM 771 CA THR A 53 -7.393 11.734 -1.384 1.00 0.00 C ATOM 772 C THR A 53 -6.837 11.785 0.028 1.00 0.00 C ATOM 773 O THR A 53 -7.448 12.370 0.912 1.00 0.00 O ATOM 774 CB THR A 53 -7.772 10.285 -1.847 1.00 0.00 C ATOM 775 OG1 THR A 53 -7.052 9.131 -1.308 1.00 0.00 O ATOM 776 CG2 THR A 53 -7.903 10.217 -3.389 1.00 0.00 C ATOM 0 H THR A 53 -5.910 11.848 -2.870 1.00 0.00 H new ATOM 0 HA THR A 53 -8.352 12.252 -1.412 1.00 0.00 H new ATOM 0 HB THR A 53 -8.735 10.149 -1.355 1.00 0.00 H new ATOM 0 HG1 THR A 53 -7.695 8.465 -0.987 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.166 9.202 -3.687 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.681 10.906 -3.719 1.00 0.00 H new ATOM 0 HG23 THR A 53 -6.954 10.495 -3.847 1.00 0.00 H new ATOM 784 N LYS A 54 -5.667 11.121 0.153 1.00 0.00 N ATOM 785 CA LYS A 54 -4.886 10.989 1.384 1.00 0.00 C ATOM 786 C LYS A 54 -4.572 9.502 1.555 1.00 0.00 C ATOM 787 O LYS A 54 -4.722 8.971 2.643 1.00 0.00 O ATOM 788 CB LYS A 54 -5.526 11.598 2.660 1.00 0.00 C ATOM 789 CG LYS A 54 -4.655 11.572 3.928 1.00 0.00 C ATOM 790 CD LYS A 54 -3.222 12.077 3.725 1.00 0.00 C ATOM 791 CE LYS A 54 -3.140 13.503 3.168 1.00 0.00 C ATOM 792 NZ LYS A 54 -1.761 13.945 3.005 1.00 0.00 N ATOM 0 H LYS A 54 -5.231 10.646 -0.638 1.00 0.00 H new ATOM 0 HA LYS A 54 -3.982 11.587 1.270 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -5.795 12.633 2.449 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -6.453 11.063 2.868 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -5.135 12.179 4.696 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -4.617 10.550 4.306 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -2.695 12.039 4.678 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -2.702 11.402 3.046 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -3.651 13.547 2.206 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -3.663 14.185 3.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.749 14.914 2.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -1.280 13.928 3.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -1.268 13.310 2.345 1.00 0.00 H new ATOM 805 N ALA A 55 -4.101 8.855 0.459 1.00 0.00 N ATOM 806 CA ALA A 55 -3.752 7.437 0.498 1.00 0.00 C ATOM 807 C ALA A 55 -2.650 7.287 1.560 1.00 0.00 C ATOM 808 O ALA A 55 -1.512 7.702 1.377 1.00 0.00 O ATOM 809 CB ALA A 55 -3.277 6.924 -0.873 1.00 0.00 C ATOM 0 H ALA A 55 -3.960 9.299 -0.448 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.626 6.837 0.750 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.028 5.865 -0.799 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -4.071 7.059 -1.607 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -2.395 7.483 -1.185 1.00 0.00 H new ATOM 815 N ASP A 56 -3.096 6.668 2.678 1.00 0.00 N ATOM 816 CA ASP A 56 -2.244 6.435 3.827 1.00 0.00 C ATOM 817 C ASP A 56 -1.546 5.107 3.538 1.00 0.00 C ATOM 818 O ASP A 56 -0.417 5.073 3.063 1.00 0.00 O ATOM 819 CB ASP A 56 -3.108 6.462 5.112 1.00 0.00 C ATOM 820 CG ASP A 56 -2.369 5.943 6.368 1.00 0.00 C ATOM 821 OD1 ASP A 56 -1.179 6.221 6.518 1.00 0.00 O ATOM 822 OD2 ASP A 56 -2.993 5.257 7.178 1.00 0.00 O ATOM 0 H ASP A 56 -4.050 6.326 2.791 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.484 7.198 3.995 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.442 7.484 5.294 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.001 5.859 4.951 1.00 0.00 H new ATOM 827 N LEU A 57 -2.289 4.025 3.853 1.00 0.00 N ATOM 828 CA LEU A 57 -1.761 2.691 3.641 1.00 0.00 C ATOM 829 C LEU A 57 -2.175 2.324 2.215 1.00 0.00 C ATOM 830 O LEU A 57 -3.255 2.675 1.761 1.00 0.00 O ATOM 831 CB LEU A 57 -2.271 1.735 4.732 1.00 0.00 C ATOM 832 CG LEU A 57 -3.817 1.517 4.729 1.00 0.00 C ATOM 833 CD1 LEU A 57 -4.124 0.087 4.201 1.00 0.00 C ATOM 834 CD2 LEU A 57 -4.791 2.348 5.602 1.00 0.00 C ATOM 0 H LEU A 57 -3.230 4.061 4.244 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.676 2.626 3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.780 0.769 4.610 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.973 2.123 5.706 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.300 2.234 4.065 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.202 -0.075 4.195 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.736 -0.018 3.188 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.650 -0.650 4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.813 2.012 5.427 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.540 2.215 6.654 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.705 3.402 5.340 1.00 0.00 H new ATOM 846 N ILE A 58 -1.242 1.625 1.532 1.00 0.00 N ATOM 847 CA ILE A 58 -1.476 1.220 0.152 1.00 0.00 C ATOM 848 C ILE A 58 -1.210 -0.284 0.126 1.00 0.00 C ATOM 849 O ILE A 58 -0.344 -0.801 0.820 1.00 0.00 O ATOM 850 CB ILE A 58 -0.635 2.099 -0.835 1.00 0.00 C ATOM 851 CG1 ILE A 58 -0.254 3.525 -0.277 1.00 0.00 C ATOM 852 CG2 ILE A 58 -0.090 1.252 -2.043 1.00 0.00 C ATOM 853 CD1 ILE A 58 0.289 4.501 -1.336 1.00 0.00 C ATOM 0 H ILE A 58 -0.341 1.340 1.915 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.494 1.390 -0.198 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.823 2.821 -1.630 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.136 3.967 0.188 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.494 3.406 0.507 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.488 1.895 -2.707 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.547 0.451 -1.668 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.927 0.822 -2.593 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.525 5.455 -0.865 1.00 0.00 H new ATOM 0 HD12 ILE A 58 1.191 4.086 -1.785 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.464 4.655 -2.109 1.00 0.00 H new ATOM 865 N CYS A 59 -2.033 -0.939 -0.724 1.00 0.00 N ATOM 866 CA CYS A 59 -1.959 -2.375 -0.886 1.00 0.00 C ATOM 867 C CYS A 59 -2.008 -2.651 -2.393 1.00 0.00 C ATOM 868 O CYS A 59 -2.860 -2.185 -3.142 1.00 0.00 O ATOM 869 CB CYS A 59 -3.107 -3.066 -0.129 1.00 0.00 C ATOM 870 SG CYS A 59 -3.155 -2.634 1.628 1.00 0.00 S ATOM 0 H CYS A 59 -2.744 -0.484 -1.296 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.038 -2.779 -0.465 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -4.056 -2.793 -0.591 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.003 -4.146 -0.229 1.00 0.00 H new ATOM 0 HG CYS A 59 -4.174 -3.214 2.190 1.00 0.00 H new ATOM 876 N VAL A 60 -0.996 -3.466 -2.746 1.00 0.00 N ATOM 877 CA VAL A 60 -0.743 -3.963 -4.083 1.00 0.00 C ATOM 878 C VAL A 60 -1.318 -5.377 -4.051 1.00 0.00 C ATOM 879 O VAL A 60 -1.138 -6.088 -3.070 1.00 0.00 O ATOM 880 CB VAL A 60 0.809 -3.948 -4.293 1.00 0.00 C ATOM 881 CG1 VAL A 60 1.157 -4.519 -5.698 1.00 0.00 C ATOM 882 CG2 VAL A 60 1.759 -2.964 -3.567 1.00 0.00 C ATOM 0 H VAL A 60 -0.312 -3.802 -2.068 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.185 -3.387 -4.896 1.00 0.00 H new ATOM 0 HB VAL A 60 1.203 -4.612 -3.524 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.238 -4.506 -5.838 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.793 -5.544 -5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.684 -3.908 -6.467 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.786 -3.152 -3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.485 -1.940 -3.820 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.676 -3.106 -2.490 1.00 0.00 H new ATOM 892 N SER A 61 -2.033 -5.740 -5.138 1.00 0.00 N ATOM 893 CA SER A 61 -2.636 -7.055 -5.167 1.00 0.00 C ATOM 894 C SER A 61 -2.060 -7.663 -6.419 1.00 0.00 C ATOM 895 O SER A 61 -2.619 -7.527 -7.491 1.00 0.00 O ATOM 896 CB SER A 61 -4.183 -6.908 -5.211 1.00 0.00 C ATOM 897 OG SER A 61 -4.789 -5.775 -5.954 1.00 0.00 O ATOM 0 H SER A 61 -2.192 -5.160 -5.962 1.00 0.00 H new ATOM 0 HA SER A 61 -2.433 -7.678 -4.296 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.587 -7.828 -5.633 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.535 -6.849 -4.181 1.00 0.00 H new ATOM 0 HG SER A 61 -4.090 -5.135 -6.202 1.00 0.00 H new ATOM 903 N SER A 62 -0.904 -8.321 -6.220 1.00 0.00 N ATOM 904 CA SER A 62 -0.216 -8.937 -7.341 1.00 0.00 C ATOM 905 C SER A 62 0.811 -9.866 -6.707 1.00 0.00 C ATOM 906 O SER A 62 0.819 -10.081 -5.505 1.00 0.00 O ATOM 907 CB SER A 62 0.429 -7.814 -8.219 1.00 0.00 C ATOM 908 OG SER A 62 1.474 -8.136 -9.218 1.00 0.00 O ATOM 0 H SER A 62 -0.446 -8.432 -5.315 1.00 0.00 H new ATOM 0 HA SER A 62 -0.867 -9.502 -8.007 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.383 -7.320 -8.753 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.855 -7.079 -7.536 1.00 0.00 H new ATOM 0 HG SER A 62 1.424 -7.498 -9.961 1.00 0.00 H new ATOM 914 N LEU A 63 1.658 -10.412 -7.602 1.00 0.00 N ATOM 915 CA LEU A 63 2.737 -11.309 -7.284 1.00 0.00 C ATOM 916 C LEU A 63 3.944 -10.764 -8.063 1.00 0.00 C ATOM 917 O LEU A 63 4.716 -11.502 -8.661 1.00 0.00 O ATOM 918 CB LEU A 63 2.368 -12.767 -7.614 1.00 0.00 C ATOM 919 CG LEU A 63 1.842 -13.002 -9.066 1.00 0.00 C ATOM 920 CD1 LEU A 63 2.874 -13.819 -9.901 1.00 0.00 C ATOM 921 CD2 LEU A 63 0.341 -12.767 -9.373 1.00 0.00 C ATOM 0 H LEU A 63 1.588 -10.219 -8.601 1.00 0.00 H new ATOM 0 HA LEU A 63 2.968 -11.344 -6.219 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.246 -13.393 -7.456 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.607 -13.102 -6.909 1.00 0.00 H new ATOM 0 HG LEU A 63 1.731 -12.189 -9.783 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.488 -13.971 -10.909 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.815 -13.272 -9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.042 -14.786 -9.427 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.148 -12.976 -10.425 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.265 -13.429 -8.754 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.083 -11.731 -9.155 1.00 0.00 H new ATOM 933 N TYR A 64 4.043 -9.413 -8.000 1.00 0.00 N ATOM 934 CA TYR A 64 5.085 -8.616 -8.626 1.00 0.00 C ATOM 935 C TYR A 64 4.673 -8.451 -10.098 1.00 0.00 C ATOM 936 O TYR A 64 4.923 -9.299 -10.946 1.00 0.00 O ATOM 937 CB TYR A 64 6.498 -9.225 -8.434 1.00 0.00 C ATOM 938 CG TYR