USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1213 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 93 ASNHD21 : A 93 ASN OD1 : A 153 CACA :(metal ligand) USER MOD NoAdj : A 93 ASNHD22 : A 93 ASN OD1 : A 153 CACA :(metal ligand) USER MOD Set 1.1: A 105 MET CE :methyl 170:sc= -0.0761 (180deg=-0.0824) USER MOD Set 1.2: A 120 MET CE :methyl 152:sc= -2.58 (180deg=-3.33!) USER MOD Set 1.3: B 7 THR OG1 : rot -133:sc= 1.3 USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.311 K(o=-0.44,f=-4.4) USER MOD Set 2.2: A 107 ASN :FLIP amide:sc= -0.749 F(o=-1.7,f=-0.44) USER MOD Set 3.1: A 32 MET CE :methyl -177:sc= -0.751 (180deg=-0.826) USER MOD Set 3.2: A 47 MET CE :methyl 145:sc= -0.825 (180deg=-0.604) USER MOD Set 4.1: A 22 THR OG1 : rot -39:sc= 1.27 USER MOD Set 4.2: A 56 ASN : amide:sc= 1.31 K(o=3.5,f=0.47!) USER MOD Set 4.3: A 58 THR OG1 : rot -159:sc= 0.957 USER MOD Set 5.1: A 1 THR N :NH3+ -165:sc= 0.694 (180deg=-1.01) USER MOD Set 5.2: A 4 GLN : amide:sc= 0.805 K(o=1.5,f=-8!) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.146) USER MOD Single : A 13 SER OG : rot 78:sc= 1.18 USER MOD Single : A 17 LYS NZ :NH3+ -146:sc= 0.0698 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -71:sc= 0.3 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 75:sc= 0.92 USER MOD Single : A 34 SER OG : rot 77:sc= 1.25 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.0009) USER MOD Single : A 38 ASN : amide:sc= -0.977 K(o=-0.98,f=-2.3!) USER MOD Single : A 40 THR OG1 : rot -89:sc= 1.18 USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 49 ASN : amide:sc= -0.31 K(o=-0.31,f=-2.3!) USER MOD Single : A 66 THR OG1 : rot 72:sc= 1.16 USER MOD Single : A 67 MET CE :methyl -119:sc= -0.238 (180deg=-0.874) USER MOD Single : A 68 MET CE :methyl -168:sc= 0 (180deg=-0.154) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -164:sc= 0 (180deg=-0.436) USER MOD Single : A 73 LYS NZ :NH3+ -166:sc= 0.646 (180deg=0.504) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 76:sc= 0.446 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 75:sc= 1.01 USER MOD Single : A 111 LYS NZ :NH3+ -135:sc= 0.141 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.00526 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 ASN : amide:sc= 0.0164 K(o=0.016,f=-4.9!) USER MOD Single : A 134 TYR OH : rot 147:sc= 1.23 USER MOD Single : A 139 GLN : amide:sc=-5.99e-05 K(o=-6e-05,f=-1.2) USER MOD Single : A 140 MET CE :methyl -148:sc= -0.958 (180deg=-3.68!) USER MOD Single : A 141 MET CE :methyl -160:sc= -0.0113 (180deg=-0.773) USER MOD Single : A 142 THR OG1 : rot 32:sc= 0.234 USER MOD Single : B 1 ARG N :NH3+ -167:sc= 0.957 (180deg=0.516) USER MOD Single : B 3 LYS NZ :NH3+ -154:sc= 1.22 (180deg=1.18) USER MOD Single : B 5 GLN : amide:sc= -0.323 X(o=-0.32,f=-0.098) USER MOD Single : B 6 LYS NZ :NH3+ 175:sc= 1.03 (180deg=0.756) USER MOD Single : B 9 HIS : no HE2:sc= -1.07 K(o=-1.1,f=-2.4!) USER MOD Single : B 18 SER OG : rot 74:sc= 0.643 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 5.207 7.294 14.887 1.00 0.00 N ATOM 2 CA THR A 1 4.880 6.538 16.116 1.00 0.00 C ATOM 3 C THR A 1 5.152 5.073 16.166 1.00 0.00 C ATOM 4 O THR A 1 5.332 4.459 15.116 1.00 0.00 O ATOM 5 CB THR A 1 3.456 6.726 16.547 1.00 0.00 C ATOM 6 OG1 THR A 1 2.588 6.197 15.556 1.00 0.00 O ATOM 7 CG2 THR A 1 3.139 8.230 16.612 1.00 0.00 C ATOM 0 H1 THR A 1 5.201 8.313 15.094 1.00 0.00 H new ATOM 0 H2 THR A 1 6.150 7.015 14.549 1.00 0.00 H new ATOM 0 H3 THR A 1 4.500 7.086 14.153 1.00 0.00 H new ATOM 0 HA THR A 1 5.603 6.996 16.791 1.00 0.00 H new ATOM 0 HB THR A 1 3.321 6.236 17.511 1.00 0.00 H new ATOM 0 HG1 THR A 1 1.657 6.318 15.838 1.00 0.00 H new ATOM 0 HG21 THR A 1 2.104 8.371 16.925 1.00 0.00 H new ATOM 0 HG22 THR A 1 3.804 8.711 17.329 1.00 0.00 H new ATOM 0 HG23 THR A 1 3.284 8.675 15.628 1.00 0.00 H new ATOM 14 N GLU A 2 5.139 4.439 17.352 1.00 0.00 N ATOM 15 CA GLU A 2 5.416 3.057 17.598 1.00 0.00 C ATOM 16 C GLU A 2 4.426 2.111 17.010 1.00 0.00 C ATOM 17 O GLU A 2 4.775 0.995 16.628 1.00 0.00 O ATOM 18 CB GLU A 2 5.340 2.866 19.122 1.00 0.00 C ATOM 19 CG GLU A 2 6.285 3.676 20.012 1.00 0.00 C ATOM 20 CD GLU A 2 5.954 5.160 19.960 1.00 0.00 C ATOM 21 OE1 GLU A 2 4.750 5.530 19.942 1.00 0.00 O ATOM 22 OE2 GLU A 2 6.894 6.000 19.963 1.00 0.00 O ATOM 0 H GLU A 2 4.915 4.938 18.213 1.00 0.00 H new ATOM 0 HA GLU A 2 6.383 2.837 17.146 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.320 3.091 19.433 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.512 1.810 19.332 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.214 3.321 21.040 1.00 0.00 H new ATOM 0 HG3 GLU A 2 7.315 3.519 19.691 1.00 0.00 H new ATOM 29 N GLU A 3 3.173 2.574 16.858 1.00 0.00 N ATOM 30 CA GLU A 3 2.102 1.853 16.243 1.00 0.00 C ATOM 31 C GLU A 3 2.251 1.841 14.760 1.00 0.00 C ATOM 32 O GLU A 3 1.888 0.896 14.062 1.00 0.00 O ATOM 33 CB GLU A 3 0.749 2.517 16.547 1.00 0.00 C ATOM 34 CG GLU A 3 -0.458 1.828 15.907 1.00 0.00 C ATOM 35 CD GLU A 3 -1.747 2.591 16.181 1.00 0.00 C ATOM 36 OE1 GLU A 3 -1.816 3.702 15.592 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.692 2.015 16.783 1.00 0.00 O ATOM 0 H GLU A 3 2.892 3.500 17.181 1.00 0.00 H new ATOM 0 HA GLU A 3 2.136 0.840 16.644 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.606 2.541 17.627 1.00 0.00 H new ATOM 0 HB3 GLU A 3 0.783 3.552 16.206 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.304 1.747 14.831 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.546 0.813 16.294 1.00 0.00 H new ATOM 44 N GLN A 4 2.848 2.889 14.165 1.00 0.00 N ATOM 45 CA GLN A 4 3.206 2.958 12.782 1.00 0.00 C ATOM 46 C GLN A 4 4.313 2.020 12.445 1.00 0.00 C ATOM 47 O GLN A 4 4.244 1.290 11.458 1.00 0.00 O ATOM 48 CB GLN A 4 3.662 4.345 12.298 1.00 0.00 C ATOM 49 CG GLN A 4 2.493 5.329 12.222 1.00 0.00 C ATOM 50 CD GLN A 4 3.052 6.683 11.810 1.00 0.00 C ATOM 51 OE1 GLN A 4 4.089 7.071 12.346 1.00 0.00 O ATOM 52 NE2 GLN A 4 2.441 7.411 10.837 1.00 0.00 N ATOM 0 H GLN A 4 3.095 3.735 14.678 1.00 0.00 H new ATOM 0 HA GLN A 4 2.275 2.694 12.280 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.423 4.735 12.974 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.126 4.254 11.316 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.751 4.986 11.501 1.00 0.00 H new ATOM 0 HG3 GLN A 4 1.990 5.401 13.187 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.582 7.068 10.407 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.842 8.300 10.537 1.00 0.00 H new ATOM 61 N ILE A 5 5.362 1.949 13.285 1.00 0.00 N ATOM 62 CA ILE A 5 6.343 0.910 13.248 1.00 0.00 C ATOM 63 C ILE A 5 5.799 -0.473 13.146 1.00 0.00 C ATOM 64 O ILE A 5 5.995 -1.307 12.263 1.00 0.00 O ATOM 65 CB ILE A 5 7.365 1.140 14.322 1.00 0.00 C ATOM 66 CG1 ILE A 5 8.225 2.414 14.256 1.00 0.00 C ATOM 67 CG2 ILE A 5 8.279 -0.088 14.469 1.00 0.00 C ATOM 68 CD1 ILE A 5 8.892 2.678 12.907 1.00 0.00 C ATOM 0 H ILE A 5 5.532 2.640 14.016 1.00 0.00 H new ATOM 0 HA ILE A 5 6.867 0.978 12.295 1.00 0.00 H new ATOM 0 HB ILE A 5 6.740 1.304 15.200 1.00 0.00 H new ATOM 0 HG12 ILE A 5 7.598 3.270 14.507 1.00 0.00 H new ATOM 0 HG13 ILE A 5 9.000 2.351 15.020 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.014 0.097 15.252 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.679 -0.959 14.733 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.793 -0.274 13.526 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.475 3.597 12.963 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.550 1.846 12.658 1.00 0.00 H new ATOM 0 HD13 ILE A 5 8.127 2.779 12.137 1.00 0.00 H new ATOM 80 N ALA A 6 4.914 -0.851 14.085 1.00 0.00 N ATOM 81 CA ALA A 6 4.096 -2.024 14.129 1.00 0.00 C ATOM 82 C ALA A 6 3.326 -2.438 12.923 1.00 0.00 C ATOM 83 O ALA A 6 3.337 -3.542 12.382 1.00 0.00 O ATOM 84 CB ALA A 6 3.208 -2.007 15.385 1.00 0.00 C ATOM 0 H ALA A 6 4.756 -0.266 14.905 1.00 0.00 H new ATOM 0 HA ALA A 6 4.844 -2.816 14.163 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.591 -2.905 15.406 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.837 -1.978 16.275 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.566 -1.126 15.365 1.00 0.00 H new ATOM 90 N GLU A 7 2.723 -1.383 12.345 1.00 0.00 N ATOM 91 CA GLU A 7 1.967 -1.497 11.136 1.00 0.00 C ATOM 92 C GLU A 7 2.794 -1.791 9.933 1.00 0.00 C ATOM 93 O GLU A 7 2.439 -2.645 9.122 1.00 0.00 O ATOM 94 CB GLU A 7 1.156 -0.190 11.111 1.00 0.00 C ATOM 95 CG GLU A 7 0.158 -0.102 9.955 1.00 0.00 C ATOM 96 CD GLU A 7 -0.668 1.175 9.992 1.00 0.00 C ATOM 97 OE1 GLU A 7 -0.120 2.306 9.899 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.910 1.054 10.167 1.00 0.00 O ATOM 0 H GLU A 7 2.761 -0.436 12.723 1.00 0.00 H new ATOM 0 HA GLU A 7 1.307 -2.364 11.111 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.616 -0.091 12.053 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.845 0.652 11.048 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.697 -0.154 9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.509 -0.963 9.989 1.00 0.00 H new ATOM 105 N PHE A 8 3.910 -1.081 9.687 1.00 0.00 N ATOM 106 CA PHE A 8 4.924 -1.350 8.716 1.00 0.00 C ATOM 107 C PHE A 8 5.514 -2.712 8.846 1.00 0.00 C ATOM 108 O PHE A 8 5.625 -3.442 7.862 1.00 0.00 O ATOM 109 CB PHE A 8 6.077 -0.332 8.744 1.00 0.00 C ATOM 110 CG PHE A 8 5.593 0.995 8.270 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.014 1.197 7.039 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.832 2.053 9.115 1.00 0.00 C ATOM 113 CE1 PHE A 8 4.840 2.506 6.655 1.00 0.00 C ATOM 114 CE2 PHE A 8 5.816 3.335 8.619 1.00 0.00 C ATOM 115 CZ PHE A 8 5.308 3.585 7.366 1.00 0.00 C ATOM 0 H PHE A 8 4.120 -0.238 10.221 1.00 0.00 H new ATOM 0 HA PHE A 8 4.396 -1.272 7.766 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.472 -0.245 9.756 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.895 -0.678 8.112 1.00 0.00 H new ATOM 0 HD1 PHE A 8 4.713 0.373 6.409 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.031 1.878 10.162 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.302 2.698 5.738 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.203 4.148 9.215 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.278 4.585 6.959 1.00 0.00 H new ATOM 125 N LYS A 9 5.842 -3.226 10.044 1.00 0.00 N ATOM 126 CA LYS A 9 6.466 -4.486 10.306 1.00 0.00 C ATOM 127 C LYS A 9 5.553 -5.623 10.002 1.00 0.00 C ATOM 128 O LYS A 9 5.960 -6.643 9.448 1.00 0.00 O ATOM 129 CB LYS A 9 7.067 -4.479 11.722 1.00 0.00 C ATOM 130 CG LYS A 9 7.960 -5.667 12.086 1.00 0.00 C ATOM 131 CD LYS A 9 8.856 -5.266 13.259 1.00 0.00 C ATOM 132 CE LYS A 9 10.027 -6.219 13.506 1.00 0.00 C ATOM 133 NZ LYS A 9 9.518 -7.603 13.630 1.00 0.00 N ATOM 0 H LYS A 9 5.653 -2.713 10.905 1.00 0.00 H new ATOM 0 HA LYS A 9 7.304 -4.642 9.627 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.648 -3.565 11.842 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.249 -4.433 12.441 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.350 -6.530 12.354 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.567 -5.960 11.229 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.248 -4.265 13.077 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.250 -5.211 14.163 1.00 0.00 H new ATOM 0 HE2 LYS A 9 10.741 -6.155 12.685 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.558 -5.933 14.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.277 -8.222 13.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.721 -7.621 14.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.198 -7.940 12.700 1.00 0.00 H new ATOM 147 N GLU A 10 4.268 -5.513 10.384 1.00 0.00 N ATOM 148 CA GLU A 10 3.156 -6.289 9.931 1.00 0.00 C ATOM 149 C GLU A 10 2.949 -6.575 8.484 1.00 0.00 C ATOM 150 O GLU A 10 2.695 -7.725 8.127 1.00 0.00 O ATOM 151 CB GLU A 10 1.853 -5.719 10.518 1.00 0.00 C ATOM 152 CG GLU A 10 0.611 -6.598 10.355 1.00 0.00 C ATOM 153 CD GLU A 10 0.392 -7.500 11.561 1.00 0.00 C ATOM 154 OE1 GLU A 10 0.952 -8.629 11.538 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.294 -7.087 12.533 1.00 0.00 O ATOM 0 H GLU A 10 3.984 -4.817 11.073 1.00 0.00 H new ATOM 0 HA GLU A 10 3.440 -7.273 10.304 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.006 -5.532 11.581 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.657 -4.754 10.050 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.265 -5.966 10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.714 -7.209 9.458 1.00 0.00 H new ATOM 162 N ALA A 11 3.044 -5.539 7.631 1.00 0.00 N ATOM 163 CA ALA A 11 3.240 -5.622 6.217 1.00 0.00 C ATOM 164 C ALA A 11 4.478 -6.217 5.639 1.00 0.00 C ATOM 165 O ALA A 11 4.405 -7.014 4.705 1.00 0.00 O ATOM 166 CB ALA A 11 2.902 -4.272 5.562 1.00 0.00 C ATOM 0 H ALA A 11 2.979 -4.574 7.955 1.00 0.00 H new ATOM 0 HA ALA A 11 2.539 -6.415 5.958 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.053 -4.342 4.485 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.862 -4.019 5.766 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.551 -3.497 5.970 1.00 0.00 H new ATOM 172 N PHE A 12 5.588 -5.865 6.311 1.00 0.00 N ATOM 173 CA PHE A 12 6.862 -6.464 6.055 1.00 0.00 C ATOM 174 C PHE A 12 6.943 -7.941 6.234 1.00 0.00 C ATOM 175 O PHE A 12 7.629 -8.668 5.517 1.00 0.00 O ATOM 176 CB PHE A 12 7.886 -5.687 6.899 1.00 0.00 C ATOM 177 CG PHE A 12 9.307 -6.048 6.635 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.879 -5.586 5.473 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.020 -6.842 7.504 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.223 -5.787 5.266 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.343 -7.102 7.238 1.00 0.00 C ATOM 182 CZ PHE A 12 11.977 -6.444 6.211 1.00 0.00 C ATOM 0 H PHE A 12 5.602 -5.155 7.043 1.00 0.00 H new ATOM 0 HA PHE A 12 7.076 -6.379 4.990 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.755 -4.621 6.715 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.671 -5.857 7.954 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.281 -5.073 4.734 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.547 -7.255 8.383 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.688 -5.428 4.360 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.884 -7.822 7.835 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.055 -6.443 6.147 1.00 0.00 H new ATOM 192 N SER A 13 6.401 -8.414 7.370 1.00 0.00 N ATOM 193 CA SER A 13 6.561 -9.751 7.850 1.00 0.00 C ATOM 194 C SER A 13 5.756 -10.774 7.125 1.00 0.00 C ATOM 195 O SER A 13 5.968 -11.974 7.294 1.00 0.00 O ATOM 196 CB SER A 13 6.307 -9.738 9.367 1.00 0.00 C ATOM 197 OG SER A 13 7.209 -8.950 10.130 1.00 0.00 O ATOM 0 H SER A 13 5.824 -7.837 7.982 1.00 0.00 H new ATOM 0 HA SER A 13 7.582 -10.072 7.645 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.295 -9.376 9.545 1.00 0.00 H new ATOM 0 HB3 SER A 13 6.348 -10.764 9.734 1.00 0.00 H new ATOM 0 HG SER A 13 6.966 -8.004 10.050 1.00 0.00 H new ATOM 203 N LEU A 14 4.853 -10.318 6.239 1.00 0.00 N ATOM 204 CA LEU A 14 4.143 -11.131 5.300 1.00 0.00 C ATOM 205 C LEU A 14 5.016 -11.732 4.253 1.00 0.00 C ATOM 206 O LEU A 14 4.732 -12.785 3.684 1.00 0.00 O ATOM 207 CB LEU A 14 2.997 -10.362 4.623 1.00 0.00 C ATOM 208 CG LEU A 14 1.900 -9.892 5.592 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.850 -9.128 4.768 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.282 -11.034 6.417 1.00 0.00 C ATOM 0 H LEU A 14 4.605 -9.331 6.174 1.00 0.00 H new ATOM 0 HA LEU A 14 3.731 -11.945 5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.410 -9.494 4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.546 -10.999 3.862 1.00 0.00 H new ATOM 0 HG LEU A 14 2.342 -9.236 6.342 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.054 -8.779 5.426 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.320 -8.273 4.282 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.430 -9.790 4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.516 -10.631 7.079 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.833 -11.766 5.746 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.059 -11.515 7.011 1.00 0.00 H new ATOM 222 N PHE A 15 6.115 -11.052 3.881 1.00 0.00 N ATOM 223 CA PHE A 15 7.029 -11.492 2.872 1.00 0.00 C ATOM 224 C PHE A 15 8.084 -12.406 3.394 1.00 0.00 C ATOM 225 O PHE A 15 8.432 -13.392 2.747 1.00 0.00 O ATOM 226 CB PHE A 15 7.824 -10.373 2.180 1.00 0.00 C ATOM 227 CG PHE A 15 6.961 -9.419 1.428 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.670 -9.594 0.096 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.561 -8.256 2.043 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.761 -8.796 -0.557 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.666 -7.438 1.394 1.00 0.00 C ATOM 232 CZ PHE A 15 5.203 -7.748 0.136 1.00 0.00 C ATOM 0 H PHE A 15 6.378 -10.160 4.300 1.00 0.00 H new ATOM 0 HA PHE A 15 6.351 -11.980 2.172 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.394 -9.824 2.930 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.545 -10.819 1.495 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.169 -10.380 -0.452 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.943 -7.990 3.018 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.493 -8.987 -1.586 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.321 -6.537 1.880 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.404 -7.170 -0.305 1.00 0.00 H new ATOM 242 N ASP A 16 8.669 -12.141 4.576 1.00 0.00 N ATOM 243 CA ASP A 16 9.865 -12.751 5.067 1.00 0.00 C ATOM 244 C ASP A 16 9.435 -14.021 5.717 1.00 0.00 C ATOM 245 O ASP A 16 8.626 -14.073 6.642 1.00 0.00 O ATOM 246 CB ASP A 16 10.443 -11.669 5.995 1.00 0.00 C ATOM 247 CG ASP A 16 11.759 -11.980 6.694 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.385 -13.038 6.415 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.084 -11.192 7.621 1.00 0.00 O ATOM 0 H ASP A 16 8.282 -11.459 5.228 1.00 0.00 H new ATOM 0 HA ASP A 16 10.636 -13.037 4.351 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.579 -10.760 5.410 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.699 -11.448 6.760 1.00 0.00 H new ATOM 254 N LYS A 17 9.836 -15.195 5.198 1.00 0.00 N ATOM 255 CA LYS A 17 9.214 -16.459 5.443 1.00 0.00 C ATOM 256 C LYS A 17 9.704 -17.215 6.629 1.00 0.00 C ATOM 257 O LYS A 17 8.903 -17.637 7.461 1.00 0.00 O ATOM 258 CB LYS A 17 9.099 -17.387 4.222 1.00 0.00 C ATOM 259 CG LYS A 17 8.080 -16.841 3.219 1.00 0.00 C ATOM 260 CD LYS A 17 6.679 -16.491 3.726 1.00 0.00 C ATOM 261 CE LYS A 17 5.772 -16.045 2.577 1.00 0.00 C ATOM 262 NZ LYS A 17 4.380 -15.933 3.067 1.00 0.00 N ATOM 0 H LYS A 17 10.639 -15.266 4.573 1.00 0.00 H new ATOM 0 HA LYS A 17 8.206 -16.127 5.690 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.072 -17.485 3.741 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.800 -18.384 4.544 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.505 -15.944 2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.971 -17.576 2.422 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.242 -17.357 4.223 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.746 -15.697 4.470 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.109 -15.086 2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.825 -16.762 1.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.722 -16.202 2.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.246 -16.566 3.