USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 980 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 40 GLN : amide:sc= 0.108 K(o=0.085,f=-3.3!) USER MOD Set 1.2: B 711 HIS : no HE2:sc= -0.0232 X(o=0.085,f=-0.2) USER MOD Set 2.1: A 7 THR OG1 : rot 128:sc= 1.79 USER MOD Set 2.2: A 9 THR OG1 : rot 170:sc= 0.676 USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0272 (180deg=-0.189) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0.879 (180deg=0.84) USER MOD Single : A 2 GLN :FLIP amide:sc= 0.081 F(o=-1,f=0.081) USER MOD Single : A 6 LYS NZ :NH3+ -163:sc= 1.22 (180deg=1.21) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0334 USER MOD Single : A 25 ASN : amide:sc= -0.499 K(o=-0.5,f=-2.2!) USER MOD Single : A 27 LYS NZ :NH3+ -159:sc= 1.66 (180deg=1.22) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 0.951 (180deg=0.896) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ -162:sc= 0.978 (180deg=0.761) USER MOD Single : A 41 GLN : amide:sc= 0.949 K(o=0.95,f=-4.4!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.13 K(o=0.13,f=-3!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= -0.0751 USER MOD Single : A 59 TYR OH : rot 70:sc= -0.646 USER MOD Single : A 60 ASN : amide:sc= 0.2 X(o=0.2,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.241 X(o=0.24,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 49:sc= 0.0755 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.0545 X(o=-0.054,f=-0.28) USER MOD Single : B -1 MET CE :methyl 172:sc= 0 (180deg=-0.0605) USER MOD Single : B -2 HIS : no HD1:sc= -0.264 K(o=-0.26,f=-1.4) USER MOD Single : B -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0.111 USER MOD Single : B 686 GLN : amide:sc= 0.643 K(o=0.64,f=-0.2) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.212 X(o=-0.21,f=-0.24) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -87:sc= 0.703 USER MOD Single : B 708 SER OG : rot 180:sc= 0.034 USER MOD Single : B 714 HIS : no HD1:sc= -0.238 K(o=-0.24,f=-2.9!) USER MOD Single : B 715 LYS NZ :NH3+ 164:sc= 1.32 (180deg=0.952) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.403 1.254 0.247 1.00 0.00 N ATOM 2 CA MET A 1 2.199 1.225 -1.027 1.00 0.00 C ATOM 3 C MET A 1 1.893 2.438 -1.904 1.00 0.00 C ATOM 4 O MET A 1 0.992 3.194 -1.577 1.00 0.00 O ATOM 5 CB MET A 1 2.015 -0.080 -1.849 1.00 0.00 C ATOM 6 CG MET A 1 0.655 -0.301 -2.538 1.00 0.00 C ATOM 7 SD MET A 1 0.566 -1.916 -3.346 1.00 0.00 S ATOM 8 CE MET A 1 -0.678 -1.619 -4.628 1.00 0.00 C ATOM 0 H1 MET A 1 1.543 0.363 0.764 1.00 0.00 H new ATOM 0 H2 MET A 1 1.720 2.050 0.837 1.00 0.00 H new ATOM 0 H3 MET A 1 0.394 1.370 0.023 1.00 0.00 H new ATOM 0 HA MET A 1 3.242 1.258 -0.713 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.789 -0.106 -2.616 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.196 -0.925 -1.184 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.144 -0.219 -1.801 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.489 0.484 -3.276 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.002 -2.571 -5.048 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.534 -1.105 -4.192 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.248 -1.002 -5.417 1.00 0.00 H new ATOM 20 N GLN A 2 2.534 2.597 -3.067 1.00 0.00 N ATOM 21 CA GLN A 2 2.198 3.641 -4.031 1.00 0.00 C ATOM 22 C GLN A 2 2.186 3.083 -5.429 1.00 0.00 C ATOM 23 O GLN A 2 2.865 2.089 -5.688 1.00 0.00 O ATOM 24 CB GLN A 2 3.173 4.829 -3.906 1.00 0.00 C ATOM 25 CG GLN A 2 4.527 4.740 -4.640 1.00 0.00 C ATOM 26 CD GLN A 2 5.459 3.799 -3.907 1.00 0.00 C ATOM 27 OE1 GLN A 2 5.310 2.527 -4.220 1.00 0.00 O flip ATOM 28 NE2 GLN A 2 6.245 4.176 -3.041 1.00 0.00 N flip ATOM 0 H GLN A 2 3.305 1.999 -3.364 1.00 0.00 H new ATOM 0 HA GLN A 2 1.196 4.011 -3.811 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.659 5.721 -4.263 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.378 4.982 -2.846 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.373 4.389 -5.660 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.978 5.730 -4.708 1.00 0.00 H new ATOM 0 HE21 GLN A 2 6.331 5.170 -2.828 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.811 3.495 -2.535 1.00 0.00 H new ATOM 37 N ILE A 3 1.510 3.774 -6.329 1.00 0.00 N ATOM 38 CA ILE A 3 1.467 3.426 -7.748 1.00 0.00 C ATOM 39 C ILE A 3 1.555 4.711 -8.551 1.00 0.00 C ATOM 40 O ILE A 3 1.211 5.782 -8.062 1.00 0.00 O ATOM 41 CB ILE A 3 0.222 2.571 -8.056 1.00 0.00 C ATOM 42 CG1 ILE A 3 -1.059 3.128 -7.406 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.451 1.141 -7.527 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.270 3.057 -8.328 1.00 0.00 C ATOM 0 H ILE A 3 0.966 4.605 -6.097 1.00 0.00 H new ATOM 0 HA ILE A 3 2.314 2.802 -8.033 1.00 0.00 H new ATOM 0 HB ILE A 3 0.082 2.584 -9.137 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.270 2.570 -6.494 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.891 4.165 -7.114 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.425 0.529 -7.741 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.324 0.708 -8.015 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.617 1.174 -6.450 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.142 3.463 -7.815 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.076 3.638 -9.229 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.460 2.019 -8.600 1.00 0.00 H new ATOM 56 N PHE A 4 2.063 4.578 -9.767 1.00 0.00 N ATOM 57 CA PHE A 4 2.452 5.663 -10.649 1.00 0.00 C ATOM 58 C PHE A 4 1.420 5.771 -11.757 1.00 0.00 C ATOM 59 O PHE A 4 1.452 5.036 -12.731 1.00 0.00 O ATOM 60 CB PHE A 4 3.851 5.363 -11.212 1.00 0.00 C ATOM 61 CG PHE A 4 4.875 4.787 -10.252 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.117 5.449 -9.045 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.605 3.624 -10.565 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.060 4.951 -8.134 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.589 3.162 -9.673 1.00 0.00 C ATOM 66 CZ PHE A 4 6.828 3.829 -8.464 1.00 0.00 C ATOM 0 H PHE A 4 2.222 3.661 -10.185 1.00 0.00 H new ATOM 0 HA PHE A 4 2.493 6.613 -10.117 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.739 4.667 -12.044 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.256 6.288 -11.623 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.573 6.352 -8.812 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.410 3.091 -11.484 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.193 5.434 -7.177 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.166 2.284 -9.922 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.599 3.480 -7.793 1.00 0.00 H new ATOM 76 N VAL A 5 0.465 6.669 -11.633 1.00 0.00 N ATOM 77 CA VAL