A 64 7.592 -8.257 -8.046 1.00 0.00 C ATOM 939 CD1 TYR A 64 7.567 -6.898 -8.355 1.00 0.00 C ATOM 940 CD2 TYR A 64 8.678 -8.752 -7.336 1.00 0.00 C ATOM 941 CE1 TYR A 64 8.589 -6.056 -7.935 1.00 0.00 C ATOM 942 CE2 TYR A 64 9.710 -7.927 -6.918 1.00 0.00 C ATOM 943 CZ TYR A 64 9.670 -6.558 -7.200 1.00 0.00 C ATOM 944 OH TYR A 64 10.696 -5.714 -6.781 1.00 0.00 O ATOM 0 H TYR A 64 3.367 -8.844 -7.490 1.00 0.00 H new ATOM 0 HA TYR A 64 5.171 -7.638 -8.153 1.00 0.00 H new ATOM 0 HB2 TYR A 64 6.437 -9.999 -7.669 1.00 0.00 H new ATOM 0 HB3 TYR A 64 6.789 -9.717 -9.362 1.00 0.00 H new ATOM 0 HD1 TYR A 64 6.744 -6.495 -8.927 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.719 -9.806 -7.104 1.00 0.00 H new ATOM 0 HE1 TYR A 64 8.549 -5.004 -8.178 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.546 -8.342 -6.374 1.00 0.00 H new ATOM 0 HH TYR A 64 10.352 -5.089 -6.109 1.00 0.00 H new ATOM 954 N GLY A 65 4.025 -7.290 -10.323 1.00 0.00 N ATOM 955 CA GLY A 65 3.551 -6.882 -11.645 1.00 0.00 C ATOM 956 C GLY A 65 3.189 -5.387 -11.655 1.00 0.00 C ATOM 957 O GLY A 65 2.449 -4.908 -12.506 1.00 0.00 O ATOM 0 H GLY A 65 3.819 -6.614 -9.587 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.322 -7.080 -12.390 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.679 -7.474 -11.923 1.00 0.00 H new ATOM 961 N GLN A 66 3.763 -4.701 -10.643 1.00 0.00 N ATOM 962 CA GLN A 66 3.614 -3.274 -10.428 1.00 0.00 C ATOM 963 C GLN A 66 4.978 -2.638 -10.763 1.00 0.00 C ATOM 964 O GLN A 66 5.150 -1.427 -10.668 1.00 0.00 O ATOM 965 CB GLN A 66 3.266 -3.012 -8.950 1.00 0.00 C ATOM 966 CG GLN A 66 4.230 -3.733 -7.983 1.00 0.00 C ATOM 967 CD GLN A 66 4.255 -3.058 -6.610 1.00 0.00 C ATOM 968 OE1 GLN A 66 3.247 -2.586 -6.107 1.00 0.00 O ATOM 969 NE2 GLN A 66 5.476 -3.033 -6.049 1.00 0.00 N ATOM 0 H GLN A 66 4.355 -5.150 -9.944 1.00 0.00 H new ATOM 0 HA GLN A 66 2.820 -2.856 -11.047 1.00 0.00 H new ATOM 0 HB2 GLN A 66 3.296 -1.940 -8.757 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.246 -3.342 -8.755 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.925 -4.774 -7.873 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.235 -3.738 -8.406 1.00 0.00 H new ATOM 0 HE21 GLN A 66 6.269 -3.451 -6.535 1.00 0.00 H new ATOM 0 HE22 GLN A 66 5.609 -2.596 -5.137 1.00 0.00 H new ATOM 978 N GLY A 67 5.940 -3.515 -11.139 1.00 0.00 N ATOM 979 CA GLY A 67 7.285 -3.073 -11.450 1.00 0.00 C ATOM 980 C GLY A 67 8.040 -2.803 -10.145 1.00 0.00 C ATOM 981 O GLY A 67 7.452 -2.599 -9.089 1.00 0.00 O ATOM 0 H GLY A 67 5.793 -4.520 -11.228 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.804 -3.833 -12.034 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.252 -2.170 -12.059 1.00 0.00 H new ATOM 985 N GLU A 68 9.382 -2.802 -10.291 1.00 0.00 N ATOM 986 CA GLU A 68 10.234 -2.548 -9.140 1.00 0.00 C ATOM 987 C GLU A 68 10.311 -1.013 -8.921 1.00 0.00 C ATOM 988 O GLU A 68 11.073 -0.543 -8.085 1.00 0.00 O ATOM 989 CB GLU A 68 11.632 -3.170 -9.314 1.00 0.00 C ATOM 990 CG GLU A 68 11.598 -4.604 -9.865 1.00 0.00 C ATOM 991 CD GLU A 68 12.987 -5.257 -9.775 1.00 0.00 C ATOM 992 OE1 GLU A 68 13.784 -5.080 -10.696 1.00 0.00 O ATOM 993 OE2 GLU A 68 13.256 -5.937 -8.785 1.00 0.00 O ATOM 0 H GLU A 68 9.874 -2.970 -11.169 1.00 0.00 H new ATOM 0 HA GLU A 68 9.804 -3.022 -8.258 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.219 -2.544 -9.986 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.144 -3.171 -8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 68 10.876 -5.197 -9.304 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.263 -4.592 -10.902 1.00 0.00 H new ATOM 1000 N ILE A 69 9.494 -0.266 -9.706 1.00 0.00 N ATOM 1001 CA ILE A 69 9.423 1.182 -9.644 1.00 0.00 C ATOM 1002 C ILE A 69 8.419 1.502 -8.529 1.00 0.00 C ATOM 1003 O ILE A 69 8.694 2.318 -7.661 1.00 0.00 O ATOM 1004 CB ILE A 69 9.001 1.821 -11.007 1.00 0.00 C ATOM 1005 CG1 ILE A 69 8.129 0.876 -11.947 1.00 0.00 C ATOM 1006 CG2 ILE A 69 9.020 3.383 -10.803 1.00 0.00 C ATOM 1007 CD1 ILE A 69 9.036 -0.037 -12.785 1.00 0.00 C ATOM 0 H ILE A 69 8.868 -0.674 -10.400 1.00 0.00 H new ATOM 0 HA ILE A 69 10.404 1.608 -9.434 1.00 0.00 H new ATOM 0 HB ILE A 69 9.592 1.844 -11.922 1.00 0.00 H new ATOM 0 HG12 ILE A 69 7.456 0.271 -11.340 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.507 1.482 -12.605 1.00 0.00 H new ATOM 0 HG21 ILE A 69 8.731 3.875 -11.732 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.318 3.656 -10.015 1.00 0.00 H new ATOM 0 HG23 ILE A 69 10.024 3.701 -10.521 1.00 0.00 H new ATOM 0 HD11 ILE A 69 8.422 -0.675 -13.421 1.00 0.00 H new ATOM 0 HD12 ILE A 69 9.691 0.573 -13.407 1.00 0.00 H new ATOM 0 HD13 ILE A 69 9.639 -0.658 -12.123 1.00 0.00 H new ATOM 1019 N ASP A 70 7.252 0.812 -8.594 1.00 0.00 N ATOM 1020 CA ASP A 70 6.208 1.027 -7.600 1.00 0.00 C ATOM 1021 C ASP A 70 6.689 0.413 -6.270 1.00 0.00 C ATOM 1022 O ASP A 70 6.272 0.831 -5.196 1.00 0.00 O ATOM 1023 CB ASP A 70 4.871 0.424 -8.082 1.00 0.00 C ATOM 1024 CG ASP A 70 3.707 0.752 -7.130 1.00 0.00 C ATOM 1025 OD1 ASP A 70 3.581 0.080 -6.113 1.00 0.00 O ATOM 1026 OD2 ASP A 70 2.938 1.668 -7.411 1.00 0.00 O ATOM 0 H ASP A 70 7.028 0.122 -9.311 1.00 0.00 H new ATOM 0 HA ASP A 70 6.024 2.091 -7.450 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.641 0.804 -9.078 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.973 -0.658 -8.169 1.00 0.00 H new ATOM 1031 N CYS A 71 7.595 -0.582 -6.404 1.00 0.00 N ATOM 1032 CA CYS A 71 8.154 -1.280 -5.264 1.00 0.00 C ATOM 1033 C CYS A 71 9.023 -0.282 -4.498 1.00 0.00 C ATOM 1034 O CYS A 71 8.786 -0.024 -3.326 1.00 0.00 O ATOM 1035 CB CYS A 71 8.968 -2.474 -5.761 1.00 0.00 C ATOM 1036 SG CYS A 71 9.699 -3.465 -4.437 1.00 0.00 S ATOM 0 H CYS A 71 7.945 -0.908 -7.305 1.00 0.00 H new ATOM 0 HA CYS A 71 7.378 -1.663 -4.601 1.00 0.00 H new ATOM 0 HB2 CYS A 71 8.325 -3.113 -6.367 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.764 -2.113 -6.413 1.00 0.00 H new ATOM 0 HG CYS A 71 10.930 -3.094 -4.246 1.00 0.00 H new ATOM 1042 N LYS A 72 10.022 0.274 -5.228 1.00 0.00 N ATOM 1043 CA LYS A 72 10.948 1.234 -4.639 1.00 0.00 C ATOM 1044 C LYS A 72 10.391 2.650 -4.818 1.00 0.00 C ATOM 1045 O LYS A 72 11.127 3.628 -4.827 1.00 0.00 O ATOM 1046 CB LYS A 72 12.346 1.090 -5.269 1.00 0.00 C ATOM 1047 CG LYS A 72 12.940 -0.312 -5.088 1.00 0.00 C ATOM 1048 CD LYS A 72 14.410 -0.400 -5.526 1.00 0.00 C ATOM 1049 CE LYS A 72 14.616 -0.247 -7.038 1.00 0.00 C ATOM 1050 NZ LYS A 72 14.076 -1.367 -7.797 1.00 0.00 N ATOM 0 H LYS A 72 10.194 0.068 -6.212 1.00 0.00 H new ATOM 0 HA LYS A 72 11.052 1.036 -3.572 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.285 1.319 -6.333 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.017 1.824 -4.823 1.00 0.00 H new ATOM 0 HG2 LYS A 72 12.860 -0.602 -4.040 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.352 -1.027 -5.663 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.980 0.374 -5.011 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.817 -1.360 -5.209 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.142 0.675 -7.373 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.682 -0.152 -7.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.556 -1.426 -8.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.230 -2.250 -7.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.057 -1.226 -7.946 1.00 0.00 H new ATOM 1063 N GLY A 73 9.061 2.699 -4.937 1.00 0.00 N ATOM 1064 CA GLY A 73 8.319 3.931 -5.121 1.00 0.00 C ATOM 1065 C GLY A 73 7.621 4.327 -3.822 1.00 0.00 C ATOM 1066 O GLY A 73 7.452 5.500 -3.518 1.00 0.00 O ATOM 0 H GLY A 73 8.470 1.868 -4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.994 4.727 -5.436 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.582 3.805 -5.914 1.00 0.00 H new ATOM 1070 N LEU A 74 7.234 3.260 -3.089 1.00 0.00 N ATOM 1071 CA LEU A 74 6.566 3.398 -1.809 1.00 0.00 C ATOM 1072 C LEU A 74 7.675 3.526 -0.753 1.00 0.00 C ATOM 1073 O LEU A 74 7.491 4.135 0.293 1.00 0.00 O ATOM 1074 CB LEU A 74 5.619 2.207 -1.594 1.00 0.00 C ATOM 1075 CG LEU A 74 4.537 2.106 -2.749 1.00 0.00 C ATOM 1076 CD1 LEU A 74 3.482 1.030 -3.213 1.00 0.00 C ATOM 1077 CD2 LEU A 74 3.704 3.404 -2.626 1.00 0.00 C ATOM 0 H LEU A 74 7.382 2.293 -3.379 1.00 0.00 H new ATOM 0 HA LEU A 74 5.931 4.281 -1.747 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.197 1.284 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.117 2.310 -0.632 1.00 0.00 H new ATOM 0 HG LEU A 74 5.284 1.793 -3.479 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.939 1.404 -4.081 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.997 0.106 -3.478 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.780 0.835 -2.402 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.929 3.413 -3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.240 3.446 -1.641 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.355 4.268 -2.758 1.00 0.00 H new ATOM 1089 N ARG A 75 8.845 2.940 -1.097 1.00 0.00 N ATOM 1090 CA ARG A 75 10.014 3.019 -0.237 1.00 0.00 C ATOM 1091 C ARG A 75 10.515 4.473 -0.373 1.00 0.00 C ATOM 1092 O ARG A 75 11.020 5.065 0.572 1.00 0.00 O ATOM 1093 CB ARG A 75 11.082 2.009 -0.702 1.00 0.00 C ATOM 1094 CG ARG A 75 10.574 0.561 -0.756 1.00 0.00 C ATOM 1095 CD ARG A 75 10.547 -0.171 0.597 1.00 0.00 C ATOM 1096 NE ARG A 75 9.543 -1.237 0.660 1.00 0.00 N ATOM 1097 CZ ARG A 75 9.280 -2.152 -0.311 1.00 0.00 C ATOM 1098 NH1 ARG A 75 9.982 -2.222 -1.437 1.00 0.00 N ATOM 1099 NH2 ARG A 75 8.292 -3.022 -0.138 1.00 0.00 N ATOM 0 H ARG A 75 8.989 2.415 -1.960 1.00 0.00 H new ATOM 0 HA ARG A 75 9.789 2.773 0.801 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.438 2.298 -1.691 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.937 2.061 -0.028 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.566 0.561 -1.172 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.203 -0.003 -1.444 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.531 -0.597 0.792 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.350 0.551 1.389 1.00 0.00 H new ATOM 0 HE ARG A 75 8.989 -1.298 1.514 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.752 -1.573 -1.599 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.751 -2.924 -2.139 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.737 -3.000 0.718 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.088 -3.712 -0.861 1.00 0.00 H new ATOM 1113 N GLU A 76 10.314 5.002 -1.609 1.00 0.00 N ATOM 1114 CA GLU A 76 10.696 6.358 -1.955 1.00 0.00 C ATOM 1115 C GLU A 76 9.621 7.326 -1.418 1.00 0.00 C ATOM 1116 O GLU A 76 9.909 8.503 -1.267 1.00 0.00 O ATOM 1117 CB GLU A 76 10.868 6.468 -3.480 1.00 0.00 C ATOM 1118 CG GLU A 76 11.270 7.870 -3.967 1.00 0.00 C ATOM 1119 CD GLU A 76 11.509 7.862 -5.487 1.00 0.00 C ATOM 1120 OE1 GLU A 76 10.538 7.972 -6.235 1.00 0.00 O ATOM 1121 OE2 GLU A 76 12.660 7.745 -5.905 1.00 0.00 O ATOM 0 H GLU A 76 9.883 4.486 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 76 11.650 6.623 -1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.625 5.752 -3.802 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.933 6.182 -3.962 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.487 8.586 -3.719 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.174 8.195 -3.452 1.00 0.00 H new ATOM 1128 N LYS A 77 8.396 6.810 -1.135 1.00 0.00 N ATOM 1129 CA LYS A 77 7.288 7.607 -0.624 1.00 0.00 C ATOM 1130 C LYS A 77 7.532 7.890 0.880 1.00 0.00 C ATOM 1131 O LYS A 77 6.963 8.810 1.454 1.00 0.00 O ATOM 1132 CB LYS A 77 5.966 6.831 -0.821 1.00 0.00 C ATOM 1133 CG LYS A 77 4.687 7.611 -0.483 1.00 0.00 C ATOM 1134 CD LYS A 77 3.468 6.694 -0.316 1.00 0.00 C ATOM 1135 CE LYS A 77 2.203 7.462 0.088 1.00 0.00 C ATOM 1136 NZ LYS A 77 1.562 8.145 -1.027 1.00 0.00 N ATOM 0 H LYS A 77 8.165 5.824 -1.261 1.00 0.00 H new ATOM 0 HA LYS A 77 7.220 8.553 -1.162 1.00 0.00 H new ATOM 0 HB2 LYS A 77 5.908 6.504 -1.859 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.997 5.932 -0.205 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.842 8.176 0.436 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.487 8.336 -1.273 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.285 6.166 -1.252 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.687 5.939 0.439 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.493 6.767 0.536 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.460 8.194 0.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.754 8.699 -0.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.246 8.781 -1.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.227 7.443 -1.718 1.00 0.00 H new ATOM 1149 N CYS A 78 8.394 7.047 1.486 1.00 0.00 N ATOM 1150 CA CYS A 78 8.725 7.131 2.904 1.00 0.00 C ATOM 1151 C CYS A 78 9.914 8.043 3.036 1.00 0.00 C ATOM 1152 O CYS A 78 10.002 8.927 3.879 1.00 0.00 O ATOM 1153 CB CYS A 78 8.928 5.731 3.499 1.00 0.00 C ATOM 1154 SG CYS A 78 7.461 4.697 3.285 1.00 0.00 S ATOM 0 H CYS A 78 8.875 6.292 0.996 1.00 0.00 H new ATOM 0 HA CYS A 78 7.909 7.558 3.487 1.00 0.00 H new ATOM 0 HB2 CYS A 78 9.783 5.253 3.022 1.00 0.00 H new ATOM 0 HB3 CYS A 78 9.162 5.817 4.560 1.00 0.00 H new ATOM 0 HG CYS A 78 7.793 3.445 3.391 1.00 0.00 H new ATOM 1160 N ASP A 79 10.792 7.748 2.082 1.00 0.00 N ATOM 1161 CA ASP A 79 12.032 8.441 1.873 1.00 0.00 C ATOM 1162 C ASP A 79 11.730 9.785 1.186 1.00 0.00 C ATOM 1163 O ASP A 79 12.625 10.571 0.900 1.00 0.00 O ATOM 1164 CB ASP A 79 13.068 7.545 1.168 1.00 0.00 C ATOM 1165 CG ASP A 79 14.478 8.165 1.184 1.00 0.00 C ATOM 1166 OD1 ASP A 79 15.106 8.170 2.242 1.00 0.00 O ATOM 1167 OD2 ASP A 79 14.931 8.632 0.140 1.00 0.00 O ATOM 0 H ASP A 79 10.642 6.990 1.416 1.00 0.00 H new ATOM 0 HA ASP A 79 12.516 8.680 2.820 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.096 6.571 1.656 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.758 7.376 0.137 1.00 0.00 H new ATOM 1172 N GLU A 80 10.421 10.004 0.969 1.00 0.00 N ATOM 1173 CA GLU A 80 9.903 11.223 0.391 1.00 0.00 C ATOM 1174 C GLU A 80 9.863 12.200 1.557 1.00 0.00 C ATOM 1175 O GLU A 80 10.407 13.297 1.518 1.00 0.00 O ATOM 1176 CB GLU A 80 8.493 11.094 -0.230 1.00 0.00 C ATOM 1177 CG GLU A 80 7.970 12.401 -0.852 1.00 0.00 C ATOM 1178 CD GLU A 80 8.782 12.796 -2.096 1.00 0.00 C ATOM 1179 OE1 GLU A 80 8.518 12.250 -3.167 1.00 0.00 O ATOM 1180 OE2 GLU A 80 9.667 13.643 -1.980 1.00 0.00 O ATOM 0 H GLU A 80 9.698 9.322 1.198 1.00 0.00 H new ATOM 0 HA GLU A 80 10.534 11.533 -0.442 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.513 10.319 -0.997 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.795 10.763 0.540 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.921 12.282 -1.123 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.020 13.202 -0.114 1.00 0.00 H new ATOM 1187 N ALA A 81 9.154 11.685 2.588 1.00 0.00 N ATOM 1188 CA ALA A 81 8.928 12.392 3.842 1.00 0.00 C ATOM 1189 C ALA A 81 8.088 13.642 3.513 1.00 0.00 C ATOM 1190 O ALA A 81 8.296 14.723 4.051 1.00 0.00 O ATOM 1191 CB ALA A 81 10.247 12.719 4.567 1.00 0.00 C ATOM 0 H ALA A 81 8.725 10.760 2.560 1.00 0.00 H new ATOM 0 HA ALA A 81 8.383 11.764 4.547 1.00 0.00 H new ATOM 0 HB1 ALA A 81 10.030 13.246 5.496 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.779 11.794 4.790 1.00 0.00 H new ATOM 0 HB3 ALA A 81 10.866 13.349 3.929 1.00 0.00 H new ATOM 1197 N GLY A 82 7.136 13.402 2.586 1.00 0.00 N ATOM 1198 CA GLY A 82 6.205 14.408 2.095 1.00 0.00 C ATOM 1199 C GLY A 82 4.856 13.725 1.873 1.00 0.00 C ATOM 1200 O GLY A 82 3.811 14.184 2.318 1.00 0.00 O ATOM 0 H GLY A 82 7.001 12.486 2.159 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.108 15.222 2.813 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.570 14.845 1.166 1.00 0.00 H new ATOM 1204 N LEU A 83 4.977 12.584 1.159 1.00 0.00 N ATOM 1205 CA LEU A 83 3.838 11.737 0.861 1.00 0.00 C ATOM 1206 C LEU A 83 3.750 10.833 2.094 1.00 0.00 C ATOM 1207 O LEU A 83 4.684 10.111 2.422 1.00 0.00 O ATOM 1208 CB LEU A 83 4.106 10.917 -0.406 1.00 0.00 C ATOM 1209 CG LEU A 83 4.203 11.770 -1.710 1.00 0.00 C ATOM 1210 CD1 LEU A 83 5.013 10.962 -2.770 1.00 0.00 C ATOM 1211 CD2 LEU A 83 3.188 12.875 -2.075 1.00 0.00 C ATOM 0 H LEU A 83 5.862 12.242 0.785 1.00 0.00 H new ATOM 0 HA LEU A 83 2.917 12.289 0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.036 10.363 -0.277 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.311 10.181 -0.524 1.00 0.00 H new ATOM 0 HG LEU A 83 4.735 12.697 -1.495 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.091 11.543 -3.689 1.00 0.00 H new ATOM 0 HD12 LEU A 83 6.012 10.756 -2.385 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.503 10.021 -2.978 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.467 13.325 -3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.191 12.441 -2.157 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.188 13.640 -1.298 1.00 0.00 H new ATOM 1223 N LYS A 84 2.579 10.929 2.754 1.00 0.00 N ATOM 1224 CA LYS A 84 2.359 10.166 3.971 1.00 0.00 C ATOM 1225 C LYS A 84 1.873 8.775 3.550 1.00 0.00 C ATOM 1226 O LYS A 84 0.872 8.611 2.862 1.00 0.00 O ATOM 1227 CB LYS A 84 1.402 10.919 4.916 1.00 0.00 C ATOM 1228 CG LYS A 84 -0.074 10.957 4.476 1.00 0.00 C ATOM 1229 CD LYS A 84 -0.922 9.861 5.143 1.00 0.00 C ATOM 1230 CE LYS A 84 -1.257 10.193 6.601 1.00 0.00 C ATOM 1231 NZ LYS A 84 -1.835 9.060 7.304 1.00 0.00 N ATOM 0 H LYS A 84 1.796 11.515 2.464 1.00 0.00 H new ATOM 0 HA LYS A 84 3.273 10.043 4.551 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.457 10.458 5.902 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.757 11.944 5.023 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.495 11.933 4.717 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.129 10.844 3.393 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.846 9.727 4.581 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.385 8.914 5.102 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.351 10.514 7.116 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.954 11.030 6.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.998 9.315 8.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.739 8.801 6.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.182 8.252 7.257 1.00 0.00 H new ATOM 1244 N GLY A 85 2.671 7.792 4.012 1.00 0.00 N ATOM 1245 CA GLY A 85 2.373 6.401 3.723 1.00 0.00 C ATOM 1246 C GLY A 85 3.604 5.536 3.992 1.00 0.00 C ATOM 1247 O GLY A 85 4.351 5.184 3.088 1.00 0.00 O ATOM 0 H GLY A 85 3.508 7.944 4.575 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.540 6.063 4.339 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.064 6.295 2.683 1.00 0.00 H new ATOM 1251 N ILE A 86 3.744 5.225 5.301 1.00 0.00 N ATOM 1252 CA ILE A 86 4.831 4.388 5.795 1.00 0.00 C ATOM 1253 C ILE A 86 4.175 3.086 6.264 1.00 0.00 C ATOM 1254 O ILE A 86 4.542 2.501 7.277 1.00 0.00 O ATOM 1255 CB ILE A 86 5.630 5.082 6.943 1.00 0.00 C ATOM 1256 CG1 ILE A 86 7.104 4.638 7.100 1.00 0.00 C ATOM 1257 CG2 ILE A 86 4.650 5.713 7.986 1.00 0.00 C ATOM 1258 CD1 ILE A 86 7.889 5.264 8.273 1.00 0.00 C ATOM 0 H ILE A 86 3.107 5.550 6.028 1.00 0.00 H new ATOM 0 HA ILE A 86 5.567 4.201 5.013 1.00 0.00 H new ATOM 0 HB ILE A 86 6.165 6.027 6.848 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.124 3.554 7.216 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.631 4.870 6.174 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.223 6.193 8.780 1.00 0.00 H new ATOM 0 HG22 ILE A 86 4.022 6.455 7.493 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.021 4.932 8.414 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.907 4.875 8.278 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.915 6.347 8.156 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.400 5.012 9.214 1.00 0.00 H new ATOM 1270 N LYS A 87 3.175 2.689 5.452 1.00 0.00 N ATOM 1271 CA LYS A 87 2.397 1.489 5.667 1.00 0.00 C ATOM 1272 C LYS A 87 2.113 1.013 4.251 1.00 0.00 C ATOM 1273 O LYS A 87 1.429 1.676 3.483 1.00 0.00 O ATOM 1274 CB LYS A 87 1.074 1.798 6.382 1.00 0.00 C ATOM 1275 CG LYS A 87 1.237 2.395 7.787 1.00 0.00 C ATOM 1276 CD LYS A 87 1.771 1.370 8.794 1.00 0.00 C ATOM 1277 CE LYS A 87 1.780 1.892 10.232 1.00 0.00 C ATOM 1278 NZ LYS A 87 2.712 2.997 10.422 1.00 0.00 N ATOM 0 H LYS A 87 2.894 3.211 4.622 1.00 0.00 H new ATOM 0 HA LYS A 87 2.915 0.760 6.290 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.498 2.492 5.770 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.492 0.879 6.456 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.917 3.246 7.742 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.275 2.774 8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.160 0.468 8.745 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.784 1.085 8.511 1.00 0.00 H new ATOM 0 HE2 LYS A 87 0.776 2.218 10.502 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.044 1.079 10.