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.192 -14.952 3.357 1.00 0.00 H new ATOM 276 N ASP A 18 11.039 -17.331 6.752 1.00 0.00 N ATOM 277 CA ASP A 18 11.815 -17.664 7.905 1.00 0.00 C ATOM 278 C ASP A 18 11.925 -16.739 9.068 1.00 0.00 C ATOM 279 O ASP A 18 11.864 -17.198 10.208 1.00 0.00 O ATOM 280 CB ASP A 18 13.200 -18.169 7.465 1.00 0.00 C ATOM 281 CG ASP A 18 13.902 -17.212 6.513 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.676 -15.973 6.478 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.720 -17.729 5.706 1.00 0.00 O ATOM 0 H ASP A 18 11.641 -17.171 5.944 1.00 0.00 H new ATOM 0 HA ASP A 18 11.187 -18.430 8.360 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.823 -18.320 8.346 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.091 -19.140 6.982 1.00 0.00 H new ATOM 288 N GLY A 19 11.981 -15.425 8.790 1.00 0.00 N ATOM 289 CA GLY A 19 11.844 -14.398 9.775 1.00 0.00 C ATOM 290 C GLY A 19 13.131 -13.901 10.338 1.00 0.00 C ATOM 291 O GLY A 19 13.253 -13.791 11.557 1.00 0.00 O ATOM 0 H GLY A 19 12.127 -15.065 7.847 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.308 -13.558 9.333 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.228 -14.776 10.591 1.00 0.00 H new ATOM 295 N ASP A 20 14.146 -13.609 9.507 1.00 0.00 N ATOM 296 CA ASP A 20 15.371 -13.040 9.977 1.00 0.00 C ATOM 297 C ASP A 20 15.068 -11.587 10.116 1.00 0.00 C ATOM 298 O ASP A 20 15.661 -10.942 10.979 1.00 0.00 O ATOM 299 CB ASP A 20 16.512 -13.439 9.026 1.00 0.00 C ATOM 300 CG ASP A 20 16.242 -13.151 7.556 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.393 -13.862 6.954 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.996 -12.348 6.945 1.00 0.00 O ATOM 0 H ASP A 20 14.118 -13.769 8.500 1.00 0.00 H new ATOM 0 HA ASP A 20 15.730 -13.399 10.942 1.00 0.00 H new ATOM 0 HB2 ASP A 20 17.418 -12.912 9.325 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.709 -14.504 9.144 1.00 0.00 H new ATOM 307 N GLY A 21 14.237 -11.000 9.236 1.00 0.00 N ATOM 308 CA GLY A 21 14.040 -9.584 9.250 1.00 0.00 C ATOM 309 C GLY A 21 14.424 -8.961 7.953 1.00 0.00 C ATOM 310 O GLY A 21 14.568 -7.739 7.958 1.00 0.00 O ATOM 0 H GLY A 21 13.707 -11.500 8.522 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.994 -9.364 9.463 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.629 -9.143 10.054 1.00 0.00 H new ATOM 314 N THR A 22 14.661 -9.805 6.933 1.00 0.00 N ATOM 315 CA THR A 22 15.047 -9.380 5.624 1.00 0.00 C ATOM 316 C THR A 22 14.303 -10.164 4.597 1.00 0.00 C ATOM 317 O THR A 22 14.072 -11.372 4.615 1.00 0.00 O ATOM 318 CB THR A 22 16.498 -9.270 5.259 1.00 0.00 C ATOM 319 OG1 THR A 22 17.136 -10.525 5.074 1.00 0.00 O ATOM 320 CG2 THR A 22 17.268 -8.454 6.311 1.00 0.00 C ATOM 0 H THR A 22 14.581 -10.818 7.023 1.00 0.00 H new ATOM 0 HA THR A 22 14.769 -8.326 5.647 1.00 0.00 H new ATOM 0 HB THR A 22 16.519 -8.756 4.298 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.811 -11.160 5.746 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.317 -8.388 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.846 -7.451 6.374 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.187 -8.943 7.282 1.00 0.00 H new ATOM 328 N ILE A 23 14.040 -9.514 3.449 1.00 0.00 N ATOM 329 CA ILE A 23 13.293 -10.069 2.363 1.00 0.00 C ATOM 330 C ILE A 23 14.220 -10.398 1.244 1.00 0.00 C ATOM 331 O ILE A 23 14.903 -9.499 0.755 1.00 0.00 O ATOM 332 CB ILE A 23 12.105 -9.324 1.832 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.244 -8.748 2.969 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.281 -10.289 0.962 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.262 -7.699 2.448 1.00 0.00 C ATOM 0 H ILE A 23 14.361 -8.563 3.270 1.00 0.00 H new ATOM 0 HA ILE A 23 12.829 -10.944 2.819 1.00 0.00 H new ATOM 0 HB ILE A 23 12.447 -8.478 1.236 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.694 -9.554 3.455 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.889 -8.301 3.725 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.410 -9.767 0.565 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.895 -10.650 0.137 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.953 -11.134 1.567 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.669 -7.312 3.277 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.815 -6.882 1.985 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.601 -8.154 1.710 1.00 0.00 H new ATOM 347 N THR A 24 14.434 -11.681 0.901 1.00 0.00 N ATOM 348 CA THR A 24 15.211 -12.081 -0.231 1.00 0.00 C ATOM 349 C THR A 24 14.466 -12.086 -1.521 1.00 0.00 C ATOM 350 O THR A 24 13.274 -11.816 -1.665 1.00 0.00 O ATOM 351 CB THR A 24 15.721 -13.481 -0.058 1.00 0.00 C ATOM 352 OG1 THR A 24 14.677 -14.443 -0.017 1.00 0.00 O ATOM 353 CG2 THR A 24 16.503 -13.600 1.261 1.00 0.00 C ATOM 0 H THR A 24 14.053 -12.466 1.429 1.00 0.00 H new ATOM 0 HA THR A 24 16.007 -11.338 -0.277 1.00 0.00 H new ATOM 0 HB THR A 24 16.355 -13.681 -0.921 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.189 -14.361 0.829 1.00 0.00 H new ATOM 0 HG21 THR A 24 16.869 -14.620 1.376 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.348 -12.911 1.247 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.848 -13.353 2.096 1.00 0.00 H new ATOM 361 N THR A 25 15.246 -12.380 -2.576 1.00 0.00 N ATOM 362 CA THR A 25 14.686 -12.532 -3.883 1.00 0.00 C ATOM 363 C THR A 25 13.692 -13.623 -4.083 1.00 0.00 C ATOM 364 O THR A 25 12.719 -13.607 -4.836 1.00 0.00 O ATOM 365 CB THR A 25 15.651 -12.443 -5.028 1.00 0.00 C ATOM 366 OG1 THR A 25 16.603 -13.456 -4.737 1.00 0.00 O ATOM 367 CG2 THR A 25 16.363 -11.090 -4.855 1.00 0.00 C ATOM 0 H THR A 25 16.256 -12.512 -2.526 1.00 0.00 H new ATOM 0 HA THR A 25 14.093 -11.618 -3.909 1.00 0.00 H new ATOM 0 HB THR A 25 15.203 -12.541 -6.017 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.284 -13.477 -5.441 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.087 -10.954 -5.659 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.628 -10.285 -4.888 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.879 -11.071 -3.895 1.00 0.00 H new ATOM 375 N LYS A 26 14.030 -14.743 -3.420 1.00 0.00 N ATOM 376 CA LYS A 26 13.184 -15.896 -3.452 1.00 0.00 C ATOM 377 C LYS A 26 11.954 -15.673 -2.641 1.00 0.00 C ATOM 378 O LYS A 26 10.891 -16.174 -3.004 1.00 0.00 O ATOM 379 CB LYS A 26 13.846 -17.225 -3.051 1.00 0.00 C ATOM 380 CG LYS A 26 15.003 -17.618 -3.972 1.00 0.00 C ATOM 381 CD LYS A 26 15.735 -18.866 -3.473 1.00 0.00 C ATOM 382 CE LYS A 26 16.754 -19.499 -4.422 1.00 0.00 C ATOM 383 NZ LYS A 26 18.004 -18.706 -4.420 1.00 0.00 N ATOM 0 H LYS A 26 14.880 -14.851 -2.867 1.00 0.00 H new ATOM 0 HA LYS A 26 12.934 -16.013 -4.506 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.214 -17.147 -2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.096 -18.016 -3.061 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.621 -17.799 -4.977 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.707 -16.789 -4.043 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.249 -18.610 -2.546 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.988 -19.620 -3.225 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.963 -20.524 -4.115 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.344 -19.546 -5.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 18.692 -19.141 -5.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.800 -17.736 -4.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.399 -18.683 -3.458 1.00 0.00 H new ATOM 397 N GLU A 27 11.979 -14.820 -1.601 1.00 0.00 N ATOM 398 CA GLU A 27 10.850 -14.648 -0.742 1.00 0.00 C ATOM 399 C GLU A 27 9.867 -13.706 -1.347 1.00 0.00 C ATOM 400 O GLU A 27 8.655 -13.733 -1.139 1.00 0.00 O ATOM 401 CB GLU A 27 11.150 -14.126 0.674 1.00 0.00 C ATOM 402 CG GLU A 27 11.664 -15.240 1.588 1.00 0.00 C ATOM 403 CD GLU A 27 12.480 -14.735 2.770 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.376 -13.854 2.681 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.212 -15.161 3.925 1.00 0.00 O ATOM 0 H GLU A 27 12.786 -14.247 -1.355 1.00 0.00 H new ATOM 0 HA GLU A 27 10.463 -15.662 -0.638 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.891 -13.329 0.619 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.246 -13.692 1.101 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.815 -15.812 1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.276 -15.925 1.002 1.00 0.00 H new ATOM 412 N LEU A 28 10.462 -12.791 -2.132 1.00 0.00 N ATOM 413 CA LEU A 28 9.855 -11.698 -2.825 1.00 0.00 C ATOM 414 C LEU A 28 9.216 -12.330 -4.013 1.00 0.00 C ATOM 415 O LEU A 28 8.010 -12.234 -4.233 1.00 0.00 O ATOM 416 CB LEU A 28 10.834 -10.585 -3.236 1.00 0.00 C ATOM 417 CG LEU A 28 10.173 -9.358 -3.888 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.167 -8.715 -2.920 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.256 -8.308 -4.188 1.00 0.00 C ATOM 0 H LEU A 28 11.468 -12.822 -2.296 1.00 0.00 H new ATOM 0 HA LEU A 28 9.149 -11.178 -2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.384 -10.259 -2.353 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.564 -11.000 -3.931 1.00 0.00 H new ATOM 0 HG LEU A 28 9.665 -9.680 -4.797 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.708 -7.848 -3.395 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.395 -9.440 -2.663 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.684 -8.400 -2.014 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.797 -7.434 -4.651 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.744 -8.013 -3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.995 -8.732 -4.867 1.00 0.00 H new ATOM 431 N GLY A 29 9.978 -13.050 -4.857 1.00 0.00 N ATOM 432 CA GLY A 29 9.548 -13.926 -5.902 1.00 0.00 C ATOM 433 C GLY A 29 8.391 -14.814 -5.599 1.00 0.00 C ATOM 434 O GLY A 29 7.502 -14.932 -6.441 1.00 0.00 O ATOM 0 H GLY A 29 10.996 -13.013 -4.799 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.292 -13.319 -6.771 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.392 -14.553 -6.189 1.00 0.00 H new ATOM 438 N THR A 30 8.424 -15.563 -4.482 1.00 0.00 N ATOM 439 CA THR A 30 7.366 -16.396 -4.000 1.00 0.00 C ATOM 440 C THR A 30 6.064 -15.688 -3.841 1.00 0.00 C ATOM 441 O THR A 30 5.008 -16.154 -4.267 1.00 0.00 O ATOM 442 CB THR A 30 7.646 -17.079 -2.695 1.00 0.00 C ATOM 443 OG1 THR A 30 8.724 -17.991 -2.853 1.00 0.00 O ATOM 444 CG2 THR A 30 6.446 -17.758 -2.013 1.00 0.00 C ATOM 0 H THR A 30 9.244 -15.588 -3.876 1.00 0.00 H new ATOM 0 HA THR A 30 7.300 -17.141 -4.793 1.00 0.00 H new ATOM 0 HB THR A 30 7.912 -16.277 -2.007 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.567 -17.495 -2.907 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.770 -18.217 -1.079 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.677 -17.014 -1.804 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.039 -18.525 -2.672 1.00 0.00 H new ATOM 452 N VAL A 31 6.070 -14.513 -3.187 1.00 0.00 N ATOM 453 CA VAL A 31 4.879 -13.746 -2.988 1.00 0.00 C ATOM 454 C VAL A 31 4.370 -13.209 -4.282 1.00 0.00 C ATOM 455 O VAL A 31 3.174 -13.198 -4.568 1.00 0.00 O ATOM 456 CB VAL A 31 5.230 -12.690 -1.983 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.107 -11.639 -1.942 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.336 -13.224 -0.545 1.00 0.00 C ATOM 0 H VAL A 31 6.910 -14.090 -2.792 1.00 0.00 H new ATOM 0 HA VAL A 31 4.054 -14.347 -2.605 1.00 0.00 H new ATOM 0 HB VAL A 31 6.195 -12.293 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.356 -10.868 -1.213 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.997 -11.185 -2.927 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.170 -12.118 -1.657 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.593 -12.406 0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.381 -13.655 -0.246 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.110 -13.990 -0.497 1.00 0.00 H new ATOM 468 N MET A 32 5.263 -12.692 -5.145 1.00 0.00 N ATOM 469 CA MET A 32 4.943 -12.087 -6.401 1.00 0.00 C ATOM 470 C MET A 32 4.429 -13.046 -7.418 1.00 0.00 C ATOM 471 O MET A 32 3.496 -12.711 -8.146 1.00 0.00 O ATOM 472 CB MET A 32 6.186 -11.407 -6.999 1.00 0.00 C ATOM 473 CG MET A 32 6.467 -10.071 -6.308 1.00 0.00 C ATOM 474 SD MET A 32 8.033 -9.457 -6.999 1.00 0.00 S ATOM 475 CE MET A 32 7.661 -7.743 -6.530 1.00 0.00 C ATOM 0 H MET A 32 6.265 -12.697 -4.955 1.00 0.00 H new ATOM 0 HA MET A 32 4.154 -11.369 -6.178 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.050 -12.063 -6.894 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.037 -11.244 -8.066 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.658 -9.363 -6.488 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.543 -10.200 -5.228 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.456 -7.088 -6.886 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.714 -7.441 -6.978 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.589 -7.670 -5.445 1.00 0.00 H new ATOM 485 N ARG A 33 4.979 -14.269 -7.530 1.00 0.00 N ATOM 486 CA ARG A 33 4.516 -15.252 -8.460 1.00 0.00 C ATOM 487 C ARG A 33 3.254 -15.915 -8.027 1.00 0.00 C ATOM 488 O ARG A 33 2.548 -16.537 -8.820 1.00 0.00 O ATOM 489 CB ARG A 33 5.617 -16.270 -8.802 1.00 0.00 C ATOM 490 CG ARG A 33 5.810 -17.369 -7.755 1.00 0.00 C ATOM 491 CD ARG A 33 7.134 -18.125 -7.883 1.00 0.00 C ATOM 492 NE ARG A 33 6.998 -19.313 -6.994 1.00 0.00 N ATOM 493 CZ ARG A 33 8.021 -19.904 -6.310 1.00 0.00 C ATOM 494 NH1 ARG A 33 9.289 -19.401 -6.260 1.00 0.00 N ATOM 495 NH2 ARG A 33 7.782 -21.112 -5.720 1.00 0.00 N ATOM 0 H ARG A 33 5.765 -14.582 -6.960 1.00 0.00 H new ATOM 0 HA ARG A 33 4.270 -14.716 -9.377 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.380 -16.735 -9.759 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.560 -15.738 -8.930 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.752 -16.924 -6.762 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.988 -18.080 -7.834 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.317 -18.425 -8.915 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.974 -17.501 -7.579 1.00 0.00 H new ATOM 0 HE ARG A 33 6.067 -19.716 -6.888 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.514 -18.536 -6.752 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.011 -19.890 -5.731 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.862 -21.545 -5.798 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.524 -21.582 -5.201 1.00 0.00 H new ATOM 509 N SER A 34 2.918 -15.729 -6.738 1.00 0.00 N ATOM 510 CA SER A 34 1.646 -16.123 -6.217 1.00 0.00 C ATOM 511 C SER A 34 0.631 -15.139 -6.686 1.00 0.00 C ATOM 512 O SER A 34 -0.370 -15.577 -7.251 1.00 0.00 O ATOM 513 CB SER A 34 1.599 -16.378 -4.701 1.00 0.00 C ATOM 514 OG SER A 34 2.566 -17.343 -4.312 1.00 0.00 O ATOM 0 H SER A 34 3.536 -15.300 -6.049 1.00 0.00 H new ATOM 0 HA SER A 34 1.418 -17.113 -6.611 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.778 -15.445 -4.167 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.604 -16.722 -4.418 1.00 0.00 H new ATOM 0 HG SER A 34 3.453 -16.928 -4.293 1.00 0.00 H new ATOM 520 N LEU A 35 0.870 -13.832 -6.474 1.00 0.00 N ATOM 521 CA LEU A 35 -0.088 -12.808 -6.750 1.00 0.00 C ATOM 522 C LEU A 35 -0.393 -12.653 -8.201 1.00 0.00 C ATOM 523 O LEU A 35 -1.456 -12.977 -8.728 1.00 0.00 O ATOM 524 CB LEU A 35 0.128 -11.443 -6.075 1.00 0.00 C ATOM 525 CG LEU A 35 0.214 -11.271 -4.549 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.160 -10.130 -4.138 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.177 -10.924 -3.992 1.00 0.00 C ATOM 0 H LEU A 35 1.751 -13.479 -6.101 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.971 -13.209 -6.253 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.053 -11.037 -6.485 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.682 -10.797 -6.415 1.00 0.00 H new ATOM 0 HG LEU A 35 0.594 -12.212 -4.150 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.184 -10.051 -3.051 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.164 -10.338 -4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.803 -9.191 -4.562 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.116 -10.802 -2.911 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.528 -9.996 -4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.874 -11.728 -4.228 1.00 0.00 H new ATOM 539 N GLY A 36 0.588 -12.255 -9.031 1.00 0.00 N ATOM 540 CA GLY A 36 0.458 -12.432 -10.444 1.00 0.00 C ATOM 541 C GLY A 36 1.752 -11.995 -11.038 1.00 0.00 C ATOM 542 O GLY A 36 2.529 -12.800 -11.548 1.00 0.00 O ATOM 0 H GLY A 36 1.459 -11.817 -8.730 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.250 -13.474 -10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.370 -11.841 -10.836 1.00 0.00 H new ATOM 546 N GLN A 37 2.096 -10.702 -10.897 1.00 0.00 N ATOM 547 CA GLN A 37 3.281 -10.227 -11.541 1.00 0.00 C ATOM 548 C GLN A 37 4.575 -10.707 -10.981 1.00 0.00 C ATOM 549 O GLN A 37 4.872 -10.363 -9.838 1.00 0.00 O ATOM 550 CB GLN A 37 3.321 -8.690 -11.586 1.00 0.00 C ATOM 551 CG GLN A 37 2.160 -8.202 -12.455 1.00 0.00 C ATOM 552 CD GLN A 37 2.235 -6.701 -12.694 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.482 -6.302 -13.831 1.00 0.00 O ATOM 554 NE2 GLN A 37 2.051 -5.821 -11.673 1.00 0.00 N ATOM 0 H GLN A 37 1.577 -10.008 -10.359 1.00 0.00 H new ATOM 0 HA GLN A 37 3.198 -10.658 -12.539 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.240 -8.279 -10.580 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.271 -8.347 -11.995 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.175 -8.725 -13.411 1.00 0.00 H new ATOM 0 HG3 GLN A 37 1.214 -8.448 -11.972 1.00 0.00 H new ATOM 0 HE21 GLN A 37 1.847 -6.164 -10.734 1.00 0.00 H new ATOM 0 HE22 GLN A 37 2.117 -4.818 -11.846 1.00 0.00 H new ATOM 563 N ASN A 38 5.443 -11.333 -11.796 1.00 0.00 N ATOM 564 CA ASN A 38 6.681 -11.964 -11.458 1.00 0.00 C ATOM 565 C ASN A 38 7.717 -11.375 -12.352 1.00 0.00 C ATOM 566 O ASN A 38 7.742 -11.815 -13.500 1.00 0.00 O ATOM 567 CB ASN A 38 6.497 -13.485 -11.596 1.00 0.00 C ATOM 568 CG ASN A 38 7.503 -14.368 -10.872 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.112 -13.927 -9.898 1.00 0.00 O ATOM 570 ND2 ASN A 38 7.727 -15.601 -11.402 1.00 0.00 N ATOM 0 H ASN A 38 5.255 -11.403 -12.796 1.00 0.00 H new ATOM 0 HA ASN A 38 7.003 -11.795 -10.430 1.00 0.00 H new ATOM 0 HB2 ASN A 38 5.500 -13.740 -11.236 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.527 -13.736 -12.656 1.00 0.00 H new ATOM 0 HD21 ASN A 38 8.431 -16.213 -10.990 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.191 -15.913 -12.211 1.00 0.00 H new ATOM 577 N PRO A 39 8.570 -10.466 -11.981 1.00 0.00 N ATOM 578 CA PRO A 39 9.663 -10.031 -12.801 1.00 0.00 C ATOM 579 C PRO A 39 10.691 -11.055 -13.138 1.00 0.00 C ATOM 580 O PRO A 39 10.637 -12.216 -12.736 1.00 0.00 O ATOM 581 CB PRO A 39 10.341 -8.878 -12.064 1.00 0.00 C ATOM 582 CG PRO A 39 9.918 -9.010 -10.592 1.00 0.00 C ATOM 583 CD PRO A 39 8.691 -9.934 -10.633 1.00 0.00 C ATOM 0 HA PRO A 39 9.231 -9.757 -13.763 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.425 -8.934 -12.165 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.032 -7.917 -12.474 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.717 -9.436 -9.985 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.672 -8.040 -10.160 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.801 -10.745 -9.913 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.791 -9.384 -10.359 1.00 0.00 H new ATOM 591 N THR A 40 11.747 -10.692 -13.888 1.00 0.00 N ATOM 592 CA THR A 40 12.914 -11.477 -14.144 1.00 0.00 C ATOM 593 C THR A 40 13.903 -11.245 -13.054 1.00 0.00 C ATOM 594 O THR A 40 13.810 -10.287 -12.288 1.00 0.00 O ATOM 595 CB THR A 40 13.597 -11.332 -15.472 1.00 0.00 C ATOM 596 OG1 THR A 40 14.193 -10.047 -15.573 1.00 0.00 O ATOM 597 CG2 THR A 40 12.545 -11.507 -16.580 1.00 0.00 C ATOM 0 H THR A 40 11.786 -9.783 -14.349 1.00 0.00 H new ATOM 0 HA THR A 40 12.529 -12.496 -14.176 1.00 0.00 H new ATOM 0 HB THR A 40 14.378 -12.086 -15.573 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.548 -9.416 -15.955 1.00 0.00 H new ATOM 0 HG21 THR A 40 13.023 -11.405 -17.555 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.093 -12.495 -16.499 1.00 0.00 H new ATOM 0 HG23 THR A 40 11.773 -10.745 -16.473 1.00 0.00 H new ATOM 605 N GLU A 41 14.913 -12.115 -12.876 1.00 0.00 N ATOM 606 CA GLU A 41 15.799 -12.125 -11.753 1.00 0.00 C ATOM 607 C GLU A 41 16.799 -11.027 -11.641 1.00 0.00 C ATOM 608 O GLU A 41 17.240 -10.568 -10.588 1.00 0.00 O ATOM 609 CB GLU A 41 16.427 -13.529 -11.782 1.00 0.00 C ATOM 610 CG GLU A 41 15.407 -14.538 -11.252 1.00 0.00 C ATOM 611 CD GLU A 41 16.071 -15.901 -11.385 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.955 -16.276 -10.569 1.00 0.00 O ATOM 613 OE2 GLU A 41 15.786 -16.553 -12.425 1.00 0.00 O ATOM 0 H GLU A 41 15.122 -12.850 -13.551 1.00 0.00 H new ATOM 0 HA GLU A 41 15.228 -11.916 -10.849 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.722 -13.789 -12.799 