A 5 -0.527 6.853 -12.685 1.00 0.00 C ATOM 78 C VAL A 5 0.092 7.835 -13.669 1.00 0.00 C ATOM 79 O VAL A 5 0.213 9.019 -13.380 1.00 0.00 O ATOM 80 CB VAL A 5 -1.888 7.268 -12.103 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.965 7.309 -13.201 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.277 6.272 -10.994 1.00 0.00 C ATOM 0 H VAL A 5 0.350 7.280 -10.825 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.763 5.931 -13.215 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.812 8.271 -11.683 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.919 7.605 -12.764 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.677 8.030 -13.966 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.063 6.321 -13.651 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.241 6.555 -10.572 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.345 5.268 -11.414 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.520 6.287 -10.210 1.00 0.00 H new ATOM 92 N LYS A 6 0.561 7.347 -14.815 1.00 0.00 N ATOM 93 CA LYS A 6 1.026 8.217 -15.883 1.00 0.00 C ATOM 94 C LYS A 6 -0.223 8.831 -16.492 1.00 0.00 C ATOM 95 O LYS A 6 -1.114 8.096 -16.919 1.00 0.00 O ATOM 96 CB LYS A 6 1.849 7.403 -16.899 1.00 0.00 C ATOM 97 CG LYS A 6 2.620 8.351 -17.831 1.00 0.00 C ATOM 98 CD LYS A 6 3.465 7.639 -18.899 1.00 0.00 C ATOM 99 CE LYS A 6 4.427 8.609 -19.616 1.00 0.00 C ATOM 100 NZ LYS A 6 5.490 7.886 -20.367 1.00 0.00 N ATOM 0 H LYS A 6 0.628 6.351 -15.024 1.00 0.00 H new ATOM 0 HA LYS A 6 1.689 9.006 -15.527 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.546 6.749 -16.374 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.189 6.762 -17.484 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.909 9.011 -18.328 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.273 8.982 -17.229 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.039 6.838 -18.433 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.806 7.174 -19.632 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.862 9.238 -20.303 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.887 9.271 -18.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.266 8.542 -20.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.854 7.103 -19.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.094 7.507 -21.251 1.00 0.00 H new ATOM 114 N THR A 7 -0.332 10.153 -16.535 1.00 0.00 N ATOM 115 CA THR A 7 -1.403 10.741 -17.302 1.00 0.00 C ATOM 116 C THR A 7 -1.131 10.496 -18.759 1.00 0.00 C ATOM 117 O THR A 7 -0.008 10.236 -19.167 1.00 0.00 O ATOM 118 CB THR A 7 -1.603 12.222 -17.010 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.390 12.899 -17.217 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.087 12.392 -15.586 1.00 0.00 C ATOM 0 H THR A 7 0.288 10.812 -16.063 1.00 0.00 H new ATOM 0 HA THR A 7 -2.340 10.266 -17.011 1.00 0.00 H new ATOM 0 HB THR A 7 -2.354 12.643 -17.679 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.538 13.658 -17.819 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.231 13.452 -15.375 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.032 11.865 -15.458 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.347 11.982 -14.899 1.00 0.00 H new ATOM 128 N LEU A 8 -2.163 10.641 -19.563 1.00 0.00 N ATOM 129 CA LEU A 8 -1.999 10.675 -20.999 1.00 0.00 C ATOM 130 C LEU A 8 -1.174 11.914 -21.391 1.00 0.00 C ATOM 131 O LEU A 8 -0.708 11.906 -22.521 1.00 0.00 O ATOM 132 CB LEU A 8 -3.390 10.664 -21.647 1.00 0.00 C ATOM 133 CG LEU A 8 -4.013 9.402 -22.262 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.469 9.648 -22.677 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.346 8.979 -23.562 1.00 0.00 C ATOM 0 H LEU A 8 -3.127 10.737 -19.244 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.453 9.802 -21.356 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.088 11.016 -20.888 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.371 11.416 -22.436 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.900 8.647 -21.484 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.883 8.737 -23.109 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.053 9.933 -21.802 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.507 10.449 -23.415 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.832 8.082 -23.945 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.435 9.781 -24.295 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.292 8.770 -23.379 1.00 0.00 H new ATOM 147 N THR A 9 -0.952 12.961 -20.565 1.00 0.00 N ATOM 148 CA THR A 9 0.037 13.983 -20.933 1.00 0.00 C ATOM 149 C THR A 9 1.400 13.346 -20.775 1.00 0.00 C ATOM 150 O THR A 9 2.281 13.519 -21.604 1.00 0.00 O ATOM 151 CB THR A 9 0.024 15.233 -20.039 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.850 15.072 -18.942 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.363 16.451 -20.853 1.00 0.00 C ATOM 0 H THR A 9 -1.426 13.113 -19.675 1.00 0.00 H new ATOM 0 HA THR A 9 -0.200 14.311 -21.945 1.00 0.00 H new ATOM 0 HB THR A 9 1.029 15.376 -19.642 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.719 15.808 -18.309 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.369 17.331 -20.210 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.358 16.595 -21.658 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.356 16.305 -21.277 1.00 0.00 H new ATOM 161 N GLY A 10 1.538 12.575 -19.705 1.00 0.00 N ATOM 162 CA GLY A 10 2.725 11.854 -19.332 1.00 0.00 C ATOM 163 C GLY A 10 3.261 12.352 -18.005 1.00 0.00 C ATOM 164 O GLY A 10 4.433 12.143 -17.704 1.00 0.00 O ATOM 0 H GLY A 10 0.775 12.435 -19.043 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.503 10.789 -19.263 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.485 11.972 -20.104 1.00 0.00 H new ATOM 168 N LYS A 11 2.419 13.030 -17.216 1.00 0.00 N ATOM 169 CA LYS A 11 2.788 13.430 -15.872 1.00 0.00 C ATOM 170 C LYS A 11 2.530 12.211 -15.026 1.00 0.00 C ATOM 171 O LYS A 11 1.391 11.756 -14.947 1.00 0.00 O ATOM 172 CB LYS A 11 1.943 14.620 -15.396 1.00 0.00 C ATOM 173 CG LYS A 11 2.470 15.099 -14.024 1.00 0.00 C ATOM 174 CD LYS A 11 1.519 14.867 -12.841 1.00 0.00 C ATOM 175 CE LYS A 11 0.240 15.718 -12.878 1.00 0.00 C ATOM 176 NZ LYS A 11 0.480 17.181 -12.729 1.00 0.00 N ATOM 0 H LYS A 11 1.478 13.309 -17.495 1.00 0.00 H new ATOM 0 HA LYS A 11 3.825 13.760 -15.813 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.994 15.431 -16.122 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.896 14.329 -15.316 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.412 14.591 -13.817 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.690 16.165 -14.089 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.239 13.814 -12.817 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.054 15.076 -11.914 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.276 15.539 -13.822 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.427 15.387 -12.