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.679 3.313 11.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 3.676 2.682 10.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.447 3.786 9.798 1.00 0.00 H new ATOM 1291 N LEU A 88 2.700 -0.157 3.951 1.00 0.00 N ATOM 1292 CA LEU A 88 2.529 -0.728 2.627 1.00 0.00 C ATOM 1293 C LEU A 88 2.362 -2.221 2.851 1.00 0.00 C ATOM 1294 O LEU A 88 3.329 -2.956 2.979 1.00 0.00 O ATOM 1295 CB LEU A 88 3.742 -0.398 1.743 1.00 0.00 C ATOM 1296 CG LEU A 88 3.920 1.139 1.547 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.816 1.697 0.605 1.00 0.00 C ATOM 1298 CD2 LEU A 88 4.902 2.096 2.283 1.00 0.00 C ATOM 0 H LEU A 88 3.277 -0.703 4.591 1.00 0.00 H new ATOM 0 HA LEU A 88 1.665 -0.321 2.102 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.643 -0.813 2.194 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.623 -0.876 0.771 1.00 0.00 H new ATOM 0 HG LEU A 88 5.007 1.205 1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 88 2.954 2.771 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.883 1.206 -0.366 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.835 1.506 1.041 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.770 3.111 1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.697 2.075 3.353 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.928 1.773 2.104 1.00 0.00 H new ATOM 1310 N PHE A 89 1.080 -2.641 2.839 1.00 0.00 N ATOM 1311 CA PHE A 89 0.792 -4.048 3.048 1.00 0.00 C ATOM 1312 C PHE A 89 0.575 -4.540 1.610 1.00 0.00 C ATOM 1313 O PHE A 89 -0.510 -4.545 1.041 1.00 0.00 O ATOM 1314 CB PHE A 89 -0.405 -4.185 4.018 1.00 0.00 C ATOM 1315 CG PHE A 89 -0.536 -5.514 4.733 1.00 0.00 C ATOM 1316 CD1 PHE A 89 0.358 -6.569 4.543 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -1.603 -5.705 5.607 1.00 0.00 C ATOM 1318 CE1 PHE A 89 0.172 -7.786 5.186 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -1.793 -6.926 6.243 1.00 0.00 C ATOM 1320 CZ PHE A 89 -0.908 -7.969 6.032 1.00 0.00 C ATOM 0 H PHE A 89 0.267 -2.043 2.692 1.00 0.00 H new ATOM 0 HA PHE A 89 1.560 -4.649 3.534 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.330 -3.398 4.768 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.323 -4.005 3.458 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.206 -6.437 3.887 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.292 -4.894 5.793 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.872 -8.592 5.025 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.635 -7.062 6.905 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.059 -8.919 6.524 1.00 0.00 H new ATOM 1330 N VAL A 90 1.737 -4.973 1.084 1.00 0.00 N ATOM 1331 CA VAL A 90 1.847 -5.413 -0.291 1.00 0.00 C ATOM 1332 C VAL A 90 1.553 -6.918 -0.378 1.00 0.00 C ATOM 1333 O VAL A 90 2.383 -7.801 -0.207 1.00 0.00 O ATOM 1334 CB VAL A 90 3.278 -5.001 -0.793 1.00 0.00 C ATOM 1335 CG1 VAL A 90 3.472 -3.470 -0.550 1.00 0.00 C ATOM 1336 CG2 VAL A 90 4.534 -5.894 -0.940 1.00 0.00 C ATOM 0 H VAL A 90 2.611 -5.022 1.608 1.00 0.00 H new ATOM 0 HA VAL A 90 1.114 -4.941 -0.945 1.00 0.00 H new ATOM 0 HB VAL A 90 3.211 -5.379 -1.813 1.00 0.00 H new ATOM 0 HG11 VAL A 90 4.462 -3.170 -0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.713 -2.915 -1.101 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.377 -3.256 0.515 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.364 -5.295 -1.315 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.798 -6.313 0.031 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.325 -6.704 -1.639 1.00 0.00 H new ATOM 1346 N GLY A 91 0.256 -7.121 -0.655 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.259 -8.473 -0.803 1.00 0.00 C ATOM 1348 C GLY A 91 0.219 -9.184 -2.073 1.00 0.00 C ATOM 1349 O GLY A 91 -0.040 -8.754 -3.189 1.00 0.00 O ATOM 0 H GLY A 91 -0.434 -6.380 -0.777 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.038 -9.062 0.065 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -1.348 -8.438 -0.806 1.00 0.00 H new ATOM 1353 N GLY A 92 0.938 -10.299 -1.789 1.00 0.00 N ATOM 1354 CA GLY A 92 1.509 -11.202 -2.785 1.00 0.00 C ATOM 1355 C GLY A 92 2.829 -10.694 -3.401 1.00 0.00 C ATOM 1356 O GLY A 92 3.792 -11.439 -3.542 1.00 0.00 O ATOM 0 H GLY A 92 1.134 -10.591 -0.832 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.685 -12.173 -2.323 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.782 -11.355 -3.582 1.00 0.00 H new ATOM 1360 N ASN A 93 2.791 -9.385 -3.749 1.00 0.00 N ATOM 1361 CA ASN A 93 3.850 -8.594 -4.358 1.00 0.00 C ATOM 1362 C ASN A 93 5.142 -8.896 -3.587 1.00 0.00 C ATOM 1363 O ASN A 93 5.194 -8.861 -2.364 1.00 0.00 O ATOM 1364 CB ASN A 93 3.405 -7.118 -4.312 1.00 0.00 C ATOM 1365 CG ASN A 93 4.498 -6.106 -4.696 1.00 0.00 C ATOM 1366 OD1 ASN A 93 4.700 -5.102 -4.026 1.00 0.00 O ATOM 1367 ND2 ASN A 93 5.185 -6.433 -5.802 1.00 0.00 N ATOM 0 H ASN A 93 1.951 -8.828 -3.594 1.00 0.00 H new ATOM 0 HA ASN A 93 4.042 -8.832 -5.404 1.00 0.00 H new ATOM 0 HB2 ASN A 93 2.556 -6.987 -4.983 1.00 0.00 H new ATOM 0 HB3 ASN A 93 3.054 -6.889 -3.306 1.00 0.00 H new ATOM 0 HD21 ASN A 93 5.934 -5.826 -6.136 1.00 0.00 H new ATOM 0 HD22 ASN A 93 4.958 -7.289 -6.309 1.00 0.00 H new ATOM 1374 N ILE A 94 6.168 -9.216 -4.413 1.00 0.00 N ATOM 1375 CA ILE A 94 7.500 -9.586 -3.950 1.00 0.00 C ATOM 1376 C ILE A 94 7.280 -10.839 -3.094 1.00 0.00 C ATOM 1377 O ILE A 94 7.360 -10.813 -1.873 1.00 0.00 O ATOM 1378 CB ILE A 94 8.277 -8.460 -3.184 1.00 0.00 C ATOM 1379 CG1 ILE A 94 7.794 -7.005 -3.329 1.00 0.00 C ATOM 1380 CG2 ILE A 94 9.746 -8.955 -2.996 1.00 0.00 C ATOM 1381 CD1 ILE A 94 8.615 -5.948 -2.553 1.00 0.00 C ATOM 0 H ILE A 94 6.078 -9.220 -5.429 1.00 0.00 H new ATOM 0 HA ILE A 94 8.156 -9.767 -4.802 1.00 0.00 H new ATOM 0 HB ILE A 94 7.984 -8.259 -2.154 1.00 0.00 H new ATOM 0 HG12 ILE A 94 7.803 -6.742 -4.387 1.00 0.00 H new ATOM 0 HG13 ILE A 94 6.758 -6.950 -2.996 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.321 -8.196 -2.465 1.00 0.00 H new ATOM 0 HG22 ILE A 94 9.747 -9.880 -2.420 1.00 0.00 H new ATOM 0 HG23 ILE A 94 10.197 -9.135 -3.972 1.00 0.00 H new ATOM 0 HD11 ILE A 94 8.190 -4.959 -2.725 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.586 -6.175 -1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.648 -5.964 -2.900 1.00 0.00 H new ATOM 1393 N VAL A 95 6.980 -11.922 -3.841 1.00 0.00 N ATOM 1394 CA VAL A 95 6.690 -13.226 -3.265 1.00 0.00 C ATOM 1395 C VAL A 95 8.011 -13.908 -2.856 1.00 0.00 C ATOM 1396 O VAL A 95 9.043 -13.266 -2.703 1.00 0.00 O ATOM 1397 CB VAL A 95 5.839 -14.029 -4.313 1.00 0.00 C ATOM 1398 CG1 VAL A 95 4.713 -14.825 -3.584 1.00 0.00 C ATOM 1399 CG2 VAL A 95 5.745 -13.644 -5.811 1.00 0.00 C ATOM 0 H VAL A 95 6.935 -11.904 -4.860 1.00 0.00 H new ATOM 0 HA VAL A 95 6.101 -13.160 -2.350 1.00 0.00 H new ATOM 0 HB VAL A 95 6.520 -14.735 -4.788 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.127 -15.380 -4.317 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.160 -15.522 -2.875 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.064 -14.131 -3.050 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.097 -14.351 -6.329 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.332 -12.639 -5.903 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.739 -13.670 -6.256 1.00 0.00 H new ATOM 1409 N VAL A 96 7.872 -15.244 -2.683 1.00 0.00 N ATOM 1410 CA VAL A 96 8.905 -16.216 -2.282 1.00 0.00 C ATOM 1411 C VAL A 96 9.438 -15.852 -0.875 1.00 0.00 C ATOM 1412 O VAL A 96 9.973 -14.777 -0.633 1.00 0.00 O ATOM 1413 CB VAL A 96 10.054 -16.528 -3.347 1.00 0.00 C ATOM 1414 CG1 VAL A 96 10.103 -17.262 -4.748 1.00 0.00 C ATOM 1415 CG2 VAL A 96 10.905 -15.261 -3.580 1.00 0.00 C ATOM 0 H VAL A 96 6.971 -15.698 -2.831 1.00 0.00 H new ATOM 0 HA VAL A 96 8.403 -17.183 -2.241 1.00 0.00 H new ATOM 0 HB VAL A 96 10.274 -17.415 -2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 96 11.122 -17.242 -5.134 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.781 -18.296 -4.628 1.00 0.00 H new ATOM 0 HG13 VAL A 96 9.440 -16.754 -5.448 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.688 -15.477 -4.307 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.269 -14.460 -3.958 1.00 0.00 H new ATOM 0 HG23 VAL A 96 11.359 -14.950 -2.639 1.00 0.00 H new ATOM 1425 N GLY A 97 9.228 -16.825 0.044 1.00 0.00 N ATOM 1426 CA GLY A 97 9.641 -16.658 1.433 1.00 0.00 C ATOM 1427 C GLY A 97 8.690 -15.694 2.156 1.00 0.00 C ATOM 1428 O GLY A 97 7.971 -14.930 1.527 1.00 0.00 O ATOM 0 H GLY A 97 8.780 -17.718 -0.161 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.644 -17.624 1.938 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.660 -16.274 1.473 1.00 0.00 H new ATOM 1432 N LYS A 98 8.713 -15.792 3.501 1.00 0.00 N ATOM 1433 CA LYS A 98 7.880 -14.931 4.331 1.00 0.00 C ATOM 1434 C LYS A 98 8.658 -14.822 5.639 1.00 0.00 C ATOM 1435 O LYS A 98 8.769 -15.777 6.397 1.00 0.00 O ATOM 1436 CB LYS A 98 6.455 -15.483 4.541 1.00 0.00 C ATOM 1437 CG LYS A 98 5.621 -15.496 3.249 1.00 0.00 C ATOM 1438 CD LYS A 98 4.118 -15.706 3.478 1.00 0.00 C ATOM 1439 CE LYS A 98 3.404 -14.471 4.045 1.00 0.00 C ATOM 1440 NZ LYS A 98 3.451 -13.325 3.145 1.00 0.00 N ATOM 0 H LYS A 98 9.294 -16.452 4.019 1.00 0.00 H new ATOM 0 HA LYS A 98 7.706 -13.962 3.863 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.518 -16.497 4.937 1.00 0.00 H new ATOM 0 HB3 LYS A 98 5.944 -14.879 5.291 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.770 -14.553 2.723 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.993 -16.286 2.597 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.650 -15.984 2.533 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.977 -16.543 4.162 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.364 -14.722 4.251 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.861 -14.198 4.