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.331 -13.551 -11.173 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.150 -14.327 -10.214 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.480 -14.496 -11.825 1.00 0.00 H new ATOM 620 N ALA A 42 17.273 -10.514 -12.790 1.00 0.00 N ATOM 621 CA ALA A 42 17.930 -9.248 -12.889 1.00 0.00 C ATOM 622 C ALA A 42 17.130 -8.122 -12.330 1.00 0.00 C ATOM 623 O ALA A 42 17.505 -7.499 -11.338 1.00 0.00 O ATOM 624 CB ALA A 42 18.249 -8.977 -14.370 1.00 0.00 C ATOM 0 H ALA A 42 17.196 -10.999 -13.684 1.00 0.00 H new ATOM 0 HA ALA A 42 18.840 -9.301 -12.292 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.751 -8.014 -14.464 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.899 -9.764 -14.752 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.323 -8.961 -14.945 1.00 0.00 H new ATOM 630 N GLU A 43 15.932 -7.881 -12.891 1.00 0.00 N ATOM 631 CA GLU A 43 14.945 -6.919 -12.510 1.00 0.00 C ATOM 632 C GLU A 43 14.652 -6.881 -11.050 1.00 0.00 C ATOM 633 O GLU A 43 14.627 -5.838 -10.399 1.00 0.00 O ATOM 634 CB GLU A 43 13.615 -7.029 -13.275 1.00 0.00 C ATOM 635 CG GLU A 43 13.893 -6.694 -14.741 1.00 0.00 C ATOM 636 CD GLU A 43 12.616 -6.987 -15.516 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.411 -8.220 -15.672 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.883 -6.089 -16.011 1.00 0.00 O ATOM 0 H GLU A 43 15.624 -8.421 -13.700 1.00 0.00 H new ATOM 0 HA GLU A 43 15.428 -5.983 -12.792 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.203 -8.034 -13.184 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.877 -6.343 -12.859 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.178 -5.648 -14.850 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.721 -7.291 -15.123 1.00 0.00 H new ATOM 645 N LEU A 44 14.508 -8.060 -10.418 1.00 0.00 N ATOM 646 CA LEU A 44 14.106 -8.340 -9.074 1.00 0.00 C ATOM 647 C LEU A 44 15.267 -8.104 -8.171 1.00 0.00 C ATOM 648 O LEU A 44 15.106 -7.606 -7.057 1.00 0.00 O ATOM 649 CB LEU A 44 13.595 -9.780 -8.898 1.00 0.00 C ATOM 650 CG LEU A 44 12.981 -10.063 -7.516 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.771 -9.165 -7.211 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.434 -11.501 -7.502 1.00 0.00 C ATOM 0 H LEU A 44 14.700 -8.927 -10.920 1.00 0.00 H new ATOM 0 HA LEU A 44 13.277 -7.677 -8.825 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.848 -9.986 -9.665 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.422 -10.471 -9.065 1.00 0.00 H new ATOM 0 HG LEU A 44 13.769 -9.886 -6.784 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.378 -9.408 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.079 -8.120 -7.232 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.997 -9.330 -7.961 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.996 -11.714 -6.527 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.672 -11.608 -8.274 1.00 0.00 H new ATOM 0 HD23 LEU A 44 13.247 -12.201 -7.695 1.00 0.00 H new ATOM 664 N GLN A 45 16.484 -8.499 -8.585 1.00 0.00 N ATOM 665 CA GLN A 45 17.698 -8.107 -7.940 1.00 0.00 C ATOM 666 C GLN A 45 18.016 -6.652 -7.953 1.00 0.00 C ATOM 667 O GLN A 45 18.468 -6.096 -6.953 1.00 0.00 O ATOM 668 CB GLN A 45 18.827 -8.899 -8.621 1.00 0.00 C ATOM 669 CG GLN A 45 20.294 -8.821 -8.195 1.00 0.00 C ATOM 670 CD GLN A 45 21.207 -9.542 -9.177 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.797 -10.504 -9.823 1.00 0.00 O ATOM 672 NE2 GLN A 45 22.463 -9.081 -9.422 1.00 0.00 N ATOM 0 H GLN A 45 16.628 -9.108 -9.391 1.00 0.00 H new ATOM 0 HA GLN A 45 17.582 -8.328 -6.879 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.545 -9.950 -8.557 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.800 -8.625 -9.676 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.595 -7.776 -8.119 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.408 -9.259 -7.203 1.00 0.00 H new ATOM 0 HE21 GLN A 45 22.825 -8.284 -8.898 1.00 0.00 H new ATOM 0 HE22 GLN A 45 23.043 -9.532 -10.129 1.00 0.00 H new ATOM 681 N ASP A 46 17.793 -5.932 -9.067 1.00 0.00 N ATOM 682 CA ASP A 46 18.047 -4.528 -9.157 1.00 0.00 C ATOM 683 C ASP A 46 17.057 -3.798 -8.315 1.00 0.00 C ATOM 684 O ASP A 46 17.426 -2.764 -7.761 1.00 0.00 O ATOM 685 CB ASP A 46 17.928 -3.965 -10.584 1.00 0.00 C ATOM 686 CG ASP A 46 19.251 -4.267 -11.275 1.00 0.00 C ATOM 687 OD1 ASP A 46 20.304 -3.761 -10.803 1.00 0.00 O ATOM 688 OD2 ASP A 46 19.291 -4.852 -12.390 1.00 0.00 O ATOM 0 H ASP A 46 17.426 -6.337 -9.928 1.00 0.00 H new ATOM 0 HA ASP A 46 19.075 -4.387 -8.822 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.097 -4.428 -11.116 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.736 -2.892 -10.564 1.00 0.00 H new ATOM 693 N MET A 47 15.805 -4.276 -8.207 1.00 0.00 N ATOM 694 CA MET A 47 14.718 -3.824 -7.395 1.00 0.00 C ATOM 695 C MET A 47 15.126 -3.704 -5.966 1.00 0.00 C ATOM 696 O MET A 47 14.893 -2.640 -5.395 1.00 0.00 O ATOM 697 CB MET A 47 13.461 -4.690 -7.578 1.00 0.00 C ATOM 698 CG MET A 47 12.114 -4.106 -7.144 1.00 0.00 C ATOM 699 SD MET A 47 10.754 -5.261 -6.797 1.00 0.00 S ATOM 700 CE MET A 47 10.576 -5.992 -8.450 1.00 0.00 C ATOM 0 H MET A 47 15.523 -5.084 -8.763 1.00 0.00 H new ATOM 0 HA MET A 47 14.448 -2.824 -7.735 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.387 -4.951 -8.634 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.614 -5.620 -7.030 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.282 -3.509 -6.247 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.780 -3.422 -7.924 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.307 -7.044 -8.356 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.795 -5.465 -8.999 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.519 -5.906 -8.989 1.00 0.00 H new ATOM 710 N ILE A 48 15.708 -4.747 -5.350 1.00 0.00 N ATOM 711 CA ILE A 48 16.199 -4.763 -4.007 1.00 0.00 C ATOM 712 C ILE A 48 17.415 -3.903 -3.953 1.00 0.00 C ATOM 713 O ILE A 48 17.416 -3.107 -3.014 1.00 0.00 O ATOM 714 CB ILE A 48 16.634 -6.111 -3.513 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.431 -7.051 -3.700 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.245 -6.111 -2.102 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.632 -8.425 -3.061 1.00 0.00 C ATOM 0 H ILE A 48 15.845 -5.640 -5.823 1.00 0.00 H new ATOM 0 HA ILE A 48 15.371 -4.426 -3.384 1.00 0.00 H new ATOM 0 HB ILE A 48 17.480 -6.471 -4.098 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.544 -6.585 -3.271 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.240 -7.178 -4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.530 -7.127 -1.829 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.127 -5.471 -2.087 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.512 -5.735 -1.388 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.747 -9.038 -3.230 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.500 -8.910 -3.507 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.793 -8.308 -1.989 1.00 0.00 H new ATOM 729 N ASN A 49 18.481 -4.115 -4.745 1.00 0.00 N ATOM 730 CA ASN A 49 19.739 -3.439 -4.669 1.00 0.00 C ATOM 731 C ASN A 49 19.675 -1.950 -4.654 1.00 0.00 C ATOM 732 O ASN A 49 20.440 -1.372 -3.884 1.00 0.00 O ATOM 733 CB ASN A 49 20.713 -4.061 -5.683 1.00 0.00 C ATOM 734 CG ASN A 49 20.927 -5.507 -5.258 1.00 0.00 C ATOM 735 OD1 ASN A 49 20.663 -5.905 -4.124 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.482 -6.283 -6.228 1.00 0.00 N ATOM 0 H ASN A 49 18.461 -4.809 -5.492 1.00 0.00 H new ATOM 0 HA ASN A 49 20.148 -3.612 -3.674 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.304 -4.011 -6.692 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.658 -3.518 -5.695 1.00 0.00 H new ATOM 0 HD21 ASN A 49 21.705 -7.259 -6.035 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.675 -5.888 -7.149 1.00 0.00 H new ATOM 743 N GLU A 50 18.810 -1.276 -5.433 1.00 0.00 N ATOM 744 CA GLU A 50 18.598 0.137 -5.372 1.00 0.00 C ATOM 745 C GLU A 50 18.223 0.741 -4.063 1.00 0.00 C ATOM 746 O GLU A 50 18.575 1.873 -3.738 1.00 0.00 O ATOM 747 CB GLU A 50 17.575 0.667 -6.391 1.00 0.00 C ATOM 748 CG GLU A 50 17.906 2.124 -6.717 1.00 0.00 C ATOM 749 CD GLU A 50 16.972 2.637 -7.803 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.750 2.735 -7.512 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.401 2.990 -8.934 1.00 0.00 O ATOM 0 H GLU A 50 18.233 -1.737 -6.137 1.00 0.00 H new ATOM 0 HA GLU A 50 19.616 0.452 -5.602 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.600 0.063 -7.298 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.566 0.592 -5.986 1.00 0.00 H new ATOM 0 HG2 GLU A 50 17.808 2.737 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.941 2.206 -7.047 1.00 0.00 H new ATOM 758 N VAL A 51 17.474 -0.046 -3.270 1.00 0.00 N ATOM 759 CA VAL A 51 16.796 0.263 -2.049 1.00 0.00 C ATOM 760 C VAL A 51 17.717 -0.120 -0.942 1.00 0.00 C ATOM 761 O VAL A 51 17.825 0.594 0.054 1.00 0.00 O ATOM 762 CB VAL A 51 15.463 -0.404 -1.882 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.734 0.025 -0.598 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.656 -0.006 -3.129 1.00 0.00 C ATOM 0 H VAL A 51 17.328 -1.024 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 51 16.560 1.327 -2.050 1.00 0.00 H new ATOM 0 HB VAL A 51 15.584 -1.483 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.776 -0.491 -0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.343 -0.231 0.269 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.565 1.102 -0.618 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.665 -0.457 -3.080 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.559 1.079 -3.169 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.171 -0.357 -4.023 1.00 0.00 H new ATOM 774 N ASP A 52 18.424 -1.262 -1.007 1.00 0.00 N ATOM 775 CA ASP A 52 19.232 -1.896 -0.012 1.00 0.00 C ATOM 776 C ASP A 52 20.410 -1.043 0.312 1.00 0.00 C ATOM 777 O ASP A 52 21.446 -1.207 -0.331 1.00 0.00 O ATOM 778 CB ASP A 52 19.555 -3.338 -0.436 1.00 0.00 C ATOM 779 CG ASP A 52 20.689 -3.918 0.398 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.828 -3.574 1.602 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.372 -4.831 -0.138 1.00 0.00 O ATOM 0 H ASP A 52 18.426 -1.807 -1.869 1.00 0.00 H new ATOM 0 HA ASP A 52 18.689 -1.993 0.928 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.666 -3.959 -0.327 1.00 0.00 H new ATOM 0 HB3 ASP A 52 19.830 -3.357 -1.491 1.00 0.00 H new ATOM 786 N ALA A 53 20.372 -0.211 1.368 1.00 0.00 N ATOM 787 CA ALA A 53 21.424 0.621 1.865 1.00 0.00 C ATOM 788 C ALA A 53 22.693 -0.099 2.165 1.00 0.00 C ATOM 789 O ALA A 53 23.774 0.086 1.606 1.00 0.00 O ATOM 790 CB ALA A 53 20.980 1.333 3.154 1.00 0.00 C ATOM 0 H ALA A 53 19.523 -0.113 1.925 1.00 0.00 H new ATOM 0 HA ALA A 53 21.625 1.324 1.057 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.791 1.962 3.520 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.107 1.951 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.727 0.591 3.911 1.00 0.00 H new ATOM 796 N ASP A 54 22.659 -0.971 3.188 1.00 0.00 N ATOM 797 CA ASP A 54 23.809 -1.592 3.769 1.00 0.00 C ATOM 798 C ASP A 54 24.622 -2.411 2.828 1.00 0.00 C ATOM 799 O ASP A 54 25.851 -2.469 2.830 1.00 0.00 O ATOM 800 CB ASP A 54 23.540 -2.462 5.009 1.00 0.00 C ATOM 801 CG ASP A 54 22.535 -3.592 4.839 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.713 -4.575 4.070 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.412 -3.507 5.403 1.00 0.00 O ATOM 0 H ASP A 54 21.786 -1.257 3.632 1.00 0.00 H new ATOM 0 HA ASP A 54 24.371 -0.708 4.070 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.486 -2.893 5.335 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.191 -1.813 5.812 1.00 0.00 H new ATOM 808 N GLY A 55 24.004 -3.009 1.794 1.00 0.00 N ATOM 809 CA GLY A 55 24.590 -3.610 0.636 1.00 0.00 C ATOM 810 C GLY A 55 24.590 -5.100 0.604 1.00 0.00 C ATOM 811 O GLY A 55 25.375 -5.632 -0.180 1.00 0.00 O ATOM 0 H GLY A 55 22.987 -3.077 1.769 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.060 -3.247 -0.245 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.620 -3.264 0.553 1.00 0.00 H new ATOM 815 N ASN A 56 23.731 -5.756 1.403 1.00 0.00 N ATOM 816 CA ASN A 56 23.922 -7.157 1.617 1.00 0.00 C ATOM 817 C ASN A 56 23.305 -7.995 0.551 1.00 0.00 C ATOM 818 O ASN A 56 23.704 -9.147 0.386 1.00 0.00 O ATOM 819 CB ASN A 56 23.464 -7.560 3.029 1.00 0.00 C ATOM 820 CG ASN A 56 21.960 -7.572 3.261 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.235 -6.645 2.906 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.548 -8.822 3.603 1.00 0.00 N ATOM 0 H ASN A 56 22.934 -5.338 1.884 1.00 0.00 H new ATOM 0 HA ASN A 56 24.992 -7.353 1.550 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.854 -8.554 3.247 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.917 -6.876 3.746 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.556 -9.057 3.577 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.231 -9.525 3.885 1.00 0.00 H new ATOM 829 N GLY A 57 22.270 -7.495 -0.148 1.00 0.00 N ATOM 830 CA GLY A 57 21.493 -8.121 -1.172 1.00 0.00 C ATOM 831 C GLY A 57 20.123 -8.427 -0.673 1.00 0.00 C ATOM 832 O GLY A 57 19.425 -9.166 -1.366 1.00 0.00 O ATOM 0 H GLY A 57 21.944 -6.544 0.027 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.432 -7.467 -2.042 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.982 -9.039 -1.497 1.00 0.00 H new ATOM 836 N THR A 58 19.731 -7.892 0.497 1.00 0.00 N ATOM 837 CA THR A 58 18.373 -7.913 0.944 1.00 0.00 C ATOM 838 C THR A 58 17.909 -6.615 1.510 1.00 0.00 C ATOM 839 O THR A 58 18.681 -5.846 2.079 1.00 0.00 O ATOM 840 CB THR A 58 18.035 -9.016 1.903 1.00 0.00 C ATOM 841 OG1 THR A 58 18.815 -9.054 3.089 1.00 0.00 O ATOM 842 CG2 THR A 58 18.216 -10.404 1.266 1.00 0.00 C ATOM 0 H THR A 58 20.371 -7.435 1.146 1.00 0.00 H new ATOM 0 HA THR A 58 17.832 -8.110 0.019 1.00 0.00 H new ATOM 0 HB THR A 58 16.999 -8.791 2.156 1.00 0.00 H new ATOM 0 HG1 THR A 58 18.772 -9.951 3.480 1.00 0.00 H new ATOM 0 HG21 THR A 58 17.961 -11.174 1.994 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.563 -10.494 0.398 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.253 -10.529 0.954 1.00 0.00 H new ATOM 850 N ILE A 59 16.570 -6.484 1.484 1.00 0.00 N ATOM 851 CA ILE A 59 15.932 -5.312 1.996 1.00 0.00 C ATOM 852 C ILE A 59 15.539 -5.610 3.402 1.00 0.00 C ATOM 853 O ILE A 59 14.971 -6.632 3.784 1.00 0.00 O ATOM 854 CB ILE A 59 14.792 -4.888 1.119 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.956 -3.748 1.725 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.921 -6.120 0.822 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.089 -3.024 0.696 1.00 0.00 C ATOM 0 H ILE A 59 15.932 -7.187 1.110 1.00 0.00 H new ATOM 0 HA ILE A 59 16.604 -4.454 1.995 1.00 0.00 H new ATOM 0 HB ILE A 59 15.204 -4.484 0.194 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.316 -4.153 2.509 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.624 -3.028 2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.086 -5.830 0.184 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.520 -6.875 0.314 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.539 -6.529 1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.525 -2.232 1.188 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.725 -2.591 -0.076 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.397 -3.732 0.240 1.00 0.00 H new ATOM 869 N ASP A 60 15.989 -4.688 4.272 1.00 0.00 N ATOM 870 CA ASP A 60 15.875 -4.757 5.696 1.00 0.00 C ATOM 871 C ASP A 60 14.624 -4.054 6.099 1.00 0.00 C ATOM 872 O ASP A 60 13.925 -3.408 5.320 1.00 0.00 O ATOM 873 CB ASP A 60 17.096 -4.120 6.380 1.00 0.00 C ATOM 874 CG ASP A 60 18.208 -5.157 6.454 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.989 -5.246 5.470 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.444 -5.779 7.525 1.00 0.00 O ATOM 0 H ASP A 60 16.463 -3.840 3.960 1.00 0.00 H new ATOM 0 HA ASP A 60 15.837 -5.800 6.009 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.430 -3.246 5.820 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.833 -3.776 7.380 1.00 0.00 H new ATOM 881 N PHE A 61 14.202 -4.214 7.366 1.00 0.00 N ATOM 882 CA PHE A 61 13.157 -3.442 7.963 1.00 0.00 C ATOM 883 C PHE A 61 13.534 -2.001 8.005 1.00 0.00 C ATOM 884 O PHE A 61 12.572 -1.294 7.709 1.00 0.00 O ATOM 885 CB PHE A 61 12.797 -3.955 9.368 1.00 0.00 C ATOM 886 CG PHE A 61 11.700 -3.246 10.083 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.474 -3.227 9.461 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.882 -2.687 11.326 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.428 -2.485 9.957 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.817 -2.012 11.876 1.00 0.00 C ATOM 891 CZ PHE A 61 9.606 -1.987 11.226 1.00 0.00 C ATOM 0 H PHE A 61 14.603 -4.907 7.998 1.00 0.00 H new ATOM 0 HA PHE A 61 12.268 -3.553 7.342 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.524 -5.007 9.285 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.693 -3.906 9.987 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.329 -3.808 8.562 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.823 -2.774 11.849 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.528 -2.306 9.388 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.933 -1.501 12.820 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.756 -1.557 11.735 1.00 0.00 H new ATOM 901 N PRO A 62 14.678 -1.469 8.318 1.00 0.00 N ATOM 902 CA PRO A 62 14.977 -0.089 8.068 1.00 0.00 C ATOM 903 C PRO A 62 14.847 0.406 6.669 1.00 0.00 C ATOM 904 O PRO A 62 14.649 1.607 6.490 1.00 0.00 O ATOM 905 CB PRO A 62 16.371 0.132 8.653 1.00 0.00 C ATOM 906 CG PRO A 62 16.834 -1.183 9.299 1.00 0.00 C ATOM 907 CD PRO A 62 15.503 -1.942 9.419 1.00 0.00 C ATOM 0 HA PRO A 62 14.207 0.517 8.545 1.00 0.00 H new ATOM 0 HB2 PRO A 62 17.067 0.438 7.872 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.350 0.932 9.393 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.556 -1.714 8.679 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.305 -1.022 10.269 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.660 -3.019 9.356 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.025 -1.745 10.379 1.00 0.00 H new ATOM 915 N GLU A 63 15.052 -0.481 5.679 1.00 0.00 N ATOM 916 CA GLU A 63 15.172 -0.187 4.285 1.00 0.00 C ATOM 917 C GLU A 63 13.807 0.084 3.752 1.00 0.00 C ATOM 918 O GLU A 63 13.551 1.197 3.295 1.00 0.00 O ATOM 919 CB GLU A 63 16.081 -1.118 3.466 1.00 0.00 C ATOM 920 CG GLU A 63 17.554 -0.813 3.749 1.00 0.00 C ATOM 921 CD GLU A 63 18.477 -2.007 3.555 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.021 -3.121 3.186 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.726 -1.926 3.701 1.00 0.00 O ATOM 0 H GLU A 63 15.140 -1.479 5.869 1.00 0.00 H new ATOM 0 HA GLU A 63 15.762 0.721 4.163 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.865 -2.157 3.713 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.875 -0.994 2.403 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.880 -0.004 3.095 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.651 -0.454 4.774 1.00 0.00 H new ATOM 930 N PHE A 64 12.963 -0.947 3.935 1.00 0.00 N ATOM 931 CA PHE A 64 11.542 -0.876 3.797 1.00 0.00 C ATOM 932 C PHE A 64 10.949 0.342 4.418 1.00 0.00 C ATOM 933 O PHE A 64 10.211 1.060 3.746 1.00 0.00 O ATOM 934 CB PHE A 64 10.983 -2.229 4.272 1.00 0.00 C ATOM 935 CG PHE A 64 9.516 -2.202 4.011 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.681 -1.851 5.045 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.025 -2.863 2.910 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.329 -2.080 4.946 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.709 -3.264 2.892 1.00 0.00 C ATOM 940 CZ PHE A 64 6.870 -2.842 3.897 1.00 0.00 C ATOM 0 H PHE A 64 13.290 -1.878 4.193 1.00 0.00 H new ATOM 0 HA PHE A 64 11.247 -0.735 2.757 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.456 -3.052 3.737 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.185 -2.380 5.332 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.087 -1.395 5.936 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.667 -3.066 2.066 