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.428 17.687 -12.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.944 17.365 -11.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.091 17.513 -13.502 1.00 0.00 H new ATOM 190 N THR A 12 3.555 11.657 -14.419 1.00 0.00 N ATOM 191 CA THR A 12 3.369 10.500 -13.577 1.00 0.00 C ATOM 192 C THR A 12 3.018 11.012 -12.188 1.00 0.00 C ATOM 193 O THR A 12 3.854 11.578 -11.484 1.00 0.00 O ATOM 194 CB THR A 12 4.611 9.610 -13.649 1.00 0.00 C ATOM 195 OG1 THR A 12 5.149 9.608 -14.964 1.00 0.00 O ATOM 196 CG2 THR A 12 4.173 8.189 -13.332 1.00 0.00 C ATOM 0 H THR A 12 4.518 11.986 -14.492 1.00 0.00 H new ATOM 0 HA THR A 12 2.550 9.858 -13.903 1.00 0.00 H new ATOM 0 HB THR A 12 5.363 9.979 -12.951 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.944 9.035 -14.991 1.00 0.00 H new ATOM 0 HG21 THR A 12 5.036 7.524 -13.374 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.739 8.157 -12.333 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.430 7.866 -14.061 1.00 0.00 H new ATOM 204 N ILE A 13 1.747 10.849 -11.831 1.00 0.00 N ATOM 205 CA ILE A 13 1.244 11.174 -10.517 1.00 0.00 C ATOM 206 C ILE A 13 1.372 9.900 -9.707 1.00 0.00 C ATOM 207 O ILE A 13 0.726 8.899 -10.003 1.00 0.00 O ATOM 208 CB ILE A 13 -0.178 11.782 -10.572 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.002 11.597 -9.273 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.048 11.480 -11.799 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.252 10.710 -9.339 1.00 0.00 C ATOM 0 H ILE A 13 1.034 10.482 -12.462 1.00 0.00 H new ATOM 0 HA ILE A 13 1.816 11.966 -10.034 1.00 0.00 H new ATOM 0 HB ILE A 13 0.089 12.833 -10.682 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.339 11.186 -8.512 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.310 12.584 -8.928 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.013 11.975 -11.691 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.551 11.847 -12.697 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.199 10.404 -11.882 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.725 10.674 -8.358 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.953 11.123 -10.065 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.967 9.702 -9.642 1.00 0.00 H new ATOM 223 N THR A 14 2.220 9.948 -8.693 1.00 0.00 N ATOM 224 CA THR A 14 2.391 8.834 -7.778 1.00 0.00 C ATOM 225 C THR A 14 1.377 9.037 -6.655 1.00 0.00 C ATOM 226 O THR A 14 1.181 10.164 -6.188 1.00 0.00 O ATOM 227 CB THR A 14 3.852 8.795 -7.309 1.00 0.00 C ATOM 228 OG1 THR A 14 4.685 8.796 -8.457 1.00 0.00 O ATOM 229 CG2 THR A 14 4.158 7.539 -6.472 1.00 0.00 C ATOM 0 H THR A 14 2.806 10.756 -8.482 1.00 0.00 H new ATOM 0 HA THR A 14 2.202 7.862 -8.234 1.00 0.00 H new ATOM 0 HB THR A 14 4.035 9.665 -6.679 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.625 8.773 -8.179 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.203 7.554 -6.162 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.518 7.525 -5.590 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.970 6.648 -7.071 1.00 0.00 H new ATOM 237 N LEU A 15 0.712 7.960 -6.242 1.00 0.00 N ATOM 238 CA LEU A 15 -0.336 8.010 -5.232 1.00 0.00 C ATOM 239 C LEU A 15 -0.194 6.825 -4.321 1.00 0.00 C ATOM 240 O LEU A 15 0.129 5.750 -4.811 1.00 0.00 O ATOM 241 CB LEU A 15 -1.721 8.086 -5.907 1.00 0.00 C ATOM 242 CG LEU A 15 -2.194 6.860 -6.699 1.00 0.00 C ATOM 243 CD1 LEU A 15 -2.995 5.899 -5.831 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.153 7.295 -7.798 1.00 0.00 C ATOM 0 H LEU A 15 0.889 7.023 -6.603 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.239 8.909 -4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.461 8.292 -5.133 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.719 8.942 -6.582 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.295 6.379 -7.085 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.311 5.045 -6.430 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.375 5.553 -5.004 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.873 6.410 -5.437 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.486 6.421 -8.357 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.016 7.791 -7.353 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.645 7.985 -8.472 1.00 0.00 H new ATOM 256 N GLU A 16 -0.463 6.994 -3.030 1.00 0.00 N ATOM 257 CA GLU A 16 -0.300 5.939 -2.048 1.00 0.00 C ATOM 258 C GLU A 16 -1.660 5.334 -1.709 1.00 0.00 C ATOM 259 O GLU A 16 -2.622 6.045 -1.412 1.00 0.00 O ATOM 260 CB GLU A 16 0.463 6.440 -0.811 1.00 0.00 C ATOM 261 CG GLU A 16 1.981 6.339 -1.022 1.00 0.00 C ATOM 262 CD GLU A 16 2.762 6.964 0.145 1.00 0.00 C ATOM 263 OE1 GLU A 16 3.072 6.245 1.127 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.086 8.174 0.088 1.00 0.00 O ATOM 0 H GLU A 16 -0.802 7.873 -2.638 1.00 0.00 H new ATOM 0 HA GLU A 16 0.314 5.144 -2.471 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.189 7.475 -0.605 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.174 5.854 0.061 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.264 5.292 -1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.253 6.840 -1.951 1.00 0.00 H new ATOM 271 N VAL A 17 -1.715 4.011 -1.830 1.00 0.00 N ATOM 272 CA VAL A 17 -2.882 3.130 -1.742 1.00 0.00 C ATOM 273 C VAL A 17 -2.443 1.772 -1.188 1.00 0.00 C ATOM 274 O VAL A 17 -1.304 1.595 -0.758 1.00 0.00 O ATOM 275 CB VAL A 17 -3.541 2.996 -3.139 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.443 4.195 -3.434 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.506 2.780 -4.253 1.00 0.00 C ATOM 0 H VAL A 17 -0.865 3.476 -2.009 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.626 3.550 -1.065 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.164 2.102 -3.118 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.894 4.078 -4.420 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.228 4.254 -2.680 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.851 5.110 -3.413 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.017 2.692 -5.212 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.821 3.628 -4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.944 1.867 -4.056 1.00 0.00 H new ATOM 287 N GLU A 18 -3.332 0.790 -1.254 1.00 0.00 N ATOM 288 CA GLU A 18 -3.111 -0.603 -0.863 1.00 0.00 C ATOM 289 C GLU A 18 -3.401 -1.465 -2.092 1.00 0.00 C ATOM 290 O GLU A 18 -4.160 -1.019 -2.955 1.00 0.00 O ATOM 291 CB GLU A 18 -4.068 -0.998 