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.803 -12.587 3.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.420 -12.948 3.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.164 -13.621 2.190 1.00 0.00 H new ATOM 1453 N GLN A 99 9.186 -13.587 5.819 1.00 0.00 N ATOM 1454 CA GLN A 99 10.015 -13.147 6.939 1.00 0.00 C ATOM 1455 C GLN A 99 11.447 -13.249 6.404 1.00 0.00 C ATOM 1456 O GLN A 99 12.222 -12.302 6.445 1.00 0.00 O ATOM 1457 CB GLN A 99 9.794 -13.916 8.264 1.00 0.00 C ATOM 1458 CG GLN A 99 10.463 -13.267 9.490 1.00 0.00 C ATOM 1459 CD GLN A 99 11.996 -13.380 9.465 1.00 0.00 C ATOM 1460 OE1 GLN A 99 12.713 -12.388 9.420 1.00 0.00 O ATOM 1461 NE2 GLN A 99 12.444 -14.648 9.497 1.00 0.00 N ATOM 0 H GLN A 99 9.029 -12.839 5.143 1.00 0.00 H new ATOM 0 HA GLN A 99 9.752 -12.134 7.243 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.723 -13.998 8.449 1.00 0.00 H new ATOM 0 HB3 GLN A 99 10.176 -14.931 8.150 1.00 0.00 H new ATOM 0 HG2 GLN A 99 10.182 -12.215 9.536 1.00 0.00 H new ATOM 0 HG3 GLN A 99 10.084 -13.738 10.397 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.781 -15.422 9.534 1.00 0.00 H new ATOM 0 HE22 GLN A 99 13.447 -14.835 9.484 1.00 0.00 H new ATOM 1470 N ASN A 100 11.726 -14.467 5.892 1.00 0.00 N ATOM 1471 CA ASN A 100 13.006 -14.811 5.302 1.00 0.00 C ATOM 1472 C ASN A 100 12.836 -14.524 3.802 1.00 0.00 C ATOM 1473 O ASN A 100 12.685 -15.415 2.975 1.00 0.00 O ATOM 1474 CB ASN A 100 13.372 -16.277 5.626 1.00 0.00 C ATOM 1475 CG ASN A 100 12.246 -17.282 5.295 1.00 0.00 C ATOM 1476 OD1 ASN A 100 11.233 -17.362 5.979 1.00 0.00 O ATOM 1477 ND2 ASN A 100 12.501 -18.046 4.217 1.00 0.00 N ATOM 0 H ASN A 100 11.054 -15.234 5.884 1.00 0.00 H new ATOM 0 HA ASN A 100 13.840 -14.232 5.699 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.268 -16.551 5.069 1.00 0.00 H new ATOM 0 HB3 ASN A 100 13.619 -16.356 6.685 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.826 -18.751 3.920 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.369 -17.920 3.697 1.00 0.00 H new ATOM 1484 N TRP A 101 12.876 -13.204 3.517 1.00 0.00 N ATOM 1485 CA TRP A 101 12.726 -12.721 2.156 1.00 0.00 C ATOM 1486 C TRP A 101 14.122 -12.816 1.522 1.00 0.00 C ATOM 1487 O TRP A 101 15.120 -12.870 2.231 1.00 0.00 O ATOM 1488 CB TRP A 101 12.273 -11.252 2.157 1.00 0.00 C ATOM 1489 CG TRP A 101 10.928 -11.104 2.830 1.00 0.00 C ATOM 1490 CD1 TRP A 101 10.700 -10.608 4.116 1.00 0.00 C ATOM 1491 CD2 TRP A 101 9.637 -11.426 2.279 1.00 0.00 C ATOM 1492 NE1 TRP A 101 9.369 -10.613 4.367 1.00 0.00 N ATOM 1493 CE2 TRP A 101 8.678 -11.106 3.268 1.00 0.00 C ATOM 1494 CE3 TRP A 101 9.240 -11.938 1.074 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 7.347 -11.311 3.021 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 7.886 -12.145 0.820 1.00 0.00 C ATOM 1497 CH2 TRP A 101 6.939 -11.834 1.795 1.00 0.00 C ATOM 0 H TRP A 101 13.010 -12.472 4.214 1.00 0.00 H new ATOM 0 HA TRP A 101 11.982 -13.303 1.611 1.00 0.00 H new ATOM 0 HB2 TRP A 101 13.012 -10.640 2.673 1.00 0.00 H new ATOM 0 HB3 TRP A 101 12.214 -10.884 1.133 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.464 -10.273 4.802 1.00 0.00 H new ATOM 0 HE1 TRP A 101 8.937 -10.300 5.237 1.00 0.00 H new ATOM 0 HE3 TRP A 101 9.975 -12.181 0.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.614 -11.068 3.776 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 7.570 -12.546 -0.132 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.889 -11.998 1.600 1.00 0.00 H new ATOM 1508 N PRO A 102 14.173 -12.827 0.153 1.00 0.00 N ATOM 1509 CA PRO A 102 15.447 -12.890 -0.563 1.00 0.00 C ATOM 1510 C PRO A 102 16.184 -11.544 -0.355 1.00 0.00 C ATOM 1511 O PRO A 102 15.945 -10.801 0.590 1.00 0.00 O ATOM 1512 CB PRO A 102 15.055 -13.146 -2.041 1.00 0.00 C ATOM 1513 CG PRO A 102 13.575 -13.524 -2.029 1.00 0.00 C ATOM 1514 CD PRO A 102 13.010 -12.951 -0.729 1.00 0.00 C ATOM 0 HA PRO A 102 16.124 -13.671 -0.218 1.00 0.00 H new ATOM 0 HB2 PRO A 102 15.225 -12.257 -2.649 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.658 -13.946 -2.471 1.00 0.00 H new ATOM 0 HG2 PRO A 102 13.059 -13.111 -2.896 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.447 -14.606 -2.068 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.533 -11.985 -0.895 1.00 0.00 H new ATOM 0 HD3 PRO A 102 12.255 -13.610 -0.300 1.00 0.00 H new ATOM 1522 N ASP A 103 17.060 -11.264 -1.346 1.00 0.00 N ATOM 1523 CA ASP A 103 17.885 -10.065 -1.373 1.00 0.00 C ATOM 1524 C ASP A 103 16.974 -8.843 -1.591 1.00 0.00 C ATOM 1525 O ASP A 103 17.347 -7.721 -1.271 1.00 0.00 O ATOM 1526 CB ASP A 103 18.971 -10.184 -2.464 1.00 0.00 C ATOM 1527 CG ASP A 103 18.376 -10.397 -3.873 1.00 0.00 C ATOM 1528 OD1 ASP A 103 18.170 -11.547 -4.261 1.00 0.00 O ATOM 1529 OD2 ASP A 103 18.128 -9.410 -4.565 1.00 0.00 O ATOM 0 H ASP A 103 17.205 -11.876 -2.149 1.00 0.00 H new ATOM 0 HA ASP A 103 18.406 -9.942 -0.423 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.581 -9.281 -2.464 1.00 0.00 H new ATOM 0 HB3 ASP A 103 19.633 -11.016 -2.223 1.00 0.00 H new ATOM 1534 N VAL A 104 15.769 -9.122 -2.144 1.00 0.00 N ATOM 1535 CA VAL A 104 14.797 -8.078 -2.418 1.00 0.00 C ATOM 1536 C VAL A 104 14.397 -7.342 -1.138 1.00 0.00 C ATOM 1537 O VAL A 104 14.755 -6.183 -0.976 1.00 0.00 O ATOM 1538 CB VAL A 104 13.574 -8.606 -3.237 1.00 0.00 C ATOM 1539 CG1 VAL A 104 12.961 -9.896 -2.601 1.00 0.00 C ATOM 1540 CG2 VAL A 104 12.771 -7.686 -4.183 1.00 0.00 C ATOM 0 H VAL A 104 15.464 -10.061 -2.402 1.00 0.00 H new ATOM 0 HA VAL A 104 15.277 -7.340 -3.061 1.00 0.00 H new ATOM 0 HB VAL A 104 13.967 -8.933 -4.200 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.114 -10.230 -3.200 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.716 -10.681 -2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.624 -9.677 -1.588 1.00 0.00 H new ATOM 0 HG21 VAL A 104 11.967 -8.256 -4.649 1.00 0.00 H new ATOM 0 HG22 VAL A 104 12.346 -6.860 -3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 104 13.432 -7.292 -4.955 1.00 0.00 H new ATOM 1550 N GLU A 105 13.667 -8.042 -0.232 1.00 0.00 N ATOM 1551 CA GLU A 105 13.266 -7.364 0.993 1.00 0.00 C ATOM 1552 C GLU A 105 14.345 -7.576 2.054 1.00 0.00 C ATOM 1553 O GLU A 105 14.029 -7.567 3.232 1.00 0.00 O ATOM 1554 CB GLU A 105 11.857 -7.710 1.509 1.00 0.00 C ATOM 1555 CG GLU A 105 10.760 -7.530 0.447 1.00 0.00 C ATOM 1556 CD GLU A 105 9.401 -8.077 0.916 1.00 0.00 C ATOM 1557 OE1 GLU A 105 8.956 -7.710 2.003 1.00 0.00 O ATOM 1558 OE2 GLU A 105 8.800 -8.861 0.184 1.00 0.00 O ATOM 0 H GLU A 105 13.367 -9.012 -0.328 1.00 0.00 H new ATOM 0 HA GLU A 105 13.181 -6.304 0.752 1.00 0.00 H new ATOM 0 HB2 GLU A 105 11.849 -8.742 1.859 1.00 0.00 H new ATOM 0 HB3 GLU A 105 11.628 -7.081 2.369 1.00 0.00 H new ATOM 0 HG2 GLU A 105 10.660 -6.472 0.206 1.00 0.00 H new ATOM 0 HG3 GLU A 105 11.058 -8.039 -0.470 1.00 0.00 H new ATOM 1565 N GLN A 106 15.612 -7.779 1.616 1.00 0.00 N ATOM 1566 CA GLN A 106 16.713 -7.879 2.569 1.00 0.00 C ATOM 1567 C GLN A 106 17.030 -6.408 2.906 1.00 0.00 C ATOM 1568 O GLN A 106 17.264 -6.030 4.049 1.00 0.00 O ATOM 1569 CB GLN A 106 17.929 -8.580 1.944 1.00 0.00 C ATOM 1570 CG GLN A 106 19.133 -8.682 2.892 1.00 0.00 C ATOM 1571 CD GLN A 106 20.299 -9.404 2.205 1.00 0.00 C ATOM 1572 OE1 GLN A 106 21.286 -8.799 1.805 1.00 0.00 O ATOM 1573 NE2 GLN A 106 20.117 -10.733 2.099 1.00 0.00 N ATOM 0 H GLN A 106 15.879 -7.873 0.636 1.00 0.00 H new ATOM 0 HA GLN A 106 16.459 -8.471 3.448 1.00 0.00 H new ATOM 0 HB2 GLN A 106 17.638 -9.582 1.630 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.228 -8.039 1.046 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.446 -7.684 3.200 1.00 0.00 H new ATOM 0 HG3 GLN A 106 18.847 -9.220 3.796 1.00 0.00 H new ATOM 0 HE21 GLN A 106 19.264 -11.161 2.459 1.00 0.00 H new ATOM 0 HE22 GLN A 106 20.832 -11.312 1.659 1.00 0.00 H new ATOM 1582 N ARG A 107 16.993 -5.610 1.811 1.00 0.00 N ATOM 1583 CA ARG A 107 17.223 -4.180 1.885 1.00 0.00 C ATOM 1584 C ARG A 107 15.900 -3.549 2.355 1.00 0.00 C ATOM 1585 O ARG A 107 15.921 -2.546 3.058 1.00 0.00 O ATOM 1586 CB ARG A 107 17.721 -3.618 0.538 1.00 0.00 C ATOM 1587 CG ARG A 107 16.888 -4.063 -0.676 1.00 0.00 C ATOM 1588 CD ARG A 107 17.312 -3.400 -1.989 1.00 0.00 C ATOM 1589 NE ARG A 107 17.077 -1.962 -1.926 1.00 0.00 N ATOM 1590 CZ ARG A 107 17.180 -1.164 -3.013 1.00 0.00 C ATOM 1591 NH1 ARG A 107 17.522 -1.656 -4.201 1.00 0.00 N ATOM 1592 NH2 ARG A 107 16.933 0.136 -2.890 1.00 0.00 N ATOM 0 H ARG A 107 16.803 -5.953 0.869 1.00 0.00 H new ATOM 0 HA ARG A 107 18.017 -3.938 2.592 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.718 -2.529 0.588 1.00 0.00 H new ATOM 0 HB3 ARG A 107 18.755 -3.927 0.388 1.00 0.00 H new ATOM 0 HG2 ARG A 107 16.967 -5.145 -0.783 1.00 0.00 H new ATOM 0 HG3 ARG A 107 15.838 -3.838 -0.488 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.367 -3.595 -2.179 1.00 0.00 H new ATOM 0 HD3 ARG A 107 16.753 -3.831 -2.820 1.00 0.00 H new ATOM 0 HE ARG A 107 16.826 -1.543 -1.030 1.00 0.00 H new ATOM 0 HH11 ARG A 107 17.712 -2.653 -4.305 1.00 0.00 H new ATOM 0 HH12 ARG A 107 17.594 -1.036 -5.008 1.00 0.00 H new ATOM 0 HH21 ARG A 107 16.669 0.521 -1.983 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.007 0.748 -3.702 1.00 0.00 H new ATOM 1606 N PHE A 108 14.757 -4.182 1.963 1.00 0.00 N ATOM 1607 CA PHE A 108 13.465 -3.647 2.391 1.00 0.00 C ATOM 1608 C PHE A 108 13.079 -4.335 3.718 1.00 0.00 C ATOM 1609 O PHE A 108 11.918 -4.291 4.100 1.00 0.00 O ATOM 1610 CB PHE A 108 12.335 -3.784 1.343 1.00 0.00 C ATOM 1611 CG PHE A 108 12.759 -3.454 -0.067 1.00 0.00 C ATOM 1612 CD1 PHE A 108 13.435 -2.272 -0.357 1.00 0.00 C ATOM 1613 CD2 PHE A 108 12.470 -4.331 -1.110 1.00 0.00 C ATOM 1614 CE1 PHE A 108 13.816 -1.980 -1.660 1.00 0.00 C ATOM 1615 CE2 PHE A 108 12.855 -4.046 -2.410 1.00 0.00 C ATOM 1616 CZ PHE A 108 13.532 -2.871 -2.685 1.00 0.00 C ATOM 0 H PHE A 108 14.717 -5.019 1.382 1.00 0.00 H new ATOM 0 HA PHE A 108 13.581 -2.571 2.523 1.00 0.00 H new ATOM 0 HB2 PHE A 108 11.954 -4.805 1.367 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.511 -3.129 1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 108 13.665 -1.577 0.437 1.00 0.00 H new ATOM 0 HD2 PHE A 108 11.938 -5.247 -0.902 1.00 0.00 H new ATOM 0 HE1 PHE A 108 14.334 -1.058 -1.876 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.627 -4.739 -3.206 1.00 0.00 H new ATOM 0 HZ PHE A 108 13.839 -2.648 -3.696 1.00 0.00 H new ATOM 1626 N LYS A 109 14.064 -5.003 4.379 1.00 0.00 N ATOM 1627 CA LYS A 109 13.832 -5.630 5.682 1.00 0.00 C ATOM 1628 C LYS A 109 14.183 -4.533 6.692 1.00 0.00 C ATOM 1629 O LYS A 109 13.515 -4.345 7.701 1.00 0.00 O ATOM 1630 CB LYS A 109 14.695 -6.891 5.937 1.00 0.00 C ATOM 1631 CG LYS A 109 13.861 -8.157 6.195 1.00 0.00 C ATOM 1632 CD LYS A 109 13.137 -8.134 7.548 1.00 0.00 C ATOM 1633 CE LYS A 109 12.374 -9.436 7.816 1.00 0.00 C ATOM 1634 NZ LYS A 109 11.676 -9.428 9.095 1.00 0.00 N ATOM 0 H LYS A 109 15.014 -5.113 4.023 1.00 0.00 H new ATOM 0 HA LYS A 109 12.805 -5.989 5.754 1.00 0.00 H new ATOM 0 HB2 LYS A 109 15.342 -7.060 5.076 1.00 0.00 H new ATOM 0 HB3 LYS A 109 15.344 -6.711 6.794 1.00 0.00 H new ATOM 0 HG2 LYS A 109 13.126 -8.270 5.398 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.513 -9.029 6.153 1.00 0.00 H new ATOM 0 HD2 LYS A 109 13.863 -7.969 8.344 1.00 0.00 H new ATOM 0 HD3 LYS A 109 12.441 -7.295 7.572 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.653 -9.601 7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 109 13.073 -10.272 7.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 11.794 -10.350 9.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 12.071 -8.681 9.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.664 -9.247 8.937 1.00 0.00 H new ATOM 1647 N ALA A 110 15.286 -3.826 6.327 1.00 0.00 N ATOM 1648 CA ALA A 110 15.829 -2.722 7.103 1.00 0.00 C ATOM 1649 C ALA A 110 14.743 -1.641 7.181 1.00 0.00 C ATOM 1650 O ALA A 110 14.588 -0.973 8.196 1.00 0.00 O ATOM 1651 CB ALA A 110 17.114 -2.196 6.447 1.00 0.00 C ATOM 0 H ALA A 110 15.814 -4.022 5.476 1.00 0.00 H new ATOM 0 HA ALA A 110 16.099 -3.041 8.110 1.00 0.00 H new ATOM 0 HB1 ALA A 110 17.512 -1.370 7.036 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.852 -2.996 6.400 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.891 -1.848 5.438 1.00 0.00 H new ATOM 1657 N MET A 111 14.000 -1.523 6.055 1.00 0.00 N ATOM 1658 CA MET A 111 12.901 -0.579 5.977 1.00 0.00 C ATOM 1659 C MET A 111 11.772 -1.272 6.755 1.00 0.00 C ATOM 1660 O MET A 111 11.302 -0.788 7.778 1.00 0.00 O ATOM 1661 CB MET A 111 12.567 -0.290 4.502 1.00 0.00 C ATOM 1662 CG MET A 111 13.751 0.348 3.767 1.00 0.00 C ATOM 1663 SD MET A 111 13.280 0.972 2.144 1.00 0.00 S ATOM 1664 CE MET A 111 13.021 2.705 2.567 1.00 0.00 C ATOM 0 H MET A 111 14.152 -2.070 5.207 1.00 0.00 H new ATOM 0 HA MET A 111 13.110 0.402 6.404 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.287 -1.218 4.004 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.704 0.374 4.448 1.00 0.00 H new ATOM 0 HG2 MET A 111 14.153 1.165 4.367 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.548 -0.388 3.656 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.145 3.081 2.039 1.00 0.00 H new ATOM 0 HE2 MET A 111 12.865 2.798 3.642 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.897 3.285 2.276 1.00 0.00 H new ATOM 1674 N GLY A 112 11.411 -2.448 6.192 1.00 0.00 N ATOM 1675 CA GLY A 112 10.408 -3.385 6.687 1.00 0.00 C ATOM 1676 C GLY A 112 9.114 -2.811 7.283 1.00 0.00 C ATOM 1677 O GLY A 112 8.483 -3.446 8.120 1.00 0.00 O ATOM 0 H GLY A 112 11.845 -2.776 5.329 1.00 0.00 H new ATOM 0 HA2 GLY A 112 10.132 -4.044 5.864 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.879 -4.006 7.449 1.00 0.00 H new ATOM 1681 N PHE A 113 8.746 -1.599 6.812 1.00 0.00 N ATOM 1682 CA PHE A 113 7.499 -0.986 7.259 1.00 0.00 C ATOM 1683 C PHE A 113 6.384 -1.535 6.337 1.00 0.00 C ATOM 1684 O PHE A 113 5.211 -1.219 6.497 1.00 0.00 O ATOM 1685 CB PHE A 113 7.581 0.557 7.252 1.00 0.00 C ATOM 1686 CG PHE A 113 8.291 1.147 6.057 1.00 0.00 C ATOM 1687 CD1 PHE A 113 7.819 0.958 4.759 1.00 0.00 C ATOM 1688 CD2 PHE A 113 9.441 1.910 6.245 1.00 0.00 C ATOM 1689 CE1 PHE A 113 8.487 1.511 3.675 1.00 0.00 C ATOM 1690 CE2 PHE A 113 10.104 2.474 5.164 1.00 0.00 C ATOM 1691 CZ PHE A 113 9.628 2.272 3.877 1.00 0.00 C ATOM 0 H PHE A 113 9.284 -1.048 6.143 1.00 0.00 H new ATOM 0 HA PHE A 113 7.285 -1.242 8.297 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.569 0.961 7.292 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.091 0.884 8.158 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.925 0.375 4.595 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.821 2.065 7.244 1.00 0.00 H new ATOM 0 HE1 PHE A 113 8.117 1.348 2.673 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.990 3.070 5.325 1.00 0.00 H new ATOM 0 HZ PHE A 113 10.145 2.707 3.034 1.00 0.00 H new ATOM 1701 N ASP A 114 6.835 -2.356 5.361 1.00 0.00 N ATOM 1702 CA ASP A 114 6.018 -3.002 4.369 1.00 0.00 C ATOM 1703 C ASP A 114 5.925 -4.479 4.786 1.00 0.00 C ATOM 1704 O ASP A 114 6.930 -5.124 5.057 1.00 0.00 O ATOM 1705 CB ASP A 114 6.688 -2.837 2.985 1.00 0.00 C ATOM 1706 CG ASP A 114 8.146 -3.367 2.966 1.00 0.00 C ATOM 1707 OD1 ASP A 114 9.052 -2.634 3.365 1.00 0.00 O ATOM 1708 OD2 ASP A 114 8.357 -4.506 2.548 1.00 0.00 O ATOM 0 H ASP A 114 7.825 -2.581 5.259 1.00 0.00 H new ATOM 0 HA ASP A 114 5.019 -2.572 4.299 1.00 0.00 H new ATOM 0 HB2 ASP A 114 6.102 -3.368 2.235 1.00 0.00 H new ATOM 0 HB3 ASP A 114 6.684 -1.783 2.706 1.00 0.00 H new ATOM 1713 N ARG A 115 4.664 -4.963 4.841 1.00 0.00 N ATOM 1714 CA ARG A 115 4.381 -6.353 5.163 1.00 0.00 C ATOM 1715 C ARG A 115 3.874 -6.917 3.832 1.00 0.00 C ATOM 1716 O ARG A 115 3.686 -6.179 2.873 1.00 0.00 O ATOM 1717 CB ARG A 115 3.399 -6.490 6.344 1.00 0.00 C ATOM 1718 CG ARG A 115 2.512 -5.263 6.617 1.00 0.00 C ATOM 1719 CD ARG A 115 3.228 -4.179 7.431 1.00 0.00 C ATOM 1720 NE ARG A 115 2.249 -3.388 8.160 1.00 0.00 N ATOM 1721 CZ ARG A 115 2.625 -2.361 8.947 1.00 0.00 C ATOM 1722 NH1 ARG A 115 3.888 -1.943 8.989 1.00 0.00 N ATOM 1723 NH2 ARG A 115 1.715 -1.761 9.700 1.00 0.00 N ATOM 0 H ARG A 115 3.833 -4.398 4.664 1.00 0.00 H new ATOM 0 HA ARG A 115 5.245 -6.910 5.525 1.00 0.00 H new ATOM 0 HB2 ARG A 115 2.753 -7.349 6.159 1.00 0.00 H new ATOM 0 HB3 ARG A 115 3.971 -6.710 7.245 1.00 0.00 H new ATOM 0 HG2 ARG A 115 2.183 -4.840 5.668 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.617 -5.580 7.152 1.00 0.00 H new ATOM 0 HD2 ARG A 115 3.931 -4.637 8.127 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.809 -3.537 6.769 1.00 0.00 H new ATOM 0 HE ARG A 115 1.258 -3.615 8.074 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.597 -2.403 8.417 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.147 -1.163 9.593 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.746 -2.078 9.679 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.984 -0.982 10.301 1.00 0.00 H new ATOM 1737 N VAL A 116 3.675 -8.256 3.813 1.00 0.00 N ATOM 1738 CA VAL A 116 3.197 -8.902 2.590 1.00 0.00 C ATOM 1739 C VAL A 116 2.175 -9.976 2.984 1.00 0.00 C ATOM 1740 O VAL A 116 2.229 -10.545 4.068 1.00 0.00 O ATOM 1741 CB VAL A 116 4.374 -9.479 1.727 1.00 0.00 C ATOM 1742 CG1 VAL A 116 3.930 -10.459 0.562 1.00 0.00 C ATOM 1743 CG2 VAL A 116 5.639 -8.543 1.845 1.00 0.00 C ATOM 0 H VAL A 116 3.834 -8.881 4.603 1.00 0.00 H new ATOM 0 HA VAL A 116 2.713 -8.164 1.950 1.00 0.00 H new ATOM 0 HB VAL A 116 4.958 -10.355 2.008 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.811 -10.805 0.022 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.405 -11.315 0.987 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.268 -9.931 -0.125 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.451 -8.951 1.243 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.388 -7.545 1.487 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.953 -8.486 2.887 1.00 0.00 H new ATOM 1753 N TYR A 117 1.247 -10.208 2.022 1.00 0.00 N ATOM 1754 CA TYR A 117 0.190 -11.205 2.220 1.00 0.00 C ATOM 1755 C TYR A 117 0.721 -12.429 1.449 1.00 0.00 C ATOM 1756 O TYR A 117 1.402 -12.274 0.443 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.181 -10.873 1.563 1.00 0.00 C ATOM 1758 CG TYR A 117 -1.917 -9.593 1.914 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.282 -8.375 2.122 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -3.308 -9.600 1.926 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -2.003 -7.202 2.260 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -4.046 -8.436 2.080 1.00 0.00 C ATOM 1763 CZ TYR A 117 -3.397 -7.211 2.239 1.00 0.00 C ATOM 1764 OH TYR A 117 -4.122 -6.025 2.311 1.00 0.00 O ATOM 0 H TYR A 117 1.216 -9.725 1.124 1.00 0.00 H new ATOM 0 HA TYR A 117 0.004 -11.305 3.289 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -1.027 -10.869 0.484 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -1.853 -11.701 1.787 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.204 -8.343 2.177 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.828 -10.539 1.812 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -1.478 -6.266 2.386 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.125 -8.478 2.077 1.00 0.00 H new ATOM 0 HH TYR A 117 -3.547 -5.274 2.055 1.00 0.00 H new ATOM 1774 N PRO A 118 0.390 -13.663 1.926 1.00 0.00 N ATOM 1775 CA PRO A 118 0.841 -14.874 1.251 1.00 0.00 C ATOM 1776 C PRO A 118 0.047 -14.944 -0.077 1.00 0.00 C ATOM 1777 O PRO A 118 -1.027 -14.368 -0.201 1.00 0.00 O ATOM 1778 CB PRO A 118 0.507 -16.021 2.222 1.00 0.00 C ATOM 1779 CG PRO A 118 -0.488 -15.450 3.240 1.00 0.00 C ATOM 1780 CD PRO A 118 -0.373 -13.923 3.147 1.00 0.00 C ATOM 0 HA PRO A 118 1.903 -14.915 1.009 1.00 0.00 H new ATOM 0 HB2 PRO A 118 0.074 -16.868 1.689 1.00 0.00 H new ATOM 0 HB3 PRO A 118 1.407 -16.383 2.719 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -1.503 -15.777 3.017 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -0.256 -15.797 4.247 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.357 -13.457 3.101 1.00 0.00 H new ATOM 0 HD3 PRO A 118 0.133 -13.513 4.021 1.00 0.00 H new ATOM 1788 N PRO A 119 0.624 -15.659 -1.087 1.00 0.00 N ATOM 1789 CA PRO A 119 -0.016 -15.810 -2.391 1.00 0.00 C ATOM 1790 C PRO A 119 -1.133 -16.842 -2.171 1.00 0.00 C ATOM 1791 O PRO A 119 -0.885 -17.986 -1.809 1.00 0.00 O ATOM 1792 CB PRO A 119 1.104 -16.342 -3.299 1.00 0.00 C ATOM 1793 CG PRO A 119 2.075 -17.047 -2.344 1.00 0.00 C ATOM 1794 CD PRO A 119 1.938 -16.301 -1.014 1.00 0.00 C ATOM 0 HA PRO A 119 -0.449 -14.911 -2.829 1.00 0.00 H new ATOM 0 HB2 PRO A 119 0.714 -17.032 -4.047 1.00 0.00 H new ATOM 0 HB3 PRO A 119 1.596 -15.532 -3.838 1.00 0.00 H new ATOM 0 HG2 PRO A 119 1.822 -18.101 -2.232 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.098 -17.002 -2.718 1.00 0.00 H new ATOM 0 HD2 PRO A 119 1.999 -16.985 -0.167 1.00 0.00 H new ATOM 0 HD3 PRO A 119 2.733 -15.566 -0.888 1.00 0.00 H new ATOM 1802 N GLY A 120 -2.372 -16.356 -2.408 1.00 0.00 N ATOM 1803 CA GLY A 120 -3.549 -17.199 -2.227 1.00 0.00 C ATOM 1804 C GLY A 120 -3.819 -17.371 -0.731 1.00 0.00 C ATOM 1805 O GLY A 120 -3.878 -18.472 -0.196 1.00 0.00 O ATOM 0 H GLY A 120 -2.569 -15.404 -2.718 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -4.413 -16.748 -2.715 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.390 -18.171 -2.694 1.00 0.00 H new ATOM 1809 N THR A 121 -3.969 -16.182 -0.115 1.00 0.00 N ATOM 1810 CA THR A 121 -4.199 -16.064 1.311 1.00 0.00 C ATOM 1811 C THR A 121 -5.700 -16.132 1.539 1.00 0.00 C ATOM 1812 O THR A 121 -6.544 -16.227 0.656 1.00 0.00 O ATOM 1813 CB THR A 121 -3.639 -14.703 1.834 1.00 0.00 C ATOM 1814 OG1 THR A 121 -3.580 -14.516 3.285 1.00 0.00 O ATOM 1815 CG2 THR A 121 -4.190 -13.504 1.000 1.00 0.00 C ATOM 0 H THR A 121 -3.932 -15.287 -0.604 1.00 0.00 H new ATOM 0 HA THR A 121 -3.693 -16.866 1.848 1.00 0.00 H new ATOM 0 HB THR A 121 -2.567 -14.742 1.639 1.00 0.00 H new ATOM 0 HG1 THR A 121 -3.838 -13.597 3.507 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.781 -12.572 1.389 1.00 0.00 H new ATOM 0 HG22 THR A 121 -3.897 -13.621 -0.043 1.00 0.00 H new ATOM 0 HG23 THR A 121 -5.277 -13.481 1.071 1.00 0.00 H new ATOM 1823 N SER A 122 -5.895 -16.042 2.857 1.00 0.00 N ATOM 1824 CA SER A 122 -7.122 -16.019 3.593 1.00 0.00 C ATOM 1825 C SER A 122 -7.678 -14.607 3.382 1.00 0.00 C ATOM 1826 O SER A 122 -7.011 -13.739 2.837 1.00 0.00 O ATOM 1827 CB SER A 122 -6.654 -16.124 5.076 1.00 0.00 C ATOM 1828 OG SER A 122 -5.592 -15.176 5.522 1.00 0.00 O ATOM 0 H SER A 122 -5.095 -15.977 3.487 1.00 0.00 H new ATOM 0 HA SER A 122 -7.848 -16.785 3.319 1.00 0.00 H new ATOM 0 HB2 SER A 122 -7.525 -15.982 5.716 1.00 0.00 H new ATOM 0 HB3 SER A 122 -6.295 -17.139 5.246 1.00 0.00 H new ATOM 0 HG SER A 122 -5.515 -14.443 4.876 1.00 0.00 H new ATOM 1834 N PRO A 123 -8.941 -14.391 3.822 1.00 0.00 N ATOM 1835 CA PRO A 123 -9.533 -13.067 3.763 1.00 0.00 C ATOM 1836 C PRO A 123 -9.233 -12.407 5.133 1.00 0.00 C ATOM 1837 O PRO A 123 -9.556 -11.247 5.355 1.00 0.00 O ATOM 1838 CB PRO A 123 -11.032 -13.354 3.623 1.00 0.00 C ATOM 1839 CG PRO A 123 -11.224 -14.685 4.364 1.00 0.00 C ATOM 1840 CD PRO A 123 -9.890 -15.429 4.221 1.00 0.00 C ATOM 0 HA PRO A 123 -9.171 -12.420 2.963 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -11.634 -12.560 4.065 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -11.328 -13.433 2.577 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -11.470 -14.519 5.413 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -12.043 -15.260 3.932 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -9.594 -15.900 5.158 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -9.953 -16.220 3.473 1.00 0.00 H new ATOM 1848 N GLU A 124 -8.591 -13.215 6.018 1.00 0.00 N ATOM 1849 CA GLU A 124 -8.215 -12.864 7.367 1.00 0.00 C ATOM 1850 C GLU A 124 -7.006 -11.928 7.321 1.00 0.00 C ATOM 1851 O GLU A 124 -6.652 -11.323 8.326 1.00 0.00 O ATOM 1852 CB GLU A 124 -7.883 -14.164 8.119 1.00 0.00 C ATOM 1853 CG GLU A 124 -7.628 -13.956 9.620 1.00 0.00 C ATOM 1854 CD GLU A 124 -7.446 -15.306 10.333 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -6.323 -15.809 10.368 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -8.429 -15.841 10.847 1.00 0.00 O ATOM 0 H GLU A 124 -8.320 -14.168 5.775 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.024 -12.347 7.883 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -8.706 -14.868 7.992 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -7.001 -14.620 7.669 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -6.739 -13.342 9.761 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.463 -13.414 10.064 1.00 0.00 H new ATOM 1863 N THR A 125 -6.389 -11.824 6.122 1.00 0.00 N ATOM 1864 CA THR A 125 -5.229 -11.000 5.964 1.00 0.00 C ATOM 1865 C THR A 125 -5.696 -9.539 5.933 1.00 0.00 C ATOM 1866 O THR A 125 -4.941 -8.647 6.299 1.00 0.00 O ATOM 1867 CB THR A 125 -4.541 -11.400 4.627 1.00 0.00 C ATOM 1868 OG1 THR A 125 -5.088 -12.530 3.888 1.00 0.00 O ATOM 1869 CG2 THR A 125 -3.001 -11.432 4.790 1.00 0.00 C ATOM 0 H THR A 125 -6.691 -12.305 5.275 1.00 0.00 H new ATOM 0 HA THR A 125 -4.516 -11.127 6.779 1.00 0.00 H new ATOM 0 HB THR A 125 -4.805 -10.593 3.943 1.00 0.00 H new ATOM 0 HG1 THR A 125 -5.991 -12.311 3.576 1.00 0.00 H new ATOM 0 HG21 THR A 125 -2.541 -11.714 3.843 1.00 0.00 H new ATOM 0 HG22 THR A 125 -2.646 -10.445 5.086 1.00 0.00 H new ATOM 0 HG23 THR A 125 -2.731 -12.160 5.555 1.00 0.00 H new ATOM 1877 N THR A 126 -6.958 -9.337 5.467 1.00 0.00 N ATOM 1878 CA THR A 126 -7.458 -7.989 5.364 1.00 0.00 C ATOM 1879 C THR A 126 -8.098 -7.554 6.667 1.00 0.00 C ATOM 1880 O THR A 126 -8.238 -6.362 6.929 1.00 0.00 O ATOM 1881 CB THR A 126 -8.446 -7.722 4.238 1.00 0.00 C ATOM 1882 OG1 THR A 126 -9.852 -8.076 4.454 1.00 0.00 O ATOM 1883 CG2 THR A 126 -7.856 -8.135 2.868 1.00 0.00 C ATOM 0 H THR A 126 -7.603 -10.071 5.175 1.00 0.00 H new ATOM 0 HA THR A 126 -6.567 -7.408 5.129 1.00 0.00 H new ATOM 0 HB THR A 126 -8.559 -6.638 4.235 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.916 -9.018 4.716 1.00 0.00 H new ATOM 0 HG21 THR A 126 -8.584 -7.933 2.082 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.947 -7.564 2.676 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.620 -9.199 2.879 1.00 0.00 H new ATOM 1891 N ILE A 127 -8.500 -8.552 7.474 1.00 0.00 N ATOM 1892 CA ILE A 127 -9.007 -8.183 8.784 1.00 0.00 C ATOM 1893 C ILE A 127 -7.732 -7.692 9.515 1.00 0.00 C ATOM 1894 O ILE A 127 -7.761 -6.810 10.366 1.00 0.00 O ATOM 1895 CB ILE A 127 -9.684 -9.411 9.463 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -10.593 -10.256 8.553 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -9.815 -9.159 11.000 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -11.326 -11.422 9.243 1.00 0.00 C ATOM 0 H ILE A 127 -8.484 -9.548 7.256 1.00 0.00 H new ATOM 0 HA ILE A 127 -9.784 -7.419 8.778 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.126 -10.342 9.565 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.337 -9.599 8.102 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -9.989 -10.660 7.740 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -10.289 -10.020 11.471 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -8.825 -9.010 11.430 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -10.423 -8.271 11.173 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -11.938 -11.951 8.512 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -10.596 -12.109 9.670 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -11.964 -11.032 10.036 1.00 0.00 H new ATOM 1910 N ALA A 128 -6.607 -8.305 9.052 1.00 0.00 N ATOM 1911 CA ALA A 128 -5.303 -8.003 9.554 1.00 0.00 C ATOM 1912 C ALA A 128 -4.746 -6.780 8.808 1.00 0.00 C ATOM 1913 O ALA A 128 -3.664 -6.323 9.157 1.00 0.00 O ATOM 1914 CB ALA A 128 -4.376 -9.228 9.480 1.00 0.00 C ATOM 0 H ALA A 128 -6.615 -9.016 8.321 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.366 -7.749 10.612 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.393 -8.964 9.869 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.796 -10.039 10.075 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.281 -9.550 8.443 1.00 0.00 H new ATOM 1920 N ASP A 129 -5.494 -6.242 7.798 1.00 0.00 N ATOM 1921 CA ASP A 129 -4.998 -5.073 7.080 1.00 0.00 C ATOM 1922 C ASP A 129 -4.909 -3.924 8.097 1.00 0.00 C ATOM 1923 O ASP A 129 -3.873 -3.318 8.325 1.00 0.00 O ATOM 1924 CB ASP A 129 -5.923 -4.644 5.910 1.00 0.00 C ATOM 1925 CG ASP A 129 -5.201 -3.974 4.721 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -4.132 -3.395 4.911 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -5.733 -4.026 3.612 1.00 0.00 O ATOM 0 H ASP A 129 -6.400 -6.594 7.488 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.031 -5.318 6.640 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.454 -5.523 5.545 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.675 -3.955 6.295 1.00 0.00 H new ATOM 1932 N MET A 130 -6.098 -3.712 8.684 1.00 0.00 N ATOM 1933 CA MET A 130 -6.351 -2.660 9.655 1.00 0.00 C ATOM 1934 C MET A 130 -6.016 -3.152 11.076 1.00 0.00 C ATOM 1935 O MET A 130 -6.183 -2.385 12.015 1.00 0.00 O ATOM 1936 CB MET A 130 -7.832 -2.215 9.563 1.00 0.00 C ATOM 1937 CG MET A 130 -8.093 -1.132 8.510 1.00 0.00 C ATOM 1938 SD MET A 130 -7.979 -1.750 6.837 1.00 0.00 S ATOM 1939 CE MET A 130 -6.377 -1.090 6.383 1.00 0.00 C ATOM 0 H MET A 130 -6.920 -4.283 8.486 1.00 0.00 H new ATOM 0 HA MET A 130 -5.712 -1.805 9.434 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.449 -3.085 9.336 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.151 -1.844 10.537 1.00 0.00 H new ATOM 0 HG2 MET A 130 -9.085 -0.709 8.669 1.00 0.00 H new ATOM 0 HG3 MET A 130 -7.376 -0.322 8.643 1.00 0.00 H new ATOM 0 HE1 MET A 130 -6.069 -1.509 5.425 1.00 0.00 H new ATOM 0 HE2 MET A 130 -6.440 -0.005 6.301 1.00 0.00 H new ATOM 0 HE3 MET A 130 -5.645 -1.354 7.146 1.00 0.00 H new ATOM 1949 N LYS A 131 -5.539 -4.405 11.250 1.00 0.00 N ATOM 1950 CA LYS A 131 -5.261 -4.832 12.619 1.00 0.00 C ATOM 1951 C LYS A 131 -3.860 -4.365 13.043 1.00 0.00 C ATOM 1952 O LYS A 131 -3.694 -3.820 14.127 1.00 0.00 O ATOM 1953 CB LYS A 131 -5.352 -6.360 12.747 1.00 0.00 C ATOM 1954 CG LYS A 131 -5.263 -6.877 14.190 1.00 0.00 C ATOM 1955 CD LYS A 131 -5.514 -8.388 14.288 1.00 0.00 C ATOM 1956 CE LYS A 131 -4.453 -9.228 13.566 1.00 0.00 C ATOM 1957 NZ LYS A 131 -4.677 -10.659 13.731 1.00 0.00 N ATOM 0 H LYS A 131 -5.353 -5.086 10.514 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.009 -4.382 13.272 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.293 -6.695 12.310 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -4.551 -6.811 12.161 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -4.277 -6.649 14.594 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.991 -6.350 14.807 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -5.543 -8.677 15.339 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -6.494 -8.614 13.868 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -4.458 -8.981 12.504 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -3.466 -8.970 13.