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.644 -1.671 5.674 1.00 0.00 H new ATOM 0 HE2 PHE A 64 7.340 -3.900 2.101 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.826 -3.116 3.862 1.00 0.00 H new ATOM 950 N LEU A 65 11.205 0.644 5.703 1.00 0.00 N ATOM 951 CA LEU A 65 10.797 1.855 6.346 1.00 0.00 C ATOM 952 C LEU A 65 11.032 3.153 5.654 1.00 0.00 C ATOM 953 O LEU A 65 10.131 3.985 5.565 1.00 0.00 O ATOM 954 CB LEU A 65 11.459 2.022 7.724 1.00 0.00 C ATOM 955 CG LEU A 65 10.674 1.334 8.853 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.402 1.422 10.205 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.293 1.912 9.204 1.00 0.00 C ATOM 0 H LEU A 65 11.719 0.017 6.321 1.00 0.00 H new ATOM 0 HA LEU A 65 9.720 1.690 6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.468 1.612 7.688 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.554 3.084 7.949 1.00 0.00 H new ATOM 0 HG LEU A 65 10.577 0.334 8.430 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.809 0.922 10.971 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.375 0.938 10.126 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.538 2.469 10.477 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.851 1.333 10.015 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.402 2.950 9.517 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.645 1.863 8.329 1.00 0.00 H new ATOM 969 N THR A 66 12.280 3.354 5.195 1.00 0.00 N ATOM 970 CA THR A 66 12.731 4.614 4.691 1.00 0.00 C ATOM 971 C THR A 66 12.124 4.790 3.341 1.00 0.00 C ATOM 972 O THR A 66 11.755 5.909 2.987 1.00 0.00 O ATOM 973 CB THR A 66 14.220 4.660 4.516 1.00 0.00 C ATOM 974 OG1 THR A 66 14.861 4.249 5.714 1.00 0.00 O ATOM 975 CG2 THR A 66 14.820 6.015 4.105 1.00 0.00 C ATOM 0 H THR A 66 12.992 2.624 5.174 1.00 0.00 H new ATOM 0 HA THR A 66 12.445 5.390 5.401 1.00 0.00 H new ATOM 0 HB THR A 66 14.402 3.984 3.680 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.739 3.284 5.836 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.902 5.920 4.011 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.398 6.325 3.149 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.586 6.762 4.864 1.00 0.00 H new ATOM 983 N MET A 67 11.839 3.706 2.597 1.00 0.00 N ATOM 984 CA MET A 67 11.146 3.794 1.349 1.00 0.00 C ATOM 985 C MET A 67 9.707 4.123 1.551 1.00 0.00 C ATOM 986 O MET A 67 9.173 5.119 1.067 1.00 0.00 O ATOM 987 CB MET A 67 11.390 2.471 0.603 1.00 0.00 C ATOM 988 CG MET A 67 10.613 2.291 -0.703 1.00 0.00 C ATOM 989 SD MET A 67 11.000 0.716 -1.523 1.00 0.00 S ATOM 990 CE MET A 67 9.948 -0.217 -0.374 1.00 0.00 C ATOM 0 H MET A 67 12.093 2.755 2.865 1.00 0.00 H new ATOM 0 HA MET A 67 11.523 4.613 0.737 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.455 2.390 0.385 1.00 0.00 H new ATOM 0 HB3 MET A 67 11.138 1.647 1.271 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.544 2.338 -0.497 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.844 3.116 -1.377 1.00 0.00 H new ATOM 0 HE1 MET A 67 10.555 -0.940 0.170 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.482 0.470 0.333 1.00 0.00 H new ATOM 0 HE3 MET A 67 9.174 -0.741 -0.934 1.00 0.00 H new ATOM 1000 N MET A 68 8.957 3.359 2.365 1.00 0.00 N ATOM 1001 CA MET A 68 7.544 3.535 2.498 1.00 0.00 C ATOM 1002 C MET A 68 7.031 4.675 3.308 1.00 0.00 C ATOM 1003 O MET A 68 6.012 5.260 2.945 1.00 0.00 O ATOM 1004 CB MET A 68 6.961 2.299 3.203 1.00 0.00 C ATOM 1005 CG MET A 68 7.046 0.980 2.431 1.00 0.00 C ATOM 1006 SD MET A 68 6.012 0.840 0.942 1.00 0.00 S ATOM 1007 CE MET A 68 4.410 0.654 1.776 1.00 0.00 C ATOM 0 H MET A 68 9.337 2.607 2.940 1.00 0.00 H new ATOM 0 HA MET A 68 7.244 3.718 1.466 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.476 2.173 4.155 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.913 2.496 3.431 1.00 0.00 H new ATOM 0 HG2 MET A 68 8.085 0.822 2.141 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.778 0.170 3.109 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.657 0.340 1.053 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.494 -0.097 2.561 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.116 1.607 2.215 1.00 0.00 H new ATOM 1017 N ALA A 69 7.698 5.112 4.391 1.00 0.00 N ATOM 1018 CA ALA A 69 7.289 6.201 5.222 1.00 0.00 C ATOM 1019 C ALA A 69 7.499 7.558 4.644 1.00 0.00 C ATOM 1020 O ALA A 69 7.379 8.534 5.383 1.00 0.00 O ATOM 1021 CB ALA A 69 8.127 5.934 6.484 1.00 0.00 C ATOM 0 H ALA A 69 8.569 4.682 4.703 1.00 0.00 H new ATOM 0 HA ALA A 69 6.212 6.228 5.387 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.918 6.702 7.229 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.871 4.956 6.890 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.186 5.955 6.228 1.00 0.00 H new ATOM 1027 N ARG A 70 8.016 7.632 3.405 1.00 0.00 N ATOM 1028 CA ARG A 70 8.089 8.860 2.676 1.00 0.00 C ATOM 1029 C ARG A 70 6.864 9.177 1.889 1.00 0.00 C ATOM 1030 O ARG A 70 6.454 8.425 1.007 1.00 0.00 O ATOM 1031 CB ARG A 70 9.179 8.543 1.638 1.00 0.00 C ATOM 1032 CG ARG A 70 9.598 9.569 0.584 1.00 0.00 C ATOM 1033 CD ARG A 70 10.799 9.125 -0.254 1.00 0.00 C ATOM 1034 NE ARG A 70 10.773 9.834 -1.564 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.670 9.620 -2.570 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.877 9.022 -2.353 1.00 0.00 N ATOM 1037 NH2 ARG A 70 11.527 10.147 -3.821 1.00 0.00 N ATOM 0 H ARG A 70 8.389 6.827 2.901 1.00 0.00 H new ATOM 0 HA ARG A 70 8.250 9.696 3.356 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.077 8.274 2.193 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.856 7.651 1.102 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.754 9.763 -0.078 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.838 10.510 1.079 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.727 9.345 0.274 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.770 8.047 -0.410 1.00 0.00 H new ATOM 0 HE ARG A 70 10.038 10.524 -1.719 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.134 8.718 -1.414 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.522 8.879 -3.130 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.720 10.732 -4.039 1.00 0.00 H new ATOM 0 HH22 ARG A 70 12.227 9.956 -4.538 1.00 0.00 H new ATOM 1051 N LYS A 71 6.301 10.354 2.216 1.00 0.00 N ATOM 1052 CA LYS A 71 5.128 10.902 1.609 1.00 0.00 C ATOM 1053 C LYS A 71 5.267 11.184 0.153 1.00 0.00 C ATOM 1054 O LYS A 71 6.135 11.937 -0.286 1.00 0.00 O ATOM 1055 CB LYS A 71 4.685 12.215 2.276 1.00 0.00 C ATOM 1056 CG LYS A 71 3.194 12.544 2.165 1.00 0.00 C ATOM 1057 CD LYS A 71 2.261 11.556 2.868 1.00 0.00 C ATOM 1058 CE LYS A 71 0.786 11.855 2.595 1.00 0.00 C ATOM 1059 NZ LYS A 71 -0.056 10.702 2.985 1.00 0.00 N ATOM 0 H LYS A 71 6.686 10.956 2.944 1.00 0.00 H new ATOM 0 HA LYS A 71 4.384 10.118 1.751 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.952 12.173 3.332 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.253 13.035 1.836 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.025 13.538 2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.924 12.588 1.110 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.491 10.544 2.537 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.443 11.589 3.942 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.479 12.741 3.150 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.643 12.076 1.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -1.055 10.921 2.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.226 9.865 2.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.068 10.509 3.999 1.00 0.00 H new ATOM 1073 N MET A 72 4.342 10.652 -0.665 1.00 0.00 N ATOM 1074 CA MET A 72 4.390 10.852 -2.080 1.00 0.00 C ATOM 1075 C MET A 72 3.674 12.076 -2.538 1.00 0.00 C ATOM 1076 O MET A 72 2.943 12.725 -1.791 1.00 0.00 O ATOM 1077 CB MET A 72 3.866 9.659 -2.897 1.00 0.00 C ATOM 1078 CG MET A 72 4.430 8.352 -2.336 1.00 0.00 C ATOM 1079 SD MET A 72 3.814 6.950 -3.315 1.00 0.00 S ATOM 1080 CE MET A 72 5.129 6.951 -4.568 1.00 0.00 C ATOM 0 H MET A 72 3.559 10.082 -0.346 1.00 0.00 H new ATOM 0 HA MET A 72 5.457 10.970 -2.269 1.00 0.00 H new ATOM 0 HB2 MET A 72 2.777 9.637 -2.866 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.153 9.769 -3.943 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.519 8.374 -2.360 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.137 8.236 -1.293 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.812 6.361 -5.428 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.330 7.975 -4.884 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.035 6.518 -4.145 1.00 0.00 H new ATOM 1090 N LYS A 73 3.793 12.382 -3.842 1.00 0.00 N ATOM 1091 CA LYS A 73 3.030 13.466 -4.379 1.00 0.00 C ATOM 1092 C LYS A 73 1.644 13.011 -4.679 1.00 0.00 C ATOM 1093 O LYS A 73 1.353 11.824 -4.545 1.00 0.00 O ATOM 1094 CB LYS A 73 3.789 14.141 -5.534 1.00 0.00 C ATOM 1095 CG LYS A 73 3.420 15.600 -5.808 1.00 0.00 C ATOM 1096 CD LYS A 73 4.110 16.324 -6.966 1.00 0.00 C ATOM 1097 CE LYS A 73 4.108 15.634 -8.332 1.00 0.00 C ATOM 1098 NZ LYS A 73 2.754 15.673 -8.929 1.00 0.00 N ATOM 0 H LYS A 73 4.396 11.897 -4.506 1.00 0.00 H new ATOM 0 HA LYS A 73 2.907 14.262 -3.644 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.857 14.089 -5.322 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.617 13.565 -6.443 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.345 15.642 -5.984 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.616 16.168 -4.898 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.638 17.300 -7.081 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.147 16.503 -6.681 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.819 16.126 -8.996 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.435 14.600 -8.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 2.707 15.009 -9.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.051 15.403 -8.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 2.551 16.635 -9.267 1.00 0.00 H new ATOM 1112 N ASP A 74 0.743 13.903 -5.131 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.630 13.815 -5.520 1.00 0.00 C ATOM 1114 C ASP A 74 -0.971 12.632 -6.360 1.00 0.00 C ATOM 1115 O ASP A 74 -1.621 11.651 -6.002 1.00 0.00 O ATOM 1116 CB ASP A 74 -1.201 15.128 -6.081 1.00 0.00 C ATOM 1117 CG ASP A 74 -0.170 15.867 -6.921 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.102 15.337 -8.031 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.419 16.848 -6.393 1.00 0.00 O ATOM 0 H ASP A 74 1.050 14.870 -5.240 1.00 0.00 H new ATOM 0 HA ASP A 74 -1.148 13.640 -4.577 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.081 14.914 -6.687 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.527 15.765 -5.259 1.00 0.00 H new ATOM 1124 N THR A 75 -0.502 12.615 -7.620 1.00 0.00 N ATOM 1125 CA THR A 75 -0.831 11.554 -8.520 1.00 0.00 C ATOM 1126 C THR A 75 -0.295 10.204 -8.187 1.00 0.00 C ATOM 1127 O THR A 75 -0.916 9.163 -8.396 1.00 0.00 O ATOM 1128 CB THR A 75 -0.504 11.697 -9.977 1.00 0.00 C ATOM 1129 OG1 THR A 75 0.771 12.244 -10.278 1.00 0.00 O ATOM 1130 CG2 THR A 75 -1.460 12.772 -10.521 1.00 0.00 C ATOM 0 H THR A 75 0.104 13.334 -8.015 1.00 0.00 H new ATOM 0 HA THR A 75 -1.906 11.645 -8.363 1.00 0.00 H new ATOM 0 HB THR A 75 -0.564 10.690 -10.390 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.885 12.293 -11.250 1.00 0.00 H new ATOM 0 HG21 THR A 75 -1.271 12.923 -11.584 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.491 12.448 -10.378 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.297 13.708 -9.987 1.00 0.00 H new ATOM 1138 N ASP A 76 0.872 10.236 -7.519 1.00 0.00 N ATOM 1139 CA ASP A 76 1.645 9.131 -7.045 1.00 0.00 C ATOM 1140 C ASP A 76 0.939 8.384 -5.965 1.00 0.00 C ATOM 1141 O ASP A 76 1.012 7.162 -5.844 1.00 0.00 O ATOM 1142 CB ASP A 76 3.065 9.602 -6.689 1.00 0.00 C ATOM 1143 CG ASP A 76 3.817 10.179 -7.880 1.00 0.00 C ATOM 1144 OD1 ASP A 76 3.801 9.683 -9.038 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.512 11.179 -7.556 1.00 0.00 O ATOM 0 H ASP A 76 1.316 11.125 -7.290 1.00 0.00 H new ATOM 0 HA ASP A 76 1.761 8.394 -7.840 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.006 10.356 -5.904 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.629 8.762 -6.282 1.00 0.00 H new ATOM 1150 N SER A 77 0.199 9.083 -5.087 1.00 0.00 N ATOM 1151 CA SER A 77 -0.590 8.595 -3.998 1.00 0.00 C ATOM 1152 C SER A 77 -1.848 8.007 -4.536 1.00 0.00 C ATOM 1153 O SER A 77 -2.276 6.945 -4.085 1.00 0.00 O ATOM 1154 CB SER A 77 -0.901 9.675 -2.948 1.00 0.00 C ATOM 1155 OG SER A 77 0.279 10.151 -2.316 1.00 0.00 O ATOM 0 H SER A 77 0.150 10.100 -5.149 1.00 0.00 H new ATOM 0 HA SER A 77 -0.007 7.833 -3.481 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.419 10.507 -3.425 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.577 9.267 -2.196 1.00 0.00 H new ATOM 0 HG SER A 77 0.752 10.760 -2.921 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.469 8.585 -5.580 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.605 7.992 -6.215 1.00 0.00 C ATOM 1163 C GLU A 78 -3.243 6.652 -6.759 1.00 0.00 C ATOM 1164 O GLU A 78 -3.914 5.639 -6.572 1.00 0.00 O ATOM 1165 CB GLU A 78 -4.181 8.887 -7.325 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.571 8.488 -7.823 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.703 8.896 -6.891 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.910 10.137 -6.835 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -7.326 8.029 -6.222 1.00 0.00 O ATOM 0 H GLU A 78 -2.180 9.474 -5.988 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.383 7.877 -5.460 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.224 9.912 -6.958 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.493 8.879 -8.170 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.739 8.939 -8.801 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.600 7.407 -7.961 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.128 6.642 -7.512 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.520 5.546 -8.200 1.00 0.00 C ATOM 1178 C GLU A 79 -1.161 4.462 -7.242 1.00 0.00 C ATOM 1179 O GLU A 79 -1.499 3.340 -7.613 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.259 6.032 -8.933 1.00 0.00 C ATOM 1181 CG GLU A 79 0.092 5.068 -10.067 1.00 0.00 C ATOM 1182 CD GLU A 79 1.289 5.478 -10.914 1.00 0.00 C ATOM 1183 OE1 GLU A 79 2.391 5.658 -10.331 1.00 0.00 O ATOM 1184 OE2 GLU A 79 1.123 5.690 -12.145 1.00 0.00 O ATOM 0 H GLU A 79 -1.596 7.501 -7.652 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.231 5.148 -8.924 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.424 7.032 -9.333 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.574 6.102 -8.233 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.288 4.085 -9.640 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.776 4.965 -10.718 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.498 4.715 -6.099 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.177 3.733 -5.110 1.00 0.00 C ATOM 1193 C GLU A 80 -1.307 2.818 -4.782 1.00 0.00 C ATOM 1194 O GLU A 80 -1.255 1.597 -4.924 1.00 0.00 O ATOM 1195 CB GLU A 80 0.265 4.381 -3.788 1.00 0.00 C ATOM 1196 CG GLU A 80 1.015 3.486 -2.798 1.00 0.00 C ATOM 1197 CD GLU A 80 0.934 4.134 -1.423 1.00 0.00 C ATOM 1198 OE1 GLU A 80 -0.239 4.240 -0.977 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.984 4.439 -0.796 1.00 0.00 O ATOM 0 H GLU A 80 -0.170 5.649 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 80 0.631 3.158 -5.562 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.901 5.234 -4.024 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.621 4.772 -3.288 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.574 2.489 -2.776 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.055 3.368 -3.103 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.441 3.395 -4.345 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.645 2.682 -4.054 1.00 0.00 C ATOM 1208 C ILE A 81 -4.241 2.010 -5.242 1.00 0.00 C ATOM 1209 O ILE A 81 -4.575 0.828 -5.311 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.525 3.658 -3.330 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.825 4.464 -2.223 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.714 2.871 -2.753 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.649 5.705 -1.881 1.00 0.00 C ATOM 0 H ILE A 81 -2.522 4.400 -4.188 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.467 1.819 -3.413 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.842 4.410 -4.052 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.699 3.845 -1.335 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.828 4.758 -2.551 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.376 3.552 -2.218 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.263 2.394 -3.565 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.347 2.108 -2.066 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.147 6.270 -1.096 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.752 6.329 -2.769 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.637 5.402 -1.534 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.642 2.757 -6.287 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.191 2.222 -7.494 1.00 0.00 C ATOM 1227 C ARG A 82 -4.463 1.118 -8.181 1.00 0.00 C ATOM 1228 O ARG A 82 -5.043 0.202 -8.761 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.344 3.332 -8.547 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.452 3.016 -9.554 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.705 4.086 -10.617 1.00 0.00 C ATOM 1232 NE ARG A 82 -7.756 3.607 -11.558 1.00 0.00 N ATOM 1233 CZ ARG A 82 -9.075 3.777 -11.249 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -9.536 4.262 -10.060 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -10.015 3.261 -12.094 1.00 0.00 N ATOM 0 H ARG A 82 -4.581 3.775 -6.290 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.124 1.793 -7.130 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.565 4.276 -8.049 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.400 3.463 -9.076 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.205 2.081 -10.057 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.379 2.848 -9.006 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -7.020 5.017 -10.145 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.785 4.300 -11.160 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.491 3.153 -12.432 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.877 4.526 -9.327 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.539 4.360 -9.904 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -9.726 2.761 -12.935 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.007 3.375 -11.884 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.119 1.138 -8.226 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.322 0.021 -8.628 1.00 0.00 C ATOM 1251 C GLU A 83 -2.478 -1.156 -7.728 1.00 0.00 C ATOM 1252 O GLU A 83 -2.484 -2.296 -8.190 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.826 0.348 -8.767 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.511 1.212 -9.990 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.860 0.404 -11.233 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.080 -0.485 -11.667 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.975 0.563 -11.797 1.00 0.00 O ATOM 0 H GLU A 83 -2.569 1.959 -7.974 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.708 -0.232 -9.615 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.488 0.864 -7.868 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.261 -0.582 -8.832 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.086 2.138 -9.962 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.543 1.491 -9.999 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.638 -0.944 -6.409 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.012 -1.934 -5.448 1.00 0.00 C ATOM 1266 C ALA A 84 -4.375 -2.424 -5.798 1.00 0.00 C ATOM 1267 O ALA A 84 -4.446 -3.649 -5.726 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.900 -1.389 -4.014 1.00 0.00 C ATOM 0 H ALA A 84 -2.497 -0.025 -5.989 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.327 -2.781 -5.478 