0.279 1.00 0.00 C ATOM 292 CG GLU A 18 -4.119 0.014 1.428 1.00 0.00 C ATOM 293 CD GLU A 18 -4.871 -0.556 2.644 1.00 0.00 C ATOM 294 OE1 GLU A 18 -6.125 -0.494 2.678 1.00 0.00 O ATOM 295 OE2 GLU A 18 -4.209 -1.067 3.581 1.00 0.00 O ATOM 0 H GLU A 18 -4.278 0.948 -1.600 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.089 -0.743 -0.512 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.072 -1.121 -0.128 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.764 -1.967 0.675 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.105 0.287 1.720 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.610 0.927 1.090 1.00 0.00 H new ATOM 302 N PRO A 19 -2.899 -2.709 -2.192 1.00 0.00 N ATOM 303 CA PRO A 19 -3.325 -3.619 -3.255 1.00 0.00 C ATOM 304 C PRO A 19 -4.845 -3.829 -3.292 1.00 0.00 C ATOM 305 O PRO A 19 -5.444 -3.956 -4.355 1.00 0.00 O ATOM 306 CB PRO A 19 -2.591 -4.936 -2.997 1.00 0.00 C ATOM 307 CG PRO A 19 -1.440 -4.586 -2.066 1.00 0.00 C ATOM 308 CD PRO A 19 -1.948 -3.364 -1.300 1.00 0.00 C ATOM 0 HA PRO A 19 -3.080 -3.199 -4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.254 -5.672 -2.542 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.225 -5.370 -3.928 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.205 -5.411 -1.393 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.530 -4.360 -2.622 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.426 -3.658 -0.365 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.128 -2.694 -1.042 1.00 0.00 H new ATOM 316 N SER A 20 -5.510 -3.771 -2.142 1.00 0.00 N ATOM 317 CA SER A 20 -6.938 -4.038 -2.017 1.00 0.00 C ATOM 318 C SER A 20 -7.702 -2.727 -1.986 1.00 0.00 C ATOM 319 O SER A 20 -8.890 -2.719 -1.648 1.00 0.00 O ATOM 320 CB SER A 20 -7.185 -4.909 -0.774 1.00 0.00 C ATOM 321 OG SER A 20 -6.355 -6.066 -0.798 1.00 0.00 O ATOM 0 H SER A 20 -5.064 -3.533 -1.256 1.00 0.00 H new ATOM 0 HA SER A 20 -7.304 -4.596 -2.879 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.985 -4.330 0.128 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.233 -5.207 -0.735 1.00 0.00 H new ATOM 0 HG SER A 20 -6.525 -6.607 0.001 1.00 0.00 H new ATOM 327 N ASP A 21 -7.047 -1.611 -2.332 1.00 0.00 N ATOM 328 CA ASP A 21 -7.745 -0.362 -2.449 1.00 0.00 C ATOM 329 C ASP A 21 -8.399 -0.350 -3.826 1.00 0.00 C ATOM 330 O ASP A 21 -7.845 -0.868 -4.815 1.00 0.00 O ATOM 331 CB ASP A 21 -6.786 0.809 -2.217 1.00 0.00 C ATOM 332 CG ASP A 21 -7.302 1.850 -1.205 1.00 0.00 C ATOM 333 OD1 ASP A 21 -8.507 1.862 -0.859 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.461 2.676 -0.778 1.00 0.00 O ATOM 0 H ASP A 21 -6.047 -1.565 -2.530 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.519 -0.252 -1.690 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.831 0.419 -1.866 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.598 1.305 -3.169 1.00 0.00 H new ATOM 339 N THR A 22 -9.623 0.163 -3.878 1.00 0.00 N ATOM 340 CA THR A 22 -10.450 0.094 -5.064 1.00 0.00 C ATOM 341 C THR A 22 -10.062 1.135 -6.087 1.00 0.00 C ATOM 342 O THR A 22 -9.561 2.210 -5.752 1.00 0.00 O ATOM 343 CB THR A 22 -11.931 0.248 -4.719 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.088 1.293 -3.771 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.483 -1.058 -4.173 1.00 0.00 C ATOM 0 H THR A 22 -10.066 0.639 -3.092 1.00 0.00 H new ATOM 0 HA THR A 22 -10.284 -0.892 -5.497 1.00 0.00 H new ATOM 0 HB THR A 22 -12.488 0.500 -5.621 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.037 1.394 -3.550 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.539 -0.934 -3.931 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.372 -1.842 -4.922 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.935 -1.337 -3.273 1.00 0.00 H new ATOM 353 N ILE A 23 -10.382 0.834 -7.337 1.00 0.00 N ATOM 354 CA ILE A 23 -10.298 1.770 -8.442 1.00 0.00 C ATOM 355 C ILE A 23 -11.137 3.015 -8.150 1.00 0.00 C ATOM 356 O ILE A 23 -10.685 4.098 -8.495 1.00 0.00 O ATOM 357 CB ILE A 23 -10.749 1.059 -9.722 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.968 -0.238 -10.018 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.686 1.984 -10.951 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.520 -0.360 -9.532 1.00 0.00 C ATOM 0 H ILE A 23 -10.715 -0.089 -7.615 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.270 2.107 -8.576 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.786 0.783 -9.531 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.531 -1.066 -9.588 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.966 -0.382 -11.099 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.015 1.437 -11.835 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.337 2.844 -10.793 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.662 2.327 -11.096 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.119 -1.331 -9.822 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.918 0.430 -9.981 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.491 -0.266 -8.446 1.00 0.00 H new ATOM 372 N GLU A 24 -12.298 2.906 -7.499 1.00 0.00 N ATOM 373 CA GLU A 24 -13.092 4.070 -7.099 1.00 0.00 C ATOM 374 C GLU A 24 -12.222 5.029 -6.286 1.00 0.00 C ATOM 375 O GLU A 24 -12.089 6.207 -6.619 1.00 0.00 O ATOM 376 CB GLU A 24 -14.312 3.607 -6.284 1.00 0.00 C ATOM 377 CG GLU A 24 -15.214 4.766 -5.842 1.00 0.00 C ATOM 378 CD GLU A 24 -16.466 4.249 -5.110 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.403 4.038 -3.874 1.00 0.00 O ATOM 380 OE2 GLU A 24 -17.525 4.063 -5.758 1.00 0.00 O ATOM 0 H GLU A 24 -12.713 2.012 -7.235 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.449 4.596 -7.984 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.896 2.907 -6.881 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -13.969 3.065 -5.403 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.656 5.435 -5.186 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.513 5.350 -6.712 1.00 0.00 H new ATOM 387 N ASN A 25 -11.558 4.492 -5.259 1.00 0.00 N ATOM 388 CA ASN A 25 -10.697 5.281 -4.388 1.00 0.00 C ATOM 389 C ASN A 25 -9.483 5.815 -5.154 1.00 0.00 C ATOM 390 O ASN A 25 -9.117 6.970 -4.983 1.00 0.00 O ATOM 391 CB ASN A 25 -10.325 4.463 -3.131 1.00 0.00 C ATOM 392 CG ASN A 25 -8.824 4.375 -2.918 1.00 0.00 C ATOM 393 OD1 ASN A 25 -8.221 5.211 -2.258 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.189 3.399 -3.543 1.00 0.00 N ATOM 0 H ASN A 25 -11.605 3.503 -5.013 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.237 6.162 -4.041 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.787 4.919 -2.255 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.736 3.457 -3.221 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.173 3.330 -3.482 