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -3.936 -11.187 13.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -4.647 -10.901 14.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -5.608 -10.912 13.342 1.00 0.00 H new ATOM 1970 N GLU A 132 -2.868 -4.608 12.155 1.00 0.00 N ATOM 1971 CA GLU A 132 -1.486 -4.298 12.499 1.00 0.00 C ATOM 1972 C GLU A 132 -1.157 -2.833 12.224 1.00 0.00 C ATOM 1973 O GLU A 132 -0.466 -2.187 13.004 1.00 0.00 O ATOM 1974 CB GLU A 132 -0.535 -5.292 11.801 1.00 0.00 C ATOM 1975 CG GLU A 132 -0.405 -5.101 10.280 1.00 0.00 C ATOM 1976 CD GLU A 132 0.505 -6.188 9.686 1.00 0.00 C ATOM 1977 OE1 GLU A 132 1.722 -6.083 9.834 1.00 0.00 O ATOM 1978 OE2 GLU A 132 -0.012 -7.129 9.084 1.00 0.00 O ATOM 0 H GLU A 132 -3.004 -5.006 11.226 1.00 0.00 H new ATOM 0 HA GLU A 132 -1.342 -4.425 13.572 1.00 0.00 H new ATOM 0 HB2 GLU A 132 0.454 -5.203 12.250 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -0.884 -6.306 11.997 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -1.390 -5.146 9.815 1.00 0.00 H new ATOM 0 HG3 GLU A 132 0.005 -4.115 10.063 1.00 0.00 H new ATOM 1985 N VAL A 133 -1.679 -2.351 11.087 1.00 0.00 N ATOM 1986 CA VAL A 133 -1.412 -0.975 10.663 1.00 0.00 C ATOM 1987 C VAL A 133 -2.080 0.074 11.571 1.00 0.00 C ATOM 1988 O VAL A 133 -1.545 1.161 11.747 1.00 0.00 O ATOM 1989 CB VAL A 133 -1.700 -0.820 9.126 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.721 0.686 8.709 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -1.354 -1.902 8.071 1.00 0.00 C ATOM 0 H VAL A 133 -2.278 -2.885 10.457 1.00 0.00 H new ATOM 0 HA VAL A 133 -0.351 -0.763 10.794 1.00 0.00 H new ATOM 0 HB VAL A 133 -2.701 -1.245 9.048 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -1.922 0.765 7.641 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -2.501 1.207 9.265 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.754 1.138 8.930 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -1.653 -1.555 7.082 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.280 -2.090 8.081 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -1.885 -2.824 8.307 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.247 -0.296 12.146 1.00 0.00 N ATOM 2002 CA LEU A 134 -3.933 0.647 13.022 1.00 0.00 C ATOM 2003 C LEU A 134 -3.413 0.406 14.447 1.00 0.00 C ATOM 2004 O LEU A 134 -3.311 1.329 15.246 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.462 0.485 12.979 1.00 0.00 C ATOM 2006 CG LEU A 134 -6.080 0.620 11.551 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -7.631 0.614 11.685 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -5.355 1.084 10.253 1.00 0.00 C ATOM 0 H LEU A 134 -3.706 -1.198 12.021 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.726 1.663 12.687 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -5.724 -0.492 13.385 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.914 1.233 13.630 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.587 -0.138 10.942 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -8.082 0.708 10.697 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -7.953 -0.321 12.144 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.946 1.451 12.308 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.058 1.072 9.420 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.973 2.096 10.391 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.526 0.410 10.038 1.00 0.00 H new ATOM 2020 N GLY A 135 -3.097 -0.884 14.713 1.00 0.00 N ATOM 2021 CA GLY A 135 -2.615 -1.307 16.020 1.00 0.00 C ATOM 2022 C GLY A 135 -1.271 -0.676 16.396 1.00 0.00 C ATOM 2023 O GLY A 135 -1.209 0.408 16.964 1.00 0.00 O ATOM 0 H GLY A 135 -3.172 -1.638 14.030 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -3.356 -1.047 16.776 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -2.516 -2.392 16.031 1.00 0.00 H new ATOM 2027 N VAL A 136 -0.210 -1.438 16.058 1.00 0.00 N ATOM 2028 CA VAL A 136 1.138 -0.985 16.365 1.00 0.00 C ATOM 2029 C VAL A 136 2.132 -1.901 15.641 1.00 0.00 C ATOM 2030 O VAL A 136 1.817 -3.017 15.244 1.00 0.00 O ATOM 2031 CB VAL A 136 1.373 -1.001 17.916 1.00 0.00 C ATOM 2032 CG1 VAL A 136 2.412 0.087 18.317 1.00 0.00 C ATOM 2033 CG2 VAL A 136 0.442 -1.674 18.964 1.00 0.00 C ATOM 0 H VAL A 136 -0.268 -2.341 15.587 1.00 0.00 H new ATOM 0 HA VAL A 136 1.281 0.040 16.024 1.00 0.00 H new ATOM 0 HB VAL A 136 1.674 -2.027 18.128 1.00 0.00 H new ATOM 0 HG11 VAL A 136 2.565 0.064 19.396 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.358 -0.110 17.812 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.042 1.069 18.024 1.00 0.00 H new ATOM 0 HG21 VAL A 136 0.852 -1.527 19.963 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.550 -1.226 18.910 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.370 -2.741 18.755 1.00 0.00 H new ATOM 2043 N GLU A 137 3.348 -1.332 15.509 1.00 0.00 N ATOM 2044 CA GLU A 137 4.468 -1.997 14.866 1.00 0.00 C ATOM 2045 C GLU A 137 5.639 -1.837 15.848 1.00 0.00 C ATOM 2046 O GLU A 137 6.023 -0.703 16.137 1.00 0.00 O ATOM 2047 CB GLU A 137 4.767 -1.351 13.498 1.00 0.00 C ATOM 2048 CG GLU A 137 3.628 -1.510 12.479 1.00 0.00 C ATOM 2049 CD GLU A 137 3.358 -2.992 12.153 1.00 0.00 C ATOM 2050 OE1 GLU A 137 4.269 -3.671 11.681 1.00 0.00 O ATOM 2051 OE2 GLU A 137 2.238 -3.450 12.373 1.00 0.00 O ATOM 2052 OXT GLU A 137 6.157 -2.850 16.317 1.00 0.00 O ATOM 0 H GLU A 137 3.567 -0.396 15.851 1.00 0.00 H new ATOM 0 HA GLU A 137 4.270 -3.048 14.657 1.00 0.00 H new ATOM 0 HB2 GLU A 137 4.967 -0.289 13.643 1.00 0.00 H new ATOM 0 HB3 GLU A 137 5.675 -1.794 13.087 1.00 0.00 H new ATOM 0 HG2 GLU A 137 2.720 -1.053 12.873 1.00 0.00 H new ATOM 0 HG3 GLU A 137 3.882 -0.976 11.563 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 0.991 -17.579 -11.832 1.00 0.00 N HETATM 2061 C5 FOP A 138 1.022 -16.758 -10.622 1.00 0.00 C HETATM 2062 C6 FOP A 138 -0.305 -16.698 -9.854 1.00 0.00 C HETATM 2063 C7 FOP A 138 -1.352 -15.864 -10.607 1.00 0.00 C HETATM 2064 O7 FOP A 138 -0.787 -17.995 -9.562 1.00 0.00 O HETATM 0 H73 FOP A 138 -0.982 -14.847 -10.737 1.00 0.00 H new HETATM 0 H72 FOP A 138 -1.538 -16.310 -11.584 1.00 0.00 H new HETATM 0 H71 FOP A 138 -2.280 -15.842 -10.035 1.00 0.00 H new HETATM 0 H6 FOP A 138 -0.114 -16.198 -8.905 1.00 0.00 H new HETATM 0 H52 FOP A 138 1.794 -17.145 -9.957 1.00 0.00 H new HETATM 0 H51 FOP A 138 1.315 -15.744 -10.895 1.00 0.00 H new HETATM 0 H43 FOP A 138 1.908 -17.563 -12.278 1.00 0.00 H new HETATM 0 H42 FOP A 138 0.749 -18.539 -11.586 1.00 0.00 H new HETATM 0 H41 FOP A 138 0.294 -17.208 -12.477 1.00 0.00 H new HETATM 2074 P DBI A 139 -2.083 -18.016 -8.651 1.00 0.00 P HETATM 2075 O1P DBI A 139 -3.360 -18.123 -9.575 1.00 0.00 O HETATM 2076 O2P DBI A 139 -2.024 -19.275 -7.699 1.00 0.00 O HETATM 2077 O3' DBI A 139 -2.154 -16.701 -7.769 1.00 0.00 O HETATM 2078 O5' DBI A 139 -5.969 -16.811 -8.398 1.00 0.00 O HETATM 2079 C5' DBI A 139 -5.168 -15.698 -8.701 1.00 0.00 C HETATM 2080 C4' DBI A 139 -4.183 -15.371 -7.574 1.00 0.00 C HETATM 2081 O4' DBI A 139 -4.859 -14.877 -6.436 1.00 0.00 O HETATM 2082 C1' DBI A 139 -3.984 -14.995 -5.329 1.00 0.00 C HETATM 2083 N1 DBI A 139 -3.257 -13.741 -5.158 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.521 -12.740 -4.231 1.00 0.00 C HETATM 2085 C7 DBI A 139 -4.406 -12.628 -3.191 1.00 0.00 C HETATM 2086 C6 DBI A 139 -4.469 -11.460 -2.422 1.00 0.00 C HETATM 2087 C11 DBI A 139 -5.418 -11.372 -1.256 1.00 0.00 C HETATM 2088 C10 DBI A 139 -3.728 -9.080 -1.985 1.00 0.00 C HETATM 2089 C5 DBI A 139 -3.639 -10.378 -2.745 1.00 0.00 C HETATM 2090 C4 DBI A 139 -2.720 -10.513 -3.788 1.00 0.00 C HETATM 2091 C9 DBI A 139 -2.645 -11.662 -4.519 1.00 0.00 C HETATM 2092 N3 DBI A 139 -1.843 -12.045 -5.579 1.00 0.00 N HETATM 2093 C2 DBI A 139 -2.247 -13.283 -5.920 1.00 0.00 C HETATM 2094 C2' DBI A 139 -3.130 -16.242 -5.595 1.00 0.00 C HETATM 2095 O2' DBI A 139 -1.773 -16.078 -5.251 1.00 0.00 O HETATM 2096 C3' DBI A 139 -3.365 -16.555 -7.064 1.00 0.00 C HETATM 0 HO21 DBI A 139 -1.217 -16.186 -6.051 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -4.615 -15.890 -9.621 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.805 -14.833 -8.887 1.00 0.00 H new HETATM 0 H113 DBI A 139 -6.441 -11.509 -1.608 1.00 0.00 H new HETATM 0 H112 DBI A 139 -5.177 -12.149 -0.531 1.00 0.00 H new HETATM 0 H111 DBI A 139 -5.324 -10.394 -0.784 1.00 0.00 H new HETATM 0 H103 DBI A 139 -4.732 -8.668 -2.085 1.00 0.00 H new HETATM 0 H102 DBI A 139 -3.512 -9.260 -0.932 1.00 0.00 H new HETATM 0 H101 DBI A 139 -3.004 -8.372 -2.388 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -5.498 -17.632 -8.652 1.00 0.00 H new HETATM 0 H7 DBI A 139 -5.071 -13.460 -2.959 1.00 0.00 H new HETATM 0 H4' DBI A 139 -3.516 -14.642 -8.034 1.00 0.00 H new HETATM 0 H4 DBI A 139 -2.051 -9.685 -4.022 1.00 0.00 H new HETATM 0 H3' DBI A 139 -3.882 -17.504 -7.207 1.00 0.00 H new HETATM 0 H2' DBI A 139 -3.421 -17.079 -4.960 1.00 0.00 H new HETATM 0 H2 DBI A 139 -1.801 -13.857 -6.732 1.00 0.00 H new HETATM 0 H1' DBI A 139 -4.483 -15.143 -4.371 1.00 0.00 H new