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.191 -2.165 -3.306 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.871 -1.087 -3.819 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.559 -0.528 -3.900 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.378 -1.582 -6.109 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.632 -1.988 -6.664 1.00 0.00 C ATOM 1276 C PHE A 85 -6.574 -2.966 -7.786 1.00 0.00 C ATOM 1277 O PHE A 85 -7.318 -3.944 -7.850 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.513 -0.794 -7.065 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.977 -1.049 -6.958 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.547 -1.214 -5.718 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.741 -1.171 -8.095 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.893 -1.470 -5.600 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.057 -1.550 -7.976 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.652 -1.612 -6.738 1.00 0.00 C ATOM 0 H PHE A 85 -5.311 -0.574 -5.967 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.087 -2.525 -5.832 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.258 0.059 -6.436 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.279 -0.514 -8.092 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.934 -1.142 -4.832 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.314 -0.972 -9.067 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.349 -1.559 -4.625 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.626 -1.800 -8.859 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.717 -1.772 -6.659 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.582 -2.805 -8.680 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.334 -3.653 -9.804 1.00 0.00 C ATOM 1296 C ARG A 86 -4.751 -4.965 -9.405 1.00 0.00 C ATOM 1297 O ARG A 86 -4.662 -5.869 -10.234 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.367 -3.035 -10.829 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.978 -1.813 -11.517 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.535 -1.771 -12.981 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.066 -1.540 -13.077 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.210 -2.253 -13.865 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.540 -3.465 -14.397 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -0.898 -1.892 -13.748 1.00 0.00 N ATOM 0 H ARG A 86 -4.914 -2.037 -8.613 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.318 -3.786 -10.255 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.442 -2.747 -10.329 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.105 -3.782 -11.579 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -6.066 -1.856 -11.457 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.666 -0.902 -11.006 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.794 -2.709 -13.472 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.068 -0.978 -13.506 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.670 -0.791 -12.510 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.457 -3.871 -14.211 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -1.870 -3.965 -14.981 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.630 -1.143 -13.109 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.186 -2.371 -14.299 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.364 -5.284 -8.157 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.052 -6.636 -7.814 1.00 0.00 C ATOM 1320 C VAL A 87 -5.229 -7.258 -7.146 1.00 0.00 C ATOM 1321 O VAL A 87 -5.381 -8.479 -7.136 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.939 -6.671 -6.809 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.611 -8.071 -6.263 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.651 -6.055 -7.380 1.00 0.00 C ATOM 0 H VAL A 87 -4.268 -4.614 -7.394 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.775 -7.161 -8.728 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.315 -6.079 -5.974 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.795 -7.999 -5.544 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.492 -8.486 -5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.314 -8.722 -7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.864 -6.095 -6.627 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.339 -6.615 -8.262 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.836 -5.017 -7.656 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.140 -6.469 -6.549 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.225 -6.882 -5.713 1.00 0.00 C ATOM 1336 C PHE A 88 -8.262 -7.412 -6.642 1.00 0.00 C ATOM 1337 O PHE A 88 -8.778 -8.486 -6.337 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.765 -5.694 -4.900 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.313 -5.711 -3.480 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.704 -6.712 -2.621 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.342 -4.828 -3.072 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.025 -6.888 -1.438 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.708 -4.921 -1.855 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.032 -6.008 -1.078 1.00 0.00 C ATOM 0 H PHE A 88 -6.114 -5.456 -6.662 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.917 -7.635 -4.988 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.443 -4.764 -5.368 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.855 -5.705 -4.930 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.536 -7.353 -2.873 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.064 -4.024 -3.738 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.272 -7.717 -0.792 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.994 -4.180 -1.527 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.491 -6.175 -0.158 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.777 -6.710 -7.667 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.773 -7.187 -8.576 1.00 0.00 C ATOM 1356 C ASP A 89 -9.200 -8.083 -9.620 1.00 0.00 C ATOM 1357 O ASP A 89 -8.302 -7.666 -10.348 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.371 -5.923 -9.215 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.524 -6.282 -10.141 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.870 -7.478 -10.331 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.124 -5.378 -10.783 1.00 0.00 O ATOM 0 H ASP A 89 -8.481 -5.756 -7.873 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.521 -7.786 -8.057 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.721 -5.246 -8.436 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.600 -5.393 -9.775 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.542 -9.383 -9.683 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.802 -10.373 -10.402 1.00 0.00 C ATOM 1368 C LYS A 90 -9.201 -10.434 -11.836 1.00 0.00 C ATOM 1369 O LYS A 90 -8.309 -10.500 -12.681 1.00 0.00 O ATOM 1370 CB LYS A 90 -8.941 -11.835 -9.945 1.00 0.00 C ATOM 1371 CG LYS A 90 -7.851 -12.740 -10.522 1.00 0.00 C ATOM 1372 CD LYS A 90 -6.385 -12.348 -10.326 1.00 0.00 C ATOM 1373 CE LYS A 90 -5.491 -13.480 -10.836 1.00 0.00 C ATOM 1374 NZ LYS A 90 -4.108 -13.309 -10.339 1.00 0.00 N ATOM 0 H LYS A 90 -10.366 -9.759 -9.214 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.786 -10.026 -10.213 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.903 -11.876 -8.856 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.918 -12.214 -10.245 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.987 -13.733 -10.094 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.028 -12.828 -11.594 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.167 -11.426 -10.864 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.185 -12.157 -9.272 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.886 -14.441 -10.506 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.494 -13.491 -11.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.513 -14.085 -10.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.728 -12.401 -10.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.109 -13.321 -9.299 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.506 -10.304 -12.133 1.00 0.00 N ATOM 1389 CA ASP A 91 -10.962 -10.192 -13.484 1.00 0.00 C ATOM 1390 C ASP A 91 -10.945 -8.799 -14.013 1.00 0.00 C ATOM 1391 O ASP A 91 -10.591 -8.609 -15.175 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.274 -10.983 -13.612 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.446 -10.442 -12.805 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.344 -9.346 -12.193 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.484 -11.151 -12.891 1.00 0.00 O ATOM 0 H ASP A 91 -11.249 -10.276 -11.434 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.253 -10.655 -14.170 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.561 -11.010 -14.663 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.089 -12.013 -13.306 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.121 -7.744 -13.198 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.766 -6.411 -13.574 1.00 0.00 C ATOM 1402 C GLY A 92 -11.989 -5.683 -14.017 1.00 0.00 C ATOM 1403 O GLY A 92 -11.790 -4.899 -14.943 1.00 0.00 O ATOM 0 H GLY A 92 -11.517 -7.818 -12.261 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.306 -5.894 -12.732 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.030 -6.431 -14.377 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.185 -5.976 -13.475 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.400 -5.291 -13.792 1.00 0.00 C ATOM 1409 C ASN A 93 -14.551 -4.001 -13.061 1.00 0.00 C ATOM 1410 O ASN A 93 -15.449 -3.278 -13.489 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.624 -6.213 -13.676 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.830 -6.839 -12.303 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.932 -7.157 -11.525 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.122 -7.099 -11.970 1.00 0.00 N ATOM 0 H ASN A 93 -13.310 -6.720 -12.788 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.336 -5.007 -14.842 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.516 -5.643 -13.936 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.530 -7.011 -14.412 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.338 -7.553 -11.083 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.875 -6.840 -12.607 1.00 0.00 H new ATOM 1421 N GLY A 94 -13.764 -3.651 -12.028 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.990 -2.509 -11.197 1.00 0.00 C ATOM 1423 C GLY A 94 -14.196 -2.838 -9.758 1.00 0.00 C ATOM 1424 O GLY A 94 -14.512 -1.939 -8.981 1.00 0.00 O ATOM 0 H GLY A 94 -12.937 -4.185 -11.761 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.139 -1.833 -11.287 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.864 -1.972 -11.565 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.288 -4.148 -9.467 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.985 -4.639 -8.319 1.00 0.00 C ATOM 1430 C TYR A 95 -14.208 -5.815 -7.835 1.00 0.00 C ATOM 1431 O TYR A 95 -14.010 -6.777 -8.576 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.407 -5.142 -8.619 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.250 -3.984 -9.029 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.672 -3.125 -8.042 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.524 -3.715 -10.349 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.370 -1.978 -8.337 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.193 -2.544 -10.617 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.649 -1.679 -9.650 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.332 -0.497 -10.007 1.00 0.00 O ATOM 0 H TYR A 95 -13.870 -4.881 -10.041 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.074 -3.820 -7.605 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.383 -5.890 -9.411 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.831 -5.624 -7.738 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.450 -3.357 -7.011 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.228 -4.391 -11.138 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -18.696 -1.319 -7.546 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -18.371 -2.288 -11.651 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.435 -0.460 -10.981 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.846 -5.804 -6.540 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.368 -6.922 -5.788 1.00 0.00 C ATOM 1451 C ILE A 96 -14.504 -7.725 -5.255 1.00 0.00 C ATOM 1452 O ILE A 96 -15.312 -7.249 -4.459 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.454 -6.471 -4.687 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.696 -5.157 -4.938 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.544 -7.600 -4.173 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.075 -4.496 -3.708 1.00 0.00 C ATOM 0 H ILE A 96 -13.891 -4.953 -5.980 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.793 -7.563 -6.455 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.137 -6.213 -3.878 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.904 -5.350 -5.661 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.382 -4.447 -5.400 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.904 -7.218 -3.378 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.157 -8.414 -3.786 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -10.925 -7.969 -4.991 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.567 -3.578 -4.005 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.858 -4.260 -2.987 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.356 -5.177 -3.253 1.00 0.00 H new ATOM 1468 N SER A 97 -14.660 -8.985 -5.699 1.00 0.00 N ATOM 1469 CA SER A 97 -15.552 -9.925 -5.095 1.00 0.00 C ATOM 1470 C SER A 97 -14.825 -10.703 -4.053 1.00 0.00 C ATOM 1471 O SER A 97 -13.638 -10.524 -3.784 1.00 0.00 O ATOM 1472 CB SER A 97 -16.102 -10.886 -6.164 1.00 0.00 C ATOM 1473 OG SER A 97 -16.967 -10.262 -7.101 1.00 0.00 O ATOM 0 H SER A 97 -14.152 -9.360 -6.500 1.00 0.00 H new ATOM 0 HA SER A 97 -16.382 -9.387 -4.636 1.00 0.00 H new ATOM 0 HB2 SER A 97 -15.266 -11.337 -6.699 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.639 -11.696 -5.670 1.00 0.00 H new ATOM 0 HG SER A 97 -17.279 -10.926 -7.751 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.541 -11.577 -3.322 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.368 -12.228 -2.061 1.00 0.00 C ATOM 1481 C ALA A 98 -14.249 -13.209 -2.143 1.00 0.00 C ATOM 1482 O ALA A 98 -13.453 -13.288 -1.209 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.600 -13.036 -1.620 1.00 0.00 C ATOM 0 H ALA A 98 -16.432 -11.884 -3.713 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.180 -11.427 -1.346 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.402 -13.504 -0.656 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.459 -12.371 -1.531 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.814 -13.807 -2.361 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.062 -13.875 -3.297 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.133 -14.946 -3.482 1.00 0.00 C ATOM 1491 C ALA A 99 -11.866 -14.418 -4.060 1.00 0.00 C ATOM 1492 O ALA A 99 -10.775 -14.914 -3.782 1.00 0.00 O ATOM 1493 CB ALA A 99 -13.780 -15.898 -4.502 1.00 0.00 C ATOM 0 H ALA A 99 -14.586 -13.655 -4.144 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.908 -15.442 -2.538 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.114 -16.741 -4.686 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.728 -16.264 -4.108 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -13.957 -15.365 -5.436 1.00 0.00 H new ATOM 1499 N GLU A 100 -11.897 -13.242 -4.712 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.770 -12.536 -5.238 1.00 0.00 C ATOM 1501 C GLU A 100 -9.981 -12.084 -4.058 1.00 0.00 C ATOM 1502 O GLU A 100 -8.757 -12.202 -4.022 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.128 -11.387 -6.195 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.913 -11.744 -7.459 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.418 -10.575 -8.293 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.075 -9.649 -7.747 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.242 -10.564 -9.540 1.00 0.00 O ATOM 0 H GLU A 100 -12.774 -12.750 -4.883 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.186 -13.198 -5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.705 -10.650 -5.636 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.201 -10.901 -6.500 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.279 -12.366 -8.091 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.770 -12.353 -7.169 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.660 -11.639 -2.985 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.181 -11.175 -1.720 1.00 0.00 C ATOM 1516 C LEU A 101 -9.483 -12.289 -1.019 1.00 0.00 C ATOM 1517 O LEU A 101 -8.307 -12.273 -0.659 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.302 -10.548 -0.874 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.872 -10.143 0.546 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.723 -9.122 0.494 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.055 -9.651 1.398 1.00 0.00 C ATOM 0 H LEU A 101 -11.679 -11.602 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.462 -10.372 -1.884 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.682 -9.667 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.127 -11.257 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.498 -11.036 1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.433 -8.848 1.509 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.869 -9.561 -0.021 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.051 -8.232 -0.042 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.699 -9.377 2.391 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.509 -8.781 0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.796 -10.445 1.484 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.179 -13.435 -0.914 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.695 -14.655 -0.346 1.00 0.00 C ATOM 1535 C ARG A 102 -8.470 -15.195 -0.999 1.00 0.00 C ATOM 1536 O ARG A 102 -7.597 -15.755 -0.338 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.796 -15.723 -0.459 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.601 -17.035 0.304 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.848 -17.919 0.234 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.920 -18.847 1.397 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.030 -19.099 2.151 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.195 -18.412 1.967 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -13.008 -20.220 2.930 1.00 0.00 N ATOM 0 H ARG A 102 -11.140 -13.514 -1.247 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.432 -14.424 0.686 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.731 -15.276 -0.122 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.920 -15.965 -1.514 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.749 -17.574 -0.110 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.366 -16.819 1.346 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.740 -17.292 0.210 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.837 -18.494 -0.692 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.063 -19.338 1.653 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.253 -17.688 1.251 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.008 -18.622 2.546 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.187 -20.825 2.930 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.813 -20.453 3.512 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.217 -14.970 -2.301 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.070 -15.360 -3.060 1.00 0.00 C ATOM 1559 C HIS A 103 -5.915 -14.444 -2.846 1.00 0.00 C ATOM 1560 O HIS A 103 -4.785 -14.910 -2.707 1.00 0.00 O ATOM 1561 CB HIS A 103 -7.471 -15.280 -4.542 1.00 0.00 C ATOM 1562 CG HIS A 103 -6.646 -16.154 -5.439 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -5.285 -15.978 -5.588 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.976 -17.278 -6.131 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -4.861 -17.043 -6.319 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.841 -17.859 -6.659 1.00 0.00 N ATOM 0 H HIS A 103 -8.887 -14.462 -2.879 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.764 -16.360 -2.752 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.520 -15.560 -4.641 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.384 -14.246 -4.877 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.979 -17.660 -6.250 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.829 -17.205 -6.593 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.774 -18.726 -7.193 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.099 -13.111 -2.851 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.111 -12.135 -2.509 1.00 0.00 C ATOM 1576 C VAL A 104 -4.621 -12.253 -1.107 1.00 0.00 C ATOM 1577 O VAL A 104 -3.431 -12.097 -0.836 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.542 -10.732 -2.816 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.547 -9.620 -2.446 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.911 -10.566 -4.300 1.00 0.00 C ATOM 0 H VAL A 104 -6.992 -12.690 -3.109 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.265 -12.362 -3.157 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.409 -10.602 -2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.968 -8.651 -2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.353 -9.647 -1.374 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.613 -9.773 -2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.218 -9.537 -4.486 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.046 -10.803 -4.919 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.731 -11.240 -4.549 1.00 0.00 H new ATOM 1590 N MET A 105 -5.531 -12.689 -0.219 1.00 0.00 N ATOM 1591 CA MET A 105 -5.157 -13.053 1.112 1.00 0.00 C ATOM 1592 C MET A 105 -4.260 -14.243 1.143 1.00 0.00 C ATOM 1593 O MET A 105 -3.172 -14.191 1.715 1.00 0.00 O ATOM 1594 CB MET A 105 -6.458 -13.360 1.873 1.00 0.00 C ATOM 1595 CG MET A 105 -7.080 -12.074 2.421 1.00 0.00 C ATOM 1596 SD MET A 105 -6.145 -11.140 3.669 1.00 0.00 S ATOM 1597 CE MET A 105 -7.562 -10.073 4.057 1.00 0.00 C ATOM 0 H MET A 105 -6.525 -12.790 -0.422 1.00 0.00 H new ATOM 0 HA MET A 105 -4.601 -12.235 1.569 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.165 -13.858 1.209 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.252 -14.048 2.693 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.269 -11.409 1.578 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.049 -12.328 2.850 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.340 -9.482 4.946 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.756 -9.406 3.217 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.442 -10.689 4.242 1.00 0.00 H new ATOM 1607 N THR A 106 -4.662 -15.239 0.334 1.00 0.00 N ATOM 1608 CA THR A 106 -3.978 -16.494 0.272 1.00 0.00 C ATOM 1609 C THR A 106 -2.629 -16.374 -0.348 1.00 0.00 C ATOM 1610 O THR A 106 -1.712 -17.060 0.101 1.00 0.00 O ATOM 1611 CB THR A 106 -4.770 -17.513 -0.491 1.00 0.00 C ATOM 1612 OG1 THR A 106 -5.980 -18.008 0.065 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.073 -18.882 -0.558 1.00 0.00 C ATOM 0 H THR A 106 -5.471 -15.174 -0.284 1.00 0.00 H new ATOM 0 HA THR A 106 -3.860 -16.820 1.305 1.00 0.00 H new ATOM 0 HB THR A 106 -4.907 -16.922 -1.397 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.679 -17.325 -0.011 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.693 -19.579 -1.122 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.107 -18.775 -1.051 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.924 -19.264 0.452 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.481 -15.453 -1.317 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.167 -15.296 -1.858 1.00 0.00 C ATOM 1623 C ASN A 107 -0.093 -14.837 -0.932 1.00 0.00 C ATOM 1624 O ASN A 107 1.024 -15.352 -0.894 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.386 -14.376 -3.071 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.257 -15.028 -4.135 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.285 -16.388 -4.129 1.00 0.00 O flip ATOM 1628 ND2 ASN A 107 -2.863 -14.314 -4.932 1.00 0.00 N flip ATOM 0 H ASN A 107 -3.212 -14.856 -1.704 1.00 0.00 H new ATOM 0 HA ASN A 107 -0.750 -16.270 -2.116 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.852 -13.447 -2.741 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.421 -14.113 -3.504 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.788 -13.299 -4.867 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.441 -14.737 -5.658 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.430 -13.877 -0.052 1.00 0.00 N ATOM 1636 CA LEU A 108 0.417 -13.428 1.009 1.00 0.00 C ATOM 1637 C LEU A 108 0.542 -14.380 2.148 1.00 0.00 C ATOM 1638 O LEU A 108 1.569 -14.356 2.825 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.172 -12.111 1.541 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.098 -10.942 0.544 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.931 -9.741 1.022 1.00 0.00 C ATOM 1642 CD2 LEU A 108 1.372 -10.511 0.401 1.00 0.00 C ATOM 0 H LEU A 108 -1.328 -13.395 -0.081 1.00 0.00 H new ATOM 0 HA LEU A 108 1.419 -13.319 0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.214 -12.276 1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.356 -11.831 2.452 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.502 -11.275 -0.412 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.856 -8.933 0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.974 -10.040 1.126 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.554 -9.397 1.985 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.441 -9.682 -0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.755 -10.195 1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.963 -11.350 0.033 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.392 -15.319 2.382 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.190 -16.429 3.261 1.00 0.00 C ATOM 1656 C GLY A 109 -1.261 -16.620 4.279 1.00 0.00 C ATOM 1657 O GLY A 109 -1.170 -17.518 5.114 1.00 0.00 O ATOM 0 H GLY A 109 -1.315 -15.306 1.947 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.109 -17.337 2.664 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.762 -16.299 3.775 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.400 -15.920 4.126 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.474 -16.024 5.065 1.00 0.00 C ATOM 1663 C GLU A 110 -4.545 -16.993 4.700 1.00 0.00 C ATOM 1664 O GLU A 110 -5.108 -16.916 3.609 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.139 -14.638 5.102 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.330 -13.481 5.691 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.997 -13.548 7.175 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.978 -13.413 7.954 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -1.823 -13.624 7.625 1.00 0.00 O ATOM 0 H GLU A 110 -2.577 -15.281 3.351 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.045 -16.371 6.005 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.415 -14.370 4.082 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.065 -14.724 5.671 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.394 -13.408 5.138 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.880 -12.558 5.510 1.00 0.00 H new ATOM 1676 N LYS A 111 -5.050 -17.770 5.674 1.00 0.00 N ATOM 1677 CA LYS A 111 -6.216 -18.593 5.578 1.00 0.00 C ATOM 1678 C LYS A 111 -7.419 -17.992 6.220 1.00 0.00 C ATOM 1679 O LYS A 111 -7.561 -17.907 7.439 1.00 0.00 O ATOM 1680 CB LYS A 111 -5.961 -19.952 6.252 1.00 0.00 C ATOM 1681 CG LYS A 111 -7.062 -20.995 6.050 1.00 0.00 C ATOM 1682 CD LYS A 111 -7.100 -21.543 4.622 1.00 0.00 C ATOM 1683 CE LYS A 111 -8.223 -22.511 4.245 1.00 0.00 C ATOM 1684 NZ LYS A 111 -9.498 -21.781 4.066 1.00 0.00 N ATOM 0 H LYS A 111 -4.612 -17.827 6.593 1.00 0.00 H new ATOM 0 HA LYS A 111 -6.414 -18.701 4.512 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.024 -20.358 5.872 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.828 -19.790 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.909 -21.819 6.747 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -8.027 -20.550 6.290 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -7.151 -20.693 3.941 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -6.151 -22.045 4.434 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.965 -23.036 3.325 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -8.336 -23.267 5.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -10.264 -22.297 4.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -9.413 -20.829 4.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.714 -21.703 3.052 1.00 0.00 H new ATOM 1698 N LEU A 112 -8.378 -17.456 5.444 1.00 0.00 N ATOM 1699 CA LEU A 112 -9.724 -17.038 5.685 1.00 0.00 C ATOM 1700 C LEU A 112 -10.705 -18.157 5.600 1.00 0.00 C ATOM 1701 O LEU A 112 -10.654 -19.034 4.740 1.00 0.00 O ATOM 1702 CB LEU A 112 -10.185 -15.841 4.837 1.00 0.00 C ATOM 1703 CG LEU A 112 -9.619 -14.547 5.447 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.140 -14.265 5.129 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -10.428 -13.355 4.909 1.00 0.00 C ATOM 0 H LEU A 112 -8.155 -17.289 4.463 1.00 0.00 H new ATOM 0 HA LEU A 112 -9.702 -16.687 6.717 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.842 -15.954 3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.274 -15.798 4.807 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.695 -14.680 6.526 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.837 -13.332 5.604 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.524 -15.081 5.507 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.009 -14.182 4.050 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.038 -12.430 5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.345 -13.320 3.823 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -11.475 -13.470 5.189 1.00 0.00 H new ATOM 1717 N THR A 113 -11.708 -18.123 6.495 1.00 0.00 N ATOM 1718 CA THR A 113 -12.929 -18.865 6.452 1.00 0.00 C ATOM 1719 C THR A 113 -14.022 -18.046 5.855 1.00 0.00 C ATOM 1720 O THR A 113 -13.764 -16.946 5.371 1.00 0.00 O ATOM 1721 CB THR A 113 -13.445 -19.221 7.815 1.00 0.00 C ATOM 1722 OG1 THR A 113 -13.458 -18.121 8.713 1.00 0.00 O ATOM 1723 CG2 THR A 113 -12.635 -20.356 8.464 1.00 0.00 C ATOM 0 H THR A 113 -11.658 -17.524 7.319 1.00 0.00 H new ATOM 0 HA THR A 113 -12.689 -19.758 5.874 1.00 0.00 H new ATOM 0 HB THR A 113 -14.470 -19.547 7.641 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.805 -18.412 9.582 1.00 0.00 H new ATOM 0 HG21 THR A 113 -13.045 -20.579 9.449 1.00 0.00 H new ATOM 0 HG22 THR A 113 -12.690 -21.247 7.838 1.00 0.00 H new ATOM 0 HG23 THR A 113 -11.594 -20.048 8.566 1.00 0.00 H new ATOM 1731 N ASP A 114 -15.287 -18.500 5.927 1.00 0.00 N ATOM 1732 CA ASP A 114 -16.351 -17.781 5.298 1.00 0.00 C ATOM 1733 C ASP A 114 -16.952 -16.750 6.190 1.00 0.00 C ATOM 1734 O ASP A 114 -17.508 -15.746 5.747 1.00 0.00 O ATOM 1735 CB ASP A 114 -17.509 -18.666 4.806 1.00 0.00 C ATOM 1736 CG ASP A 114 -17.020 -19.794 3.909 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -16.568 -19.564 2.755 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.962 -20.946 4.415 1.00 0.00 O ATOM 0 H ASP A 114 -15.570 -19.351 6.413 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.860 -17.321 4.441 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -18.035 -19.086 5.664 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -18.227 -18.054 4.261 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.809 -16.952 7.512 1.00 0.00 N ATOM 1744 CA GLU A 115 -17.061 -16.009 8.557 1.00 0.00 C ATOM 1745 C GLU A 115 -16.242 -14.776 8.392 1.00 0.00 C ATOM 1746 O GLU A 115 -16.699 -13.643 8.536 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.700 -16.569 9.943 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.100 -15.668 11.114 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.933 -16.327 12.476 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.764 -16.399 12.940 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.939 -16.771 13.093 1.00 0.00 O ATOM 0 H GLU A 115 -16.491 -17.849 7.878 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.127 -15.792 8.491 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -17.182 -17.539 10.066 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.624 -16.740 9.983 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.499 -14.759 11.084 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.140 -15.367 10.991 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.950 -14.994 8.089 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.972 -13.950 8.070 1.00 0.00 C ATOM 1760 C GLU A 116 -14.166 -13.166 6.818 1.00 0.00 C ATOM 1761 O GLU A 116 -14.166 -11.938 6.897 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.538 -14.504 8.109 1.00 0.00 C ATOM 1763 CG GLU A 116 -12.090 -15.045 9.468 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.626 -15.458 9.517 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.728 -14.608 9.275 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -10.430 -16.672 9.788 1.00 0.00 O ATOM 0 H GLU A 116 -14.577 -15.913 7.852 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.103 -13.328 8.955 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.453 -15.302 7.371 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.851 -13.714 7.805 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.268 -14.284 10.227 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.708 -15.904 9.727 1.00 0.00 H new ATOM 1773 N VAL A 117 -14.418 -13.752 5.634 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.541 -13.059 4.389 1.00 0.00 C ATOM 1775 C VAL A 117 -15.687 -12.108 4.454 1.00 0.00 C ATOM 1776 O VAL A 117 -15.505 -10.938 4.122 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.644 -13.986 3.215 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.990 -13.255 1.907 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.348 -14.795 3.038 1.00 0.00 C ATOM 0 H VAL A 117 -14.542 -14.760 5.541 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.624 -12.492 4.229 1.00 0.00 H new ATOM 0 HB VAL A 117 -15.467 -14.666 3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -15.051 -13.976 1.092 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.949 -12.748 2.016 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.215 -12.521 1.684 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.448 -15.460 2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.513 -14.114 2.873 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -13.163 -15.386 3.935 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.862 -12.608 4.875 1.00 0.00 N ATOM 1790 CA ASP A 118 -18.085 -11.931 5.176 1.00 0.00 C ATOM 1791 C ASP A 118 -17.823 -10.701 5.975 1.00 0.00 C ATOM 1792 O ASP A 118 -18.148 -9.575 5.602 1.00 0.00 O ATOM 1793 CB ASP A 118 -19.112 -12.779 5.946 1.00 0.00 C ATOM 1794 CG ASP A 118 -20.518 -12.196 5.968 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -21.078 -12.138 4.842 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -21.091 -11.842 7.033 1.00 0.00 O ATOM 0 H ASP A 118 -16.963 -13.612 5.021 1.00 0.00 H new ATOM 0 HA ASP A 118 -18.514 -11.696 4.202 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -19.151 -13.773 5.501 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.767 -12.902 6.972 1.00 0.00 H new ATOM 1801 N GLU A 119 -17.220 -10.839 7.169 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.861 -9.729 7.996 1.00 0.00 C ATOM 1803 C GLU A 119 -16.135 -8.558 7.429 1.00 0.00 C ATOM 1804 O GLU A 119 -16.242 -7.394 7.814 1.00 0.00 O ATOM 1805 CB GLU A 119 -16.058 -10.279 9.187 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.954 -9.353 10.400 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.201 -9.972 11.569 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.676 -10.915 12.257 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.175 -9.352 11.956 1.00 0.00 O ATOM 0 H GLU A 119 -16.976 -11.745 7.570 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.828 -9.285 8.231 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.513 -11.217 9.507 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -15.050 -10.514 8.845 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.454 -8.431 10.102 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.957 -9.080 10.727 1.00 0.00 H new ATOM 1816 N MET A 120 -15.249 -8.905 6.479 1.00 0.00 N ATOM 1817 CA MET A 120 -14.444 -8.005 5.713 1.00 0.00 C ATOM 1818 C MET A 120 -15.217 -7.263 4.678 1.00 0.00 C ATOM 1819 O MET A 120 -15.107 -6.039 4.623 1.00 0.00 O ATOM 1820 CB MET A 120 -13.222 -8.701 5.089 1.00 0.00 C ATOM 1821 CG MET A 120 -12.324 -9.033 6.282 1.00 0.00 C ATOM 1822 SD MET A 120 -10.646 -9.496 5.759 1.00 0.00 S ATOM 1823 CE MET A 120 -10.285 -7.997 4.798 1.00 0.00 C ATOM 0 H MET A 120 -15.085 -9.880 6.230 1.00 0.00 H new ATOM 0 HA MET A 120 -14.080 -7.267 6.427 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.511 -9.601 4.547 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.714 -8.050 4.378 1.00 0.00 H new ATOM 0 HG2 MET A 120 -12.272 -8.172 6.948 1.00 0.00 H new ATOM 0 HG3 MET A 120 -12.765 -9.851 6.852 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.210 -7.815 4.798 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.630 -8.130 3.773 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.797 -7.146 5.246 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.946 -8.018 3.836 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.747 -7.460 2.792 1.00 0.00 C ATOM 1835 C ILE A 121 -17.845 -6.666 3.411 1.00 0.00 C ATOM 1836 O ILE A 121 -18.150 -5.610 2.860 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.307 -8.543 1.917 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.250 -9.462 1.282 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.318 -8.068 0.860 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.167 -8.776 0.450 1.00 0.00 C ATOM 0 H ILE A 121 -15.979 -9.036 3.882 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.134 -6.814 2.164 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.866 -9.144 2.634 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.764 -10.025 2.078 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.762 -10.185 0.647 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.665 -8.922 0.279 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.167 -7.597 1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.839 -7.348 0.196 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.482 -9.526 0.055 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.630 -8.237 -0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.616 -8.075 1.077 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.419 -7.030 4.572 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.244 -6.215 5.409 1.00 0.00 C ATOM 1854 C ARG A 122 -18.770 -4.861 5.812 1.00 0.00 C ATOM 1855 O ARG A 122 -19.543 -3.944 5.541 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.619 -6.996 6.680 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.762 -6.446 7.536 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.891 -6.918 8.985 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.026 -8.400 8.910 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.451 -9.305 9.755 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -19.746 -8.904 10.853 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.573 -10.640 9.497 1.00 0.00 N ATOM 0 H ARG A 122 -18.296 -7.968 4.954 1.00 0.00 H new ATOM 0 HA ARG A 122 -20.084 -5.997 4.749 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.879 -8.013 6.386 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.731 -7.063 7.308 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.671 -5.360 7.550 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.697 -6.681 7.028 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.017 -6.633 9.570 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.759 -6.469 9.468 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.603 -8.774 8.156 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -19.640 -7.910 11.056 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -19.325 -9.598 11.470 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -21.091 -10.956 8.677 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.146 -11.322 10.124 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.559 -4.763 6.388 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.874 -3.542 6.681 1.00 0.00 C ATOM 1878 C GLU A 123 -16.535 -2.680 5.513 1.00 0.00 C ATOM 1879 O GLU A 123 -16.478 -1.452 5.504 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.663 -3.828 7.584 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.801 -2.661 8.070 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.791 -2.967 9.167 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -13.858 -4.048 9.812 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.863 -2.139 9.366 1.00 0.00 O ATOM 0 H GLU A 123 -17.026 -5.587 6.666 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.593 -2.923 7.219 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.028 -4.355 8.465 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.010 -4.517 7.048 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.261 -2.257 7.214 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.465 -1.874 8.428 1.00 0.00 H new ATOM 1891 N ALA A 124 -16.245 -3.318 4.365 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.911 -2.512 3.232 1.00 0.00 C ATOM 1893 C ALA A 124 -17.104 -1.923 2.561 1.00 0.00 C ATOM 1894 O ALA A 124 -17.122 -0.776 2.118 1.00 0.00 O ATOM 1895 CB ALA A 124 -15.105 -3.383 2.253 1.00 0.00 C ATOM 0 H ALA A 124 -16.240 -4.328 4.222 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.320 -1.662 3.573 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.836 -2.792 1.377 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -14.199 -3.738 2.743 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.708 -4.236 1.944 1.00 0.00 H new ATOM 1901 N ASP A 125 -18.196 -2.693 2.411 1.00 0.00 N ATOM 1902 CA ASP A 125 -19.340 -2.366 1.618 1.00 0.00 C ATOM 1903 C ASP A 125 -20.070 -1.200 2.189 1.00 0.00 C ATOM 1904 O ASP A 125 -20.393 -1.210 3.375 1.00 0.00 O ATOM 1905 CB ASP A 125 -20.189 -3.642 1.490 1.00 0.00 C ATOM 1906 CG ASP A 125 -21.247 -3.599 0.397 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.825 -3.464 -0.783 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -22.464 -3.640 0.720 1.00 0.00 O ATOM 0 H ASP A 125 -18.285 -3.599 2.872 1.00 0.00 H new ATOM 0 HA ASP A 125 -19.056 -2.043 0.616 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.525 -4.485 1.300 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.680 -3.832 2.444 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.363 -0.178 1.364 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.082 1.000 1.738 1.00 0.00 C ATOM 1915 C ILE A 126 -22.504 0.943 1.299 1.00 0.00 C ATOM 1916 O ILE A 126 -23.419 1.375 1.998 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.396 2.264 1.313 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -19.114 2.402 2.152 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -21.198 3.575 1.269 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -18.160 3.483 1.645 1.00 0.00 C ATOM 0 H ILE A 126 -20.083 -0.174 0.383 1.00 0.00 H new ATOM 0 HA ILE A 126 -21.089 1.025 2.828 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.202 2.132 0.249 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -19.388 2.626 3.183 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.592 1.445 2.162 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.549 4.387 0.941 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -22.029 3.470 0.571 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.585 3.798 2.263 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -17.280 3.521 2.287 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.856 3.250 0.625 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.663 4.450 1.662 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.699 0.528 0.034 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.922 0.527 -0.707 1.00 0.00 C ATOM 1934 C ASP A 127 -24.761 -0.611 -0.235 1.00 0.00 C ATOM 1935 O ASP A 127 -25.449 -0.413 0.765 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.750 0.700 -2.225 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.594 -0.175 -2.687 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.685 -1.425 -2.553 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.487 0.298 -3.059 1.00 0.00 O ATOM 0 H ASP A 127 -21.926 0.159 -0.520 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.486 1.435 -0.494 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.667 0.420 -2.744 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.553 1.745 -2.467 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.749 -1.799 -0.865 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.443 -3.008 -0.544 1.00 0.00 C ATOM 1946 C GLY A 128 -25.274 -4.163 -1.470 1.00 0.00 C ATOM 1947 O GLY A 128 -26.072 -5.099 -1.468 1.00 0.00 O ATOM 0 H GLY A 128 -24.181 -1.923 -1.703 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -25.126 -3.324 0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.507 -2.779 -0.482 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.312 -4.116 -2.408 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.235 -5.138 -3.406 1.00 0.00 C ATOM 1953 C ASP A 129 -23.498 -6.352 -2.956 1.00 0.00 C ATOM 1954 O ASP A 129 -23.871 -7.513 -3.118 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.689 -4.610 -4.743 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.323 -3.940 -4.798 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.602 -3.791 -3.775 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.923 -3.518 -5.916 1.00 0.00 O ATOM 0 H ASP A 129 -23.601 -3.388 -2.477 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.265 -5.452 -3.574 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.666 -5.450 -5.438 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.416 -3.896 -5.130 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.339 -6.098 -2.321 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.416 -7.040 -1.770 1.00 0.00 C ATOM 1965 C GLY A 130 -20.169 -7.129 -2.582 1.00 0.00 C ATOM 1966 O GLY A 130 -19.436 -8.115 -2.522 1.00 0.00 O ATOM 0 H GLY A 130 -22.021 -5.139 -2.182 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -21.166 -6.750 -0.749 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.886 -8.022 -1.716 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.924 -6.094 -3.405 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.656 -6.048 -4.063 1.00 0.00 C ATOM 1972 C GLN A 131 -17.983 -4.791 -3.631 1.00 0.00 C ATOM 1973 O GLN A 131 -18.638 -3.794 -3.332 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.682 -6.044 -5.601 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.699 -7.471 -6.154 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.890 -8.344 -5.787 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -19.860 -9.449 -5.246 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.063 -7.828 -6.241 1.00 0.00 N ATOM 0 H GLN A 131 -20.565 -5.327 -3.608 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.145 -6.968 -3.781 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.561 -5.504 -5.952 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.809 -5.513 -5.981 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.645 -7.413 -7.241 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -17.794 -7.975 -5.816 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.078 -6.911 -6.688 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.928 -8.358 -6.135 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.639 -4.758 -3.583 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.907 -3.636 -3.084 1.00 0.00 C ATOM 1989 C VAL A 132 -15.434 -2.846 -4.255 1.00 0.00 C ATOM 1990 O VAL A 132 -14.588 -3.314 -5.015 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.802 -4.054 -2.160 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.930 -2.916 -1.604 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.408 -4.744 -0.926 1.00 0.00 C ATOM 0 H VAL A 132 -16.048 -5.528 -3.898 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.549 -3.005 -2.470 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.169 -4.694 -2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.164 -3.331 -0.949 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.454 -2.386 -2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.553 -2.223 -1.040 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.609 -5.050 -0.251 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -16.072 -4.050 -0.411 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.973 -5.622 -1.241 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.788 -1.565 -4.466 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.188 -0.646 -5.382 1.00 0.00 C ATOM 2005 C ASN A 133 -14.038 0.111 -4.814 1.00 0.00 C ATOM 2006 O ASN A 133 -13.659 -0.171 -3.678 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.306 0.185 -6.033 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.011 1.146 -5.086 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.460 2.117 -4.569 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.364 1.024 -5.021 1.00 0.00 N ATOM 0 H ASN A 133 -16.559 -1.139 -3.951 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.687 -1.189 -6.183 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.883 0.755 -6.860 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.045 -0.494 -6.458 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.918 1.736 -4.545 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.825 0.221 -5.448 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.467 1.081 -5.550 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.383 1.930 -5.162 1.00 0.00 C ATOM 2019 C TYR A 134 -12.738 2.831 -4.029 1.00 0.00 C ATOM 2020 O TYR A 134 -11.966 2.942 -3.078 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.952 2.671 -6.438 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.737 3.494 -6.180 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.617 2.708 -6.039 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.747 4.862 -6.042 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.468 3.414 -5.771 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.566 5.536 -5.840 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.422 4.786 -5.700 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.167 5.403 -5.513 1.00 0.00 O ATOM 0 H TYR A 134 -13.792 1.287 -6.495 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.548 1.354 -4.764 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.749 1.952 -7.232 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.764 3.310 -6.786 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.638 1.632 -6.131 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.679 5.405 -6.092 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.554 2.862 -5.608 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.538 6.615 -5.793 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.154 6.265 -5.979 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.902 3.505 -4.025 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.215 4.411 -2.964 1.00 0.00 C ATOM 2040 C GLU A 135 -14.316 3.657 -1.684 1.00 0.00 C ATOM 2041 O GLU A 135 -13.856 4.048 -0.612 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.453 5.194 -3.433 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.130 6.339 -4.395 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.385 6.948 -5.004 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.295 7.478 -4.311 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.464 6.976 -6.261 1.00 0.00 O ATOM 0 H GLU A 135 -14.618 3.425 -4.747 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.447 5.152 -2.744 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.144 4.506 -3.920 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.968 5.598 -2.561 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.574 7.112 -3.864 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.483 5.971 -5.191 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.024 2.513 -1.697 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.110 1.599 -0.601 1.00 0.00 C ATOM 2055 C GLU A 136 -13.821 1.160 0.006 1.00 0.00 C ATOM 2056 O GLU A 136 -13.745 1.121 1.233 1.00 0.00 O ATOM 2057 CB GLU A 136 -16.063 0.449 -0.970 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.461 0.895 -1.403 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.384 -0.260 -1.766 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.140 -0.915 -2.814 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.400 -0.526 -1.070 1.00 0.00 O ATOM 0 H GLU A 136 -15.561 2.212 -2.510 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.535 2.159 0.232 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.615 -0.132 -1.776 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -16.158 -0.217 -0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.915 1.472 -0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.371 1.561 -2.261 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.850 0.895 -0.885 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.475 0.664 -0.567 1.00 0.00 C ATOM 2070 C PHE A 137 -10.776 1.801 0.094 1.00 0.00 C ATOM 2071 O PHE A 137 -10.108 1.663 1.118 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.975 0.103 -1.909 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.592 -0.432 -1.762 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.257 -1.529 -1.005 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.542 0.069 -2.495 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.965 -1.981 -0.882 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.238 -0.362 -2.428 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.940 -1.431 -1.616 1.00 0.00 C ATOM 0 H PHE A 137 -13.036 0.839 -1.886 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.267 -0.034 0.244 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.643 -0.687 -2.253 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.991 0.886 -2.667 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.042 -2.058 -0.485 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.761 0.872 -3.184 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.750 -2.785 -0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.465 0.128 -3.001 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.936 -1.825 -1.557 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.725 2.978 -0.555 1.00 0.00 N ATOM 2089 CA VAL A 138 -10.007 4.141 -0.134 1.00 0.00 C ATOM 2090 C VAL A 138 -10.555 4.722 1.124 1.00 0.00 C ATOM 2091 O VAL A 138 -9.916 5.211 2.054 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.057 5.073 -1.309 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.559 6.511 -1.086 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.183 4.478 -2.426 1.00 0.00 C ATOM 0 H VAL A 138 -11.220 3.126 -1.434 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.975 3.915 0.133 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.119 5.157 -1.541 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.650 7.076 -2.014 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.159 6.988 -0.311 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.514 6.490 -0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.202 5.138 -3.293 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.158 4.376 -2.070 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.569 3.498 -2.707 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.880 4.619 1.335 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.540 5.164 2.480 1.00 0.00 C ATOM 2106 C GLN A 139 -12.273 4.436 3.753 1.00 0.00 C ATOM 2107 O GLN A 139 -12.187 5.017 4.833 1.00 0.00 O ATOM 2108 CB GLN A 139 -14.047 4.961 2.252 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.997 5.617 3.256 1.00 0.00 C ATOM 2110 CD GLN A 139 -14.843 7.096 3.584 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.177 7.796 2.824 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -15.560 7.620 4.614 1.00 0.00 N ATOM 0 H GLN A 139 -12.510 4.142 0.690 1.00 0.00 H new ATOM 0 HA GLN A 139 -12.192 6.192 2.578 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.293 5.336 1.259 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.247 3.890 2.247 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -16.012 5.469 2.888 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.913 5.065 4.192 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -16.101 7.006 5.223 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -15.557 8.627 4.777 1.00 0.00 H new ATOM 2121 N MET A 140 -11.918 3.142 3.661 1.00 0.00 N ATOM 2122 CA MET A 140 -11.407 2.322 4.715 1.00 0.00 C ATOM 2123 C MET A 140 -10.148 2.927 5.233 1.00 0.00 C ATOM 2124 O MET A 140 -9.792 2.920 6.411 1.00 0.00 O ATOM 2125 CB MET A 140 -11.156 0.844 4.372 1.00 0.00 C ATOM 2126 CG MET A 140 -12.501 0.115 4.400 1.00 0.00 C ATOM 2127 SD MET A 140 -12.208 -1.667 4.196 1.00 0.00 S ATOM 2128 CE MET A 140 -11.610 -1.793 2.486 1.00 0.00 C ATOM 0 H MET A 140 -11.995 2.631 2.781 1.00 0.00 H new ATOM 0 HA MET A 140 -12.201 2.299 5.462 1.00 0.00 H new ATOM 0 HB2 MET A 140 -10.695 0.754 3.388 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.466 0.399 5.089 1.00 0.00 H new ATOM 0 HG2 MET A 140 -13.015 0.307 5.342 1.00 0.00 H new ATOM 0 HG3 MET A 140 -13.147 0.485 3.604 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.925 -2.746 2.060 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.024 -0.976 1.895 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.522 -1.733 2.476 1.00 0.00 H new ATOM 2138 N MET A 141 -9.352 3.501 4.314 1.00 0.00 N ATOM 2139 CA MET A 141 -8.071 3.989 4.719 1.00 0.00 C ATOM 2140 C MET A 141 -7.993 5.326 5.372 1.00 0.00 C ATOM 2141 O MET A 141 -7.291 5.562 6.354 1.00 0.00 O ATOM 2142 CB MET A 141 -7.094 3.914 3.533 1.00 0.00 C ATOM 2143 CG MET A 141 -6.796 2.508 3.008 1.00 0.00 C ATOM 2144 SD MET A 141 -5.575 2.482 1.661 1.00 0.00 S ATOM 2145 CE MET A 141 -6.454 1.332 0.565 1.00 0.00 C ATOM 0 H MET A 141 -9.582 3.625 3.328 1.00 0.00 H new ATOM 0 HA MET A 141 -7.795 3.319 5.533 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.498 4.510 2.715 1.00 0.00 H new ATOM 0 HB3 MET A 141 -6.154 4.378 3.831 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.432 1.891 3.830 1.00 0.00 H new ATOM 0 HG3 MET A 141 -7.723 2.056 2.656 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.751 0.898 -0.146 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.907 0.538 1.159 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.232 1.869 0.023 1.00 0.00 H new ATOM 2155 N THR A 142 -8.638 6.303 4.710 1.00 0.00 N ATOM 2156 CA THR A 142 -8.619 7.706 4.983 1.00 0.00 C ATOM 2157 C THR A 142 -9.325 8.244 6.220 1.00 0.00 C ATOM 2158 O THR A 142 -10.516 7.916 6.466 1.00 0.00 O ATOM 2159 CB THR A 142 -9.183 8.560 3.885 1.00 0.00 C ATOM 2160 OG1 THR A 142 -10.540 8.229 3.630 1.00 0.00 O ATOM 2161 CG2 THR A 142 -8.483 8.322 2.536 1.00 0.00 C ATOM 0 H THR A 142 -9.229 6.087 3.907 1.00 0.00 H new ATOM 0 HA THR A 142 -7.541 7.781 5.122 1.00 0.00 H new ATOM 0 HB THR A 142 -9.049 9.584 4.233 1.00 0.00 H new ATOM 0 HG1 THR A 142 -10.967 7.936 4.462 1.00 0.00 H new ATOM 0 HG21 THR A 142 -8.929 8.964 1.776 1.00 0.00 H new ATOM 0 HG22 THR A 142 -7.422 8.554 2.631 1.00 0.00 H new ATOM 0 HG23 THR A 142 -8.601 7.279 2.244 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -10.880 -3.362 10.592 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.725 -2.538 10.170 1.00 0.00 C ATOM 2172 C ARG B 1 -8.445 -3.275 9.976 1.00 0.00 C ATOM 2173 O ARG B 1 -7.910 -3.168 8.874 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.428 -1.353 11.104 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.313 -0.124 10.887 1.00 0.00 C ATOM 2176 CD ARG B 1 -9.957 1.132 11.686 1.00 0.00 C ATOM 2177 NE ARG B 1 -10.975 2.194 11.455 1.00 0.00 N ATOM 2178 CZ ARG B 1 -10.787 3.516 