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.715 2.715 -4.087 1.00 0.00 H new ATOM 401 N VAL A 26 -8.889 5.019 -6.042 1.00 0.00 N ATOM 402 CA VAL A 26 -7.733 5.427 -6.832 1.00 0.00 C ATOM 403 C VAL A 26 -8.144 6.598 -7.711 1.00 0.00 C ATOM 404 O VAL A 26 -7.516 7.647 -7.650 1.00 0.00 O ATOM 405 CB VAL A 26 -7.270 4.223 -7.657 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.256 4.611 -8.736 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.656 3.109 -6.803 1.00 0.00 C ATOM 0 H VAL A 26 -9.200 4.067 -6.233 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.903 5.750 -6.204 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.180 3.849 -8.125 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.959 3.722 -9.293 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.708 5.332 -9.417 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.378 5.055 -8.267 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.348 2.285 -7.447 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.788 3.496 -6.269 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.394 2.752 -6.085 1.00 0.00 H new ATOM 417 N LYS A 27 -9.212 6.467 -8.501 1.00 0.00 N ATOM 418 CA LYS A 27 -9.700 7.560 -9.332 1.00 0.00 C ATOM 419 C LYS A 27 -10.030 8.789 -8.495 1.00 0.00 C ATOM 420 O LYS A 27 -9.787 9.903 -8.954 1.00 0.00 O ATOM 421 CB LYS A 27 -10.984 7.129 -10.060 1.00 0.00 C ATOM 422 CG LYS A 27 -10.848 6.077 -11.164 1.00 0.00 C ATOM 423 CD LYS A 27 -12.262 5.795 -11.707 1.00 0.00 C ATOM 424 CE LYS A 27 -12.262 4.919 -12.966 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.622 4.870 -13.588 1.00 0.00 N ATOM 0 H LYS A 27 -9.756 5.607 -8.580 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.911 7.806 -10.043 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.682 6.747 -9.315 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.439 8.018 -10.496 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.196 6.437 -11.960 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.398 5.165 -10.772 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.851 5.305 -10.932 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -12.754 6.742 -11.931 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.543 5.311 -13.686 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.939 3.910 -12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.696 4.029 -14.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.344 4.822 -12.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.773 5.725 -14.161 1.00 0.00 H new ATOM 439 N ALA A 28 -10.552 8.629 -7.279 1.00 0.00 N ATOM 440 CA ALA A 28 -10.797 9.766 -6.394 1.00 0.00 C ATOM 441 C ALA A 28 -9.472 10.436 -6.009 1.00 0.00 C ATOM 442 O ALA A 28 -9.394 11.660 -5.987 1.00 0.00 O ATOM 443 CB ALA A 28 -11.580 9.323 -5.157 1.00 0.00 C ATOM 0 H ALA A 28 -10.813 7.725 -6.886 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.403 10.501 -6.924 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.753 10.182 -4.509 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.537 8.901 -5.464 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.008 8.570 -4.615 1.00 0.00 H new ATOM 449 N LYS A 29 -8.401 9.662 -5.791 1.00 0.00 N ATOM 450 CA LYS A 29 -7.065 10.228 -5.584 1.00 0.00 C ATOM 451 C LYS A 29 -6.597 10.935 -6.860 1.00 0.00 C ATOM 452 O LYS A 29 -6.002 11.998 -6.785 1.00 0.00 O ATOM 453 CB LYS A 29 -6.070 9.153 -5.114 1.00 0.00 C ATOM 454 CG LYS A 29 -6.425 8.638 -3.704 1.00 0.00 C ATOM 455 CD LYS A 29 -5.565 7.460 -3.215 1.00 0.00 C ATOM 456 CE LYS A 29 -5.872 7.195 -1.728 1.00 0.00 C ATOM 457 NZ LYS A 29 -4.851 7.760 -0.798 1.00 0.00 N ATOM 0 H LYS A 29 -8.435 8.643 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.114 10.971 -4.788 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.071 8.321 -5.818 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.061 9.566 -5.109 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.326 9.461 -2.996 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.472 8.334 -3.696 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.776 6.569 -3.807 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.507 7.687 -3.346 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.846 7.619 -1.486 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.943 6.119 -1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.192 7.681 0.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.960 7.232 -0.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.688 8.761 -1.028 1.00 0.00 H new ATOM 471 N ILE A 30 -6.929 10.431 -8.050 1.00 0.00 N ATOM 472 CA ILE A 30 -6.597 11.134 -9.299 1.00 0.00 C ATOM 473 C ILE A 30 -7.326 12.461 -9.334 1.00 0.00 C ATOM 474 O ILE A 30 -6.718 13.449 -9.682 1.00 0.00 O ATOM 475 CB ILE A 30 -6.920 10.317 -10.567 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.364 8.892 -10.580 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.415 11.025 -11.835 1.00 0.00 C ATOM 478 CD1 ILE A 30 -4.960 8.757 -10.034 1.00 0.00 C ATOM 0 H ILE A 30 -7.423 9.548 -8.179 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.518 11.289 -9.304 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.008 10.246 -10.553 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.028 8.252 -9.999 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.378 8.520 -11.605 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.659 10.422 -12.710 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.893 12.001 -11.922 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.334 11.155 -11.774 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.649 7.713 -10.083 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.279 9.366 -10.628 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -4.939 9.094 -8.998 1.00 0.00 H new ATOM 490 N GLN A 31 -8.593 12.534 -8.957 1.00 0.00 N ATOM 491 CA GLN A 31 -9.325 13.783 -8.902 1.00 0.00 C ATOM 492 C GLN A 31 -8.645 14.753 -7.944 1.00 0.00 C ATOM 493 O GLN A 31 -8.561 15.938 -8.260 1.00 0.00 O ATOM 494 CB GLN A 31 -10.776 13.551 -8.484 1.00 0.00 C ATOM 495 CG GLN A 31 -11.631 14.821 -8.674 1.00 0.00 C ATOM 496 CD GLN A 31 -12.262 15.253 -7.359 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.664 15.957 -6.550 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.478 14.800 -7.112 1.00 0.00 N ATOM 0 H GLN A 31 -9.143 11.721 -8.679 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.327 14.219 -9.901 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.199 12.736 -9.071 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -10.809 13.242 -7.439 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.010 15.627 -9.066 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.411 14.632 -9.411 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -13.954 14.217 -7.800 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -13.941 15.034 -6.233 1.00 0.00 H new ATOM 507 N ASP A 32 -8.095 14.255 -6.836 1.00 0.00 N ATOM 508 CA ASP A 32 -7.362 15.109 -5.917 1.00 0.00 C ATOM 509 C ASP A 32 -6.117 15.681 -6.608 1.00 0.00 C ATOM 510 O ASP A 32 -5.764 16.839 -6.360 1.00 0.00 O ATOM 511 CB ASP A 32 -6.957 14.357 -4.648 1.00 0.00 C ATOM 512 CG ASP A 32 -5.970 15.188 -3.798 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.441 15.999 -2.964 1.00 0.00 O ATOM 514 OD2 ASP A 32 -4.733 15.013 -3.944 1.00 0.00 O ATOM 0 H ASP A 32 -8.145 13.274 -6.560 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.022 15.925 -5.624 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.845 14.128 -4.059 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.498 13.405 -4.917 1.00 0.00 H new ATOM 519 N LYS A 33 -5.462 14.907 -7.489 1.00 0.00 N ATOM 520 CA LYS A 33 -4.158 15.292 -8.012 1.00 0.00 C ATOM 521 C LYS A 33 -4.268 16.020 -9.355 1.00 0.00 C ATOM 522 O LYS A 33 -3.456 16.892 -9.658 1.00 0.00 O ATOM 523 CB LYS A 33 -3.299 14.031 -8.111 1.00 0.00 C ATOM 524 CG LYS A 33 -3.217 13.188 -6.805 1.00 0.00 C ATOM 525 CD LYS A 33 -1.856 13.158 -6.097 1.00 0.00 C ATOM 526 CE LYS A 33 -1.309 14.545 -5.747 1.00 0.00 C ATOM 527 NZ LYS A 33 -1.972 15.138 -4.546 1.00 0.00 N ATOM 0 H LYS A 33 -5.817 14.020 -7.846 1.00 0.00 H new ATOM 0 HA LYS A 33 -3.687 16.005 -7.335 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.695 13.401 -8.908 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.289 14.319 -8.404 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.958 13.571 -6.104 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.502 12.163 -7.042 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.946 12.572 -5.182 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.137 12.645 -6.735 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.236 14.474 -5.567 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.446 15.211 -6.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.802 16.164 -4.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.995 14.957 -4.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.581 14.706 -3.685 1.00 0.00 H new ATOM 541 N GLU A 34 -5.318 15.714 -10.112 1.00 0.00 N ATOM 542 CA GLU A 34 -5.510 16.094 -11.502 1.00 0.00 C ATOM 543 C GLU A 34 -6.727 16.993 -11.712 1.00 0.00 C ATOM 544 O GLU A 34 -6.679 17.919 -12.523 1.00 0.00 O ATOM 545 CB GLU A 34 -5.674 14.806 -12.325 1.00 0.00 C ATOM 546 CG GLU A 34 -4.451 13.874 -12.271 1.00 0.00 C ATOM 547 CD GLU A 34 -3.110 14.621 -12.378 1.00 0.00 C ATOM 548 OE1 GLU A 34 -2.854 15.277 -13.414 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.317 14.550 -11.412 1.00 0.00 O ATOM 0 H GLU A 34 -6.097 15.165 -9.750 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.641 16.669 -11.821 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.548 14.264 -11.964 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.871 15.072 -13.364 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.472 13.312 -11.337 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.520 13.148 -13.081 1.00 0.00 H new ATOM 556 N GLY A 35 -7.809 16.742 -10.972 1.00 0.00 N ATOM 557 CA GLY A 35 -9.006 17.576 -10.987 1.00 0.00 C ATOM 558 C GLY A 35 -10.053 17.043 -11.957 1.00 0.00 C ATOM 559 O GLY A 35 -10.816 17.833 -12.509 1.00 0.00 O ATOM 0 H GLY A 35 -7.876 15.945 -10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.430 17.622 -9.984 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -8.736 18.594 -11.266 1.00 0.00 H new ATOM 563 N ILE A 36 -10.081 15.723 -12.192 1.00 0.00 N ATOM 564 CA ILE A 36 -11.043 15.089 -13.085 1.00 0.00 C ATOM 565 C ILE A 36 -11.903 14.222 -12.182 1.00 0.00 C ATOM 566 O ILE A 36 -11.328 13.427 -11.444 1.00 0.00 O ATOM 567 CB ILE A 36 -10.325 14.212 -14.126 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.333 15.006 -14.989 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.356 13.533 -15.042 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.305 14.030 -15.543 1.00 0.00 C ATOM 0 H ILE A 36 -9.429 15.067 -11.761 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.627 15.825 -13.638 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.757 13.466 -13.570 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.855 15.512 -15.801 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.844 15.778 -14.395 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.839 12.914 -15.776 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.019 12.908 -14.443 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.942 14.294 -15.557 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.587 14.569 -16.161 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.782 13.545 -14.718 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.808 13.275 -16.147 1.00 0.00 H new ATOM 582 N PRO A 37 -13.238 14.301 -12.234 1.00 0.00 N ATOM 583 CA PRO A 37 -14.097 13.447 -11.427 1.00 0.00 C ATOM 584 C PRO A 37 -13.860 11.972 -11.747 1.00 0.00 C ATOM 585 O PRO A 37 -13.568 11.643 -12.894 1.00 0.00 O ATOM 586 CB PRO A 37 -15.531 13.899 -11.701 1.00 0.00 C ATOM 587 CG PRO A 37 -15.423 15.115 -12.622 1.00 0.00 C ATOM 588 CD PRO A 37 -14.010 15.062 -13.194 1.00 0.00 C ATOM 0 HA PRO A 37 -13.879 13.541 -10.363 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.107 13.103 -12.172 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.043 14.157 -10.774 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.170 15.076 -13.415 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.590 16.041 -12.072 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.000 14.585 -14.174 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.600 16.064 -13.323 1.00 0.00 H new ATOM 596 N PRO A 38 -14.024 11.058 -10.777 1.00 0.00 N ATOM 597 CA PRO A 38 -13.826 9.635 -11.038 1.00 0.00 C ATOM 598 C PRO A 38 -14.784 9.113 -12.092 1.00 0.00 C ATOM 599 O PRO A 38 -14.391 8.299 -12.920 1.00 0.00 O ATOM 600 CB PRO A 38 -14.051 8.936 -9.699 1.00 0.00 C ATOM 601 CG PRO A 38 -14.872 9.919 -8.863 1.00 0.00 C ATOM 602 CD PRO A 38 -14.414 11.279 -9.389 1.00 0.00 C ATOM 0 HA PRO A 38 -12.827 9.446 -11.432 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.582 7.993 -9.832 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.104 8.702 -9.213 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -15.943 9.772 -9.002 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -14.671 9.809 -7.797 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.215 12.015 -9.320 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.578 11.663 -8.804 1.00 0.00 H new ATOM 610 N ASP A 39 -16.004 9.647 -12.121 1.00 0.00 N ATOM 611 CA ASP A 39 -17.023 9.174 -13.050 1.00 0.00 C ATOM 612 C ASP A 39 -16.667 9.468 -14.513 1.00 0.00 C ATOM 613 O ASP A 39 -17.217 8.838 -15.413 1.00 0.00 O ATOM 614 CB ASP A 39 -18.386 9.764 -12.671 1.00 0.00 C ATOM 615 CG ASP A 39 -19.529 9.192 -13.529 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.870 7.995 -13.370 1.00 0.00 O ATOM 617 OD2 ASP A 39 -20.117 9.947 -14.339 1.00 0.00 O ATOM 0 H ASP A 39 -16.308 10.406 -11.512 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.073 8.088 -12.967 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.588 9.561 -11.619 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.355 10.847 -12.786 1.00 0.00 H new ATOM 622 N GLN A 40 -15.697 10.361 -14.759 1.00 0.00 N ATOM 623 CA GLN A 40 -15.224 10.692 -16.110 1.00 0.00 C ATOM 624 C GLN A 40 -13.885 10.020 -16.418 1.00 0.00 C ATOM 625 O GLN A 40 -13.459 10.033 -17.570 1.00 0.00 O ATOM 626 CB GLN A 40 -15.152 12.228 -16.260 1.00 0.00 C ATOM 627 CG GLN A 40 -14.813 12.749 -17.680 1.00 0.00 C ATOM 628 CD GLN A 40 -15.846 12.385 -18.744 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.675 11.454 -19.528 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.952 13.107 -18.775 1.00 0.00 N ATOM 0 H GLN A 40 -15.216 10.876 -14.022 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.932 10.303 -16.842 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.111 12.650 -15.957 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.403 12.608 -15.565 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.713 13.834 -17.643 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.844 12.350 -17.979 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -17.078 13.876 -18.117 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.680 12.895 -19.457 1.00 0.00 H new ATOM 639 N GLN A 41 -13.201 9.418 -15.443 1.00 0.00 N ATOM 640 CA GLN A 41 -11.943 8.743 -15.721 1.00 0.00 C ATOM 641 C GLN A 41 -12.220 7.364 -16.278 1.00 0.00 C ATOM 642 O GLN A 41 -13.125 6.662 -15.834 1.00 0.00 O ATOM 643 CB GLN A 41 -11.126 8.604 -14.426 1.00 0.00 C ATOM 644 CG GLN A 41 -10.424 9.895 -13.992 1.00 0.00 C ATOM 645 CD GLN A 41 -9.999 9.796 -12.539 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.332 8.843 -12.168 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.395 10.711 -11.670 1.00 0.00 N ATOM 0 H GLN A 41 -13.497 9.387 -14.467 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.380 9.330 -16.447 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.787 8.275 -13.625 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.378 7.823 -14.562 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.553 10.074 -14.622 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.094 10.745 -14.126 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.952 11.506 -11.984 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.143 10.622 -10.686 1.00 0.00 H new ATOM 656 N ARG A 42 -11.318 6.935 -17.148 1.00 0.00 N ATOM 657 CA ARG A 42 -11.230 5.582 -17.667 1.00 0.00 C ATOM 658 C ARG A 42 -9.816 5.182 -17.315 1.00 0.00 C ATOM 659 O ARG A 42 -8.880 5.766 -17.842 1.00 0.00 O ATOM 660 CB ARG A 42 -11.520 5.652 -19.168 1.00 0.00 C ATOM 661 CG ARG A 42 -11.777 4.274 -19.782 1.00 0.00 C ATOM 662 CD ARG A 42 -12.144 4.378 -21.272 1.00 0.00 C ATOM 663 NE ARG A 42 -12.793 3.134 -21.743 1.00 0.00 N ATOM 664 CZ ARG A 42 -12.590 2.492 -22.901 1.00 0.00 C ATOM 665 NH1 ARG A 42 -11.698 2.908 -23.789 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.268 1.393 -23.191 1.00 0.00 N ATOM 0 H ARG A 42 -10.597 7.549 -17.527 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.933 4.851 -17.267 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.388 6.289 -19.337 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.677 6.121 -19.676 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.889 3.653 -19.668 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.584 3.779 -19.242 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.814 5.224 -21.428 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.246 4.570 -21.860 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.476 2.716 -21.111 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.141 3.741 -23.600 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.569 2.395 -24.661 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.953 1.027 -22.530 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.106 0.912 -24.076 1.00 0.00 H new ATOM 680 N LEU A 43 -9.644 4.332 -16.317 1.00 0.00 N ATOM 681 CA LEU A 43 -8.309 4.015 -15.833 1.00 0.00 C ATOM 682 C LEU A 43 -7.866 2.849 -16.676 1.00 0.00 C ATOM 683 O LEU A 43 -8.670 1.950 -16.902 1.00 0.00 O ATOM 684 CB LEU A 43 -8.395 3.659 -14.334 1.00 0.00 C ATOM 685 CG LEU A 43 -7.283 4.280 -13.479 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.305 5.821 -13.513 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.519 3.808 -12.042 1.00 0.00 C ATOM 0 H LEU A 43 -10.402 3.853 -15.830 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.599 4.838 -15.915 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.361 3.986 -13.949 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.359 2.575 -14.226 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.314 3.969 -13.869 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.498 6.210 -12.892 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.171 6.164 -14.539 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.261 6.180 -13.132 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.750 4.225 -11.391 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.500 4.143 -11.705 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.475 2.720 -12.005 1.00 0.00 H new ATOM 699 N ILE A 44 -6.629 2.840 -17.148 1.00 0.00 N ATOM 700 CA ILE A 44 -6.109 1.762 -17.984 1.00 0.00 C ATOM 701 C ILE A 44 -4.882 1.211 -17.284 1.00 0.00 C ATOM 702 O ILE A 44 -4.165 1.933 -16.594 1.00 0.00 O ATOM 703 CB ILE A 44 -5.905 2.255 -19.446 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.303 2.685 -19.977 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.203 1.237 -20.369 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.551 2.733 -21.494 1.00 0.00 C ATOM 0 H ILE A 44 -5.953 3.581 -16.963 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.808 0.934 -18.098 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.214 3.098 -19.446 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.040 2.007 -19.546 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.513 3.678 -19.579 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.101 1.661 -21.368 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.215 1.006 -19.971 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.796 0.324 -20.421 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.576 3.052 -21.685 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.859 3.439 -21.954 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.394 1.742 -21.920 1.00 0.00 H new ATOM 718 N PHE A 45 -4.657 -0.085 -17.457 1.00 0.00 N ATOM 719 CA PHE A 45 -3.469 -0.762 -17.003 1.00 0.00 C ATOM 720 C PHE A 45 -3.122 -1.767 -18.080 1.00 0.00 C ATOM 721 O PHE A 45 -3.947 -2.607 -18.418 1.00 0.00 O ATOM 722 CB PHE A 45 -3.745 -1.462 -15.670 1.00 0.00 C ATOM 723 CG PHE A 45 -2.591 -2.292 -15.171 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.354 -1.672 -14.943 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.745 -3.673 -14.942 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.273 -2.423 -14.456 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.670 -4.419 -14.434 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.439 -3.792 -14.175 1.00 0.00 C ATOM 0 H PHE A 45 -5.318 -0.702 -17.930 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.644 -0.069 -16.837 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.992 -0.711 -14.920 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.620 -2.102 -15.780 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.233 -0.617 -15.142 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.687 -4.156 -15.156 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.685 -1.951 -14.297 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.789 -5.475 -14.242 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.380 -4.361 -13.760 1.00 0.00 H new ATOM 738 N ALA A 46 -1.925 -1.650 -18.646 1.00 0.00 N ATOM 739 CA ALA A 46 -1.321 -2.633 -19.553 1.00 0.00 C ATOM 740 C ALA A 46 -2.188 -3.052 -20.756 1.00 0.00 C ATOM 741 O ALA A 46 -2.011 -4.135 -21.322 1.00 0.00 O ATOM 742 CB ALA A 46 -0.841 -3.822 -18.720 1.00 0.00 C ATOM 0 H ALA A 46 -1.324 -0.842 -18.483 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.476 -2.147 -20.042 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.388 -4.566 -19.375 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.104 -3.482 -17.992 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.688 -4.266 -18.198 1.00 0.00 H new ATOM 748 N GLY A 47 -3.123 -2.186 -21.150 1.00 0.00 N ATOM 749 CA GLY A 47 -3.975 -2.358 -22.323 1.00 0.00 C ATOM 750 C GLY A 47 -5.379 -2.841 -21.996 1.00 0.00 C ATOM 751 O GLY A 47 -6.153 -3.111 -22.916 1.00 0.00 O ATOM 0 H GLY A 47 -3.312 -1.320 -20.645 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.042 -1.409 -22.854 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.505 -3.070 -23.001 1.00 0.00 H new ATOM 755 N LYS A 48 -5.731 -2.910 -20.710 1.00 0.00 N ATOM 756 CA LYS A 48 -7.102 -3.141 -20.258 1.00 0.00 C ATOM 757 C LYS A 48 -7.517 -1.984 -19.381 1.00 0.00 C ATOM 758 O LYS A 48 -6.670 -1.271 -18.879 1.00 0.00 O ATOM 759 CB LYS A 48 -7.231 -4.525 -19.596 1.00 0.00 C ATOM 760 CG LYS A 48 -6.243 -4.772 -18.442 1.00 0.00 C ATOM 761 CD LYS A 48 -6.478 -6.115 -17.729 1.00 0.00 C ATOM 762 CE LYS A 48 -6.254 -7.322 -18.661 1.00 0.00 C ATOM 763 NZ LYS A 48 -6.418 -8.625 -17.959 1.00 0.00 N ATOM 0 H LYS A 48 -5.063 -2.806 -19.946 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.796 -3.171 -21.098 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.247 -4.641 -19.219 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.083 -5.293 -20.355 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.225 -4.746 -18.830 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.329 -3.962 -17.718 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.807 -6.191 -16.873 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.496 -6.144 -17.340 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.957 -7.270 -19.492 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.252 -7.266 -19.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.257 -9.403 -18.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.730 -8.690 -17.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.382 -8.693 -17.574 1.00 0.00 H new ATOM 777 N GLN A 49 -8.802 -1.756 -19.207 1.00 0.00 N ATOM 778 CA GLN A 49 -9.365 -0.669 -18.426 1.00 0.00 C ATOM 779 C GLN A 49 -10.041 -1.258 -17.193 1.00 0.00 C ATOM 780 O GLN A 49 -10.505 -2.399 -17.213 1.00 0.00 O ATOM 781 CB GLN A 49 -10.251 0.227 -19.311 1.00 0.00 C ATOM 782 CG GLN A 49 -11.560 -0.333 -19.887 1.00 0.00 C ATOM 783 CD GLN A 49 -11.370 -1.488 -20.880 1.00 0.00 C ATOM 784 OE1 GLN A 49 -11.204 -2.641 -20.488 1.00 0.00 O ATOM 785 NE2 GLN A 49 -11.349 -1.218 -22.179 1.00 0.00 N ATOM 0 H GLN A 49 -9.518 -2.350 -19.625 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.594 0.006 -18.055 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.504 1.113 -18.729 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.642 0.561 -20.151 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -12.188 -0.676 -19.065 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -12.099 0.473 -20.384 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.487 -0.261 -22.503 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.195 -1.968 -22.853 1.00 0.00 H new ATOM 794 N LEU A 50 -10.049 -0.483 -16.105 1.00 0.00 N ATOM 795 CA LEU A 50 -10.448 -0.964 -14.784 1.00 0.00 C ATOM 796 C LEU A 50 -11.746 -0.271 -14.385 1.00 0.00 C ATOM 797 O LEU A 50 -11.961 0.877 -14.773 1.00 0.00 O ATOM 798 CB LEU A 50 -9.343 -0.728 -13.729 1.00 0.00 C ATOM 799 CG LEU A 50 -7.907 -1.204 -14.006 1.00 0.00 C ATOM 800 CD1 LEU A 50 -7.222 -0.502 -15.181 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.058 -0.916 -12.763 1.00 0.00 C ATOM 0 H LEU A 50 -9.777 0.500 -16.118 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.605 -2.042 -14.830 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.299 0.344 -13.539 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.670 -1.203 -12.804 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.982 -2.263 -14.254 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.214 -0.899 -15.305 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.795 -0.675 -16.092 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.168 0.569 -14.984 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.034 -1.246 -12.937 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.064 0.155 -12.558 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.471 -1.451 -11.908 1.00 0.00 H new ATOM 813 N GLU A 51 -12.575 -0.933 -13.571 1.00 0.00 N ATOM 814 CA GLU A 51 -13.856 -0.385 -13.130 1.00 0.00 C ATOM 815 C GLU A 51 -13.823 -0.100 -11.637 1.00 0.00 C ATOM 816 O GLU A 51 -