11.738 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -9.661 3.984 12.352 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -11.734 4.412 11.334 1.00 0.00 N ATOM 0 H1 ARG B 1 -11.756 -2.811 10.487 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.934 -4.214 9.999 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.763 -3.640 11.587 1.00 0.00 H new ATOM 0 HA ARG B 1 -10.071 -2.181 9.200 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.540 -1.686 12.136 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.386 -1.060 10.975 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.289 0.129 9.827 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -11.340 -0.399 11.126 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -9.904 0.893 12.748 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -8.971 1.492 11.391 1.00 0.00 H new ATOM 0 HE ARG B 1 -11.873 1.915 11.059 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -8.919 3.337 12.618 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -9.562 4.981 12.545 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -12.561 4.089 10.832 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -11.615 5.405 11.534 1.00 0.00 H new ATOM 2193 N ARG B 2 -8.006 -4.144 10.905 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.722 -4.765 10.804 1.00 0.00 C ATOM 2195 C ARG B 2 -6.440 -5.632 9.625 1.00 0.00 C ATOM 2196 O ARG B 2 -5.360 -5.584 9.038 1.00 0.00 O ATOM 2197 CB ARG B 2 -6.422 -5.622 12.045 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.112 -6.413 12.016 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.696 -6.963 13.382 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.369 -7.633 13.288 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.815 -8.405 14.269 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.466 -8.880 15.370 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.484 -8.676 14.136 1.00 0.00 N ATOM 0 H ARG B 2 -8.543 -4.417 11.728 1.00 0.00 H new ATOM 0 HA ARG B 2 -6.083 -3.888 10.696 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.409 -4.969 12.918 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -7.244 -6.324 12.184 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -5.214 -7.242 11.316 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.318 -5.770 11.636 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.651 -6.152 14.109 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -5.444 -7.671 13.740 1.00 0.00 H new ATOM 0 HE ARG B 2 -2.835 -7.506 12.428 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -4.453 -8.664 15.512 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.966 -9.451 16.051 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -0.966 -8.307 13.339 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.008 -9.247 14.834 1.00 0.00 H new ATOM 2217 N LYS B 3 -7.427 -6.490 9.313 1.00 0.00 N ATOM 2218 CA LYS B 3 -7.308 -7.338 8.168 1.00 0.00 C ATOM 2219 C LYS B 3 -7.337 -6.652 6.845 1.00 0.00 C ATOM 2220 O LYS B 3 -6.519 -6.996 5.993 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.222 -8.574 8.139 1.00 0.00 C ATOM 2222 CG LYS B 3 -8.053 -9.445 9.386 1.00 0.00 C ATOM 2223 CD LYS B 3 -9.002 -10.644 9.357 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.963 -11.390 10.693 1.00 0.00 C ATOM 2225 NZ LYS B 3 -10.055 -12.387 10.738 1.00 0.00 N ATOM 0 H LYS B 3 -8.292 -6.597 9.842 1.00 0.00 H new ATOM 0 HA LYS B 3 -6.292 -7.702 8.322 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -9.261 -8.254 8.059 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.002 -9.166 7.251 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.023 -9.795 9.451 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -8.244 -8.848 10.278 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -10.018 -10.307 9.152 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.721 -11.319 8.548 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.000 -11.885 10.816 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -9.067 -10.685 11.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.317 -12.571 11.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -10.881 -12.020 10.223 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.736 -13.272 10.295 1.00 0.00 H new ATOM 2239 N TRP B 4 -8.166 -5.634 6.555 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.952 -4.847 5.380 1.00 0.00 C ATOM 2241 C TRP B 4 -6.673 -4.102 5.208 1.00 0.00 C ATOM 2242 O TRP B 4 -6.087 -4.005 4.130 1.00 0.00 O ATOM 2243 CB TRP B 4 -9.165 -3.903 5.340 1.00 0.00 C ATOM 2244 CG TRP B 4 -10.466 -4.486 4.842 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -11.632 -4.754 5.500 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.639 -4.832 3.455 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -12.546 -5.268 4.619 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.951 -5.315 3.380 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.860 -4.751 2.333 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.381 -5.780 2.167 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.307 -5.196 1.112 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.558 -5.765 1.065 1.00 0.00 C ATOM 0 H TRP B 4 -8.969 -5.359 7.121 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.853 -5.540 4.544 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -9.329 -3.518 6.346 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.911 -3.051 4.710 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.807 -4.587 6.553 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -13.497 -5.563 4.842 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.870 -4.327 2.409 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.385 -6.166 2.073 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.699 -5.102 0.224 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.902 -6.210 0.143 1.00 0.00 H new ATOM 2263 N GLN B 5 -6.219 -3.565 6.354 1.00 0.00 N ATOM 2264 CA GLN B 5 -5.028 -2.776 6.409 1.00 0.00 C ATOM 2265 C GLN B 5 -3.769 -3.464 6.006 1.00 0.00 C ATOM 2266 O GLN B 5 -3.223 -3.204 4.934 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.845 -2.263 7.848 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.624 -1.024 8.293 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.128 0.262 7.648 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.728 0.946 6.821 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -3.795 0.370 7.894 1.00 0.00 N ATOM 0 H GLN B 5 -6.684 -3.680 7.254 1.00 0.00 H new ATOM 0 HA GLN B 5 -5.181 -1.982 5.678 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.105 -3.077 8.524 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.785 -2.056 7.992 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -6.678 -1.160 8.052 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.554 -0.929 9.377 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -3.356 -0.228 8.594 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -3.235 1.049 7.378 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.387 -4.531 6.730 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.188 -5.274 6.496 1.00 0.00 C ATOM 2282 C LYS B 6 -1.902 -5.839 5.147 1.00 0.00 C ATOM 2283 O LYS B 6 -0.786 -5.765 4.635 1.00 0.00 O ATOM 2284 CB LYS B 6 -1.931 -6.297 7.616 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.813 -7.542 7.510 1.00 0.00 C ATOM 2286 CD LYS B 6 -2.474 -8.681 8.474 1.00 0.00 C ATOM 2287 CE LYS B 6 -3.288 -9.901 8.036 1.00 0.00 C ATOM 2288 NZ LYS B 6 -3.230 -11.026 8.995 1.00 0.00 N ATOM 0 H LYS B 6 -3.936 -4.891 7.511 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.453 -4.470 6.517 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.884 -6.598 7.590 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.102 -5.820 8.581 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.849 -7.246 7.677 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.751 -7.923 6.491 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.407 -8.901 8.449 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.718 -8.403 9.499 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -4.328 -9.604 7.900 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.924 -10.241 7.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.868 -11.784 8.680 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.257 -11.390 9.044 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.524 -10.695 9.936 1.00 0.00 H new ATOM 2302 N THR B 7 -3.036 -6.245 4.549 1.00 0.00 N ATOM 2303 CA THR B 7 -3.275 -6.721 3.222 1.00 0.00 C ATOM 2304 C THR B 7 -3.094 -5.668 2.184 1.00 0.00 C ATOM 2305 O THR B 7 -2.275 -5.809 1.277 1.00 0.00 O ATOM 2306 CB THR B 7 -4.557 -7.472 3.017 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.839 -8.334 4.110 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.474 -8.367 1.770 1.00 0.00 C ATOM 0 H THR B 7 -3.908 -6.236 5.078 1.00 0.00 H new ATOM 0 HA THR B 7 -2.491 -7.467 3.091 1.00 0.00 H new ATOM 0 HB THR B 7 -5.336 -6.717 2.913 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.095 -9.218 3.772 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.415 -8.901 1.642 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.285 -7.750 0.891 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.663 -9.085 1.891 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.782 -4.520 2.318 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.675 -3.521 1.300 1.00 0.00 C ATOM 2318 C GLY B 8 -2.417 -2.727 1.389 1.00 0.00 C ATOM 2319 O GLY B 8 -1.848 -2.380 0.356 1.00 0.00 O ATOM 0 H GLY B 8 -4.392 -4.287 3.102 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.727 -4.000 0.322 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.529 -2.847 1.370 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.770 -2.589 2.560 1.00 0.00 N ATOM 2324 CA HIS B 9 -0.492 -2.089 2.964 1.00 0.00 C ATOM 2325 C HIS B 9 0.576 -2.891 2.304 1.00 0.00 C ATOM 2326 O HIS B 9 1.524 -2.313 1.776 1.00 0.00 O ATOM 2327 CB HIS B 9 -0.480 -2.028 4.501 1.00 0.00 C ATOM 2328 CG HIS B 9 0.767 -1.379 5.024 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.994 -1.422 6.384 1.00 0.00 N ATOM 2330 CD2 HIS B 9 1.767 -0.625 4.495 1.00 0.00 C ATOM 2331 CE1 HIS B 9 2.113 -0.677 6.593 1.00 0.00 C ATOM 2332 NE2 HIS B 9 2.641 -0.207 5.478 1.00 0.00 N ATOM 0 H HIS B 9 -2.263 -2.900 3.397 1.00 0.00 H new ATOM 0 HA HIS B 9 -0.289 -1.070 2.635 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -1.352 -1.474 4.849 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -0.561 -3.037 4.905 1.00 0.00 H new ATOM 0 HD1 HIS B 9 0.439 -1.910 7.086 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.864 -0.385 3.446 1.00 0.00 H new ATOM 0 HE1 HIS B 9 2.528 -0.489 7.572 1.00 0.00 H new ATOM 2340 N ALA B 10 0.464 -4.231 2.296 1.00 0.00 N ATOM 2341 CA ALA B 10 1.384 -5.092 1.619 1.00 0.00 C ATOM 2342 C ALA B 10 1.321 -4.943 0.138 1.00 0.00 C ATOM 2343 O ALA B 10 2.340 -4.787 -0.532 1.00 0.00 O ATOM 2344 CB ALA B 10 1.550 -6.541 2.107 1.00 0.00 C ATOM 0 H ALA B 10 -0.287 -4.730 2.773 1.00 0.00 H new ATOM 0 HA ALA B 10 2.341 -4.694 1.956 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.284 -7.053 1.484 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.891 -6.539 3.142 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.593 -7.059 2.041 1.00 0.00 H new ATOM 2350 N VAL B 11 0.137 -4.959 -0.499 1.00 0.00 N ATOM 2351 CA VAL B 11 0.038 -4.887 -1.924 1.00 0.00 C ATOM 2352 C VAL B 11 0.649 -3.620 -2.414 1.00 0.00 C ATOM 2353 O VAL B 11 1.477 -3.653 -3.323 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.378 -5.002 -2.407 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.407 -4.841 -3.936 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.060 -6.346 -2.096 1.00 0.00 C ATOM 0 H VAL B 11 -0.762 -5.023 -0.021 1.00 0.00 H new ATOM 0 HA VAL B 11 0.584 -5.738 -2.330 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.922 -4.221 -1.876 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.434 -4.924 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.007 -3.864 -4.207 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.800 -5.621 -4.396 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.079 -6.335 -2.483 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.502 -7.155 -2.567 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -2.083 -6.501 -1.017 1.00 0.00 H new ATOM 2366 N ARG B 12 0.260 -2.431 -1.920 1.00 0.00 N ATOM 2367 CA ARG B 12 0.870 -1.143 -2.036 1.00 0.00 C ATOM 2368 C ARG B 12 2.354 -1.096 -1.909 1.00 0.00 C ATOM 2369 O ARG B 12 3.079 -0.390 -2.609 1.00 0.00 O ATOM 2370 CB ARG B 12 0.407 -0.173 -0.936 1.00 0.00 C ATOM 2371 CG ARG B 12 -1.040 0.314 -1.035 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.760 0.861 0.199 1.00 0.00 C ATOM 2373 NE ARG B 12 -1.151 2.191 0.480 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.802 2.679 1.706 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.018 2.030 2.887 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -0.016 3.794 1.759 1.00 0.00 N ATOM 0 H ARG B 12 -0.595 -2.371 -1.367 1.00 0.00 H new ATOM 0 HA ARG B 12 0.563 -0.870 -3.046 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.540 -0.661 0.030 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.064 0.697 -0.947 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -1.066 1.095 -1.795 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.635 -0.518 -1.412 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.830 0.954 0.016 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.639 0.190 1.049 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.978 2.796 -0.322 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.469 1.115 2.891 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -0.728 2.460 3.766 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.295 4.240 0.896 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.260 4.181 2.661 1.00 0.00 H new ATOM 2390 N ALA B 13 2.871 -1.941 -1.000 1.00 0.00 N ATOM 2391 CA ALA B 13 4.275 -2.017 -0.740 1.00 0.00 C ATOM 2392 C ALA B 13 5.178 -2.579 -1.784 1.00 0.00 C ATOM 2393 O ALA B 13 6.260 -2.126 -2.152 1.00 0.00 O ATOM 2394 CB ALA B 13 4.445 -2.779 0.585 1.00 0.00 C ATOM 0 H ALA B 13 2.308 -2.580 -0.438 1.00 0.00 H new ATOM 0 HA ALA B 13 4.611 -0.980 -0.714 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.505 -2.861 0.824 1.00 0.00 H new ATOM 0 HB2 ALA B 13 3.934 -2.240 1.383 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.016 -3.777 0.489 1.00 0.00 H new ATOM 2400 N ILE B 14 4.535 -3.504 -2.518 1.00 0.00 N ATOM 2401 CA ILE B 14 5.139 -4.252 -3.577 1.00 0.00 C ATOM 2402 C ILE B 14 5.359 -3.271 -4.678 1.00 0.00 C ATOM 2403 O ILE B 14 6.428 -3.202 -5.283 1.00 0.00 O ATOM 2404 CB ILE B 14 4.285 -5.364 -4.109 1.00 0.00 C ATOM 2405 CG1 ILE B 14 4.225 -6.374 -2.950 1.00 0.00 C ATOM 2406 CG2 ILE B 14 4.883 -6.007 -5.371 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.500 -7.679 -3.278 1.00 0.00 C ATOM 0 H ILE B 14 3.554 -3.741 -2.368 1.00 0.00 H new ATOM 0 HA ILE B 14 6.046 -4.724 -3.198 1.00 0.00 H new ATOM 0 HB ILE B 14 3.302 -5.008 -4.416 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.242 -6.608 -2.637 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.730 -5.903 -2.101 1.00 0.00 H new ATOM 0 HG21 ILE B 14 4.228 -6.806 -5.717 1.00 0.00 H new ATOM 0 HG22 ILE B 14 4.980 -5.253 -6.152 1.00 0.00 H new ATOM 0 HG23 ILE B 14 5.866 -6.418 -5.139 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.507 -8.329 -2.403 1.00 0.00 H new ATOM 0 HD12 ILE B 14 2.470 -7.462 -3.560 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.005 -8.178 -4.105 1.00 0.00 H new ATOM 2419 N GLY B 15 4.300 -2.468 -4.877 1.00 0.00 N ATOM 2420 CA GLY B 15 4.187 -1.495 -5.919 1.00 0.00 C ATOM 2421 C GLY B 15 5.095 -0.326 -5.751 1.00 0.00 C ATOM 2422 O GLY B 15 5.421 0.344 -6.730 1.00 0.00 O ATOM 0 H GLY B 15 3.476 -2.499 -4.277 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.399 -1.974 -6.875 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.157 -1.140 -5.962 1.00 0.00 H new ATOM 2426 N ARG B 16 5.522 -0.110 -4.494 1.00 0.00 N ATOM 2427 CA ARG B 16 6.516 0.853 -4.133 1.00 0.00 C ATOM 2428 C ARG B 16 7.941 0.431 -4.235 1.00 0.00 C ATOM 2429 O ARG B 16 8.779 1.303 -4.458 1.00 0.00 O ATOM 2430 CB ARG B 16 6.210 1.641 -2.848 1.00 0.00 C ATOM 2431 CG ARG B 16 5.027 2.594 -3.029 1.00 0.00 C ATOM 2432 CD ARG B 16 4.651 3.311 -1.731 1.00 0.00 C ATOM 2433 NE ARG B 16 5.789 4.189 -1.338 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.588 5.329 -0.614 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.455 5.466 0.136 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.562 6.285 -0.589 1.00 0.00 N ATOM 0 H ARG B 16 5.159 -0.629 -3.695 1.00 0.00 H new ATOM 0 HA ARG B 16 6.416 1.562 -4.955 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.994 0.944 -2.038 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.092 2.210 -2.553 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.273 3.333 -3.791 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.166 2.034 -3.394 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.746 3.902 -1.872 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.440 2.587 -0.944 1.00 0.00 H new ATOM 0 HE ARG B 16 6.737 3.933 -1.615 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.762 4.718 0.154 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.302 6.316 0.678 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.429 6.144 -1.108 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.423 7.141 -0.052 1.00 0.00 H new ATOM 2450 N LEU B 17 8.155 -0.896 -4.182 1.00 0.00 N ATOM 2451 CA LEU B 17 9.430 -1.540 -4.251 1.00 0.00 C ATOM 2452 C LEU B 17 9.661 -1.695 -5.715 1.00 0.00 C ATOM 2453 O LEU B 17 10.722 -1.253 -6.155 1.00 0.00 O ATOM 2454 CB LEU B 17 9.450 -2.833 -3.419 1.00 0.00 C ATOM 2455 CG LEU B 17 10.713 -3.709 -3.411 1.00 0.00 C ATOM 2456 CD1 LEU B 17 11.973 -3.163 -2.719 1.00 0.00 C ATOM 2457 CD2 LEU B 17 10.455 -4.974 -2.575 1.00 0.00 C ATOM 0 H LEU B 17 7.388 -1.561 -4.085 1.00 0.00 H new ATOM 0 HA LEU B 17 10.251 -0.979 -3.805 1.00 0.00 H new ATOM 0 HB2 LEU B 17 9.236 -2.560 -2.386 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.623 -3.455 -3.762 1.00 0.00 H new ATOM 0 HG LEU B 17 10.897 -3.820 -4.480 1.00 0.00 H new ATOM 0 HD11 LEU B 17 12.777 -3.895 -2.798 1.00 0.00 H new ATOM 0 HD12 LEU B 17 12.279 -2.234 -3.200 1.00 0.00 H new ATOM 0 HD13 LEU B 17 11.757 -2.973 -1.668 1.00 0.00 H new ATOM 0 HD21 LEU B 17 11.351 -5.595 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU B 17 10.204 -4.690 -1.553 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.627 -5.535 -3.009 1.00 0.00 H new ATOM 2469 N SER B 18 8.684 -2.203 -6.487 1.00 0.00 N ATOM 2470 CA SER B 18 8.555 -2.397 -7.898 1.00 0.00 C ATOM 2471 C SER B 18 8.853 -1.131 -8.625 1.00 0.00 C ATOM 2472 O SER B 18 8.021 -0.242 -8.798 1.00 0.00 O ATOM 2473 CB SER B 18 7.195 -2.867 -8.441 1.00 0.00 C ATOM 2474 OG SER B 18 6.997 -4.176 -7.926 1.00 0.00 O ATOM 0 H SER B 18 7.835 -2.535 -6.029 1.00 0.00 H new ATOM 0 HA SER B 18 9.263 -3.207 -8.072 1.00 0.00 H new ATOM 0 HB2 SER B 18 6.396 -2.198 -8.123 1.00 0.00 H new ATOM 0 HB3 SER B 18 7.191 -2.872 -9.531 1.00 0.00 H new ATOM 0 HG SER B 18 6.776 -4.123 -6.973 1.00 0.00 H new ATOM 2480 N SER B 19 10.056 -1.034 -9.219 1.00 0.00 N ATOM 2481 CA SER B 19 10.477 0.020 -10.090 1.00 0.00 C ATOM 2482 C SER B 19 9.869 -0.105 -11.479 1.00 0.00 C ATOM 2483 O SER B 19 9.141 0.831 -11.907 1.00 0.00 O ATOM 2484 CB SER B 19 11.994 -0.052 -10.330 1.00 0.00 C ATOM 2485 OG SER B 19 12.697 0.022 -9.098 1.00 0.00 O ATOM 2486 OXT SER B 19 10.123 -1.164 -12.112 1.00 0.00 O ATOM 0 H SER B 19 10.781 -1.738 -9.082 1.00 0.00 H new ATOM 0 HA SER B 19 10.165 0.942 -9.600 1.00 0.00 H new ATOM 0 HB2 SER B 19 12.243 -0.981 -10.842 1.00 0.00 H new ATOM 0 HB3 SER B 19 12.304 0.765 -10.982 1.00 0.00 H new ATOM 0 HG SER B 19 13.661 -0.027 -9.268 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 14.083 -13.963 5.014 1.00 0.00 CA HETATM 2494 CA CA A 152 20.020 -4.383 3.567 1.00 0.00 CA HETATM 2495 CA CA A 153 -13.814 -8.699 -10.028 1.00 0.00 CA HETATM 2496 CA CA A 154 -20.389 -2.017 -2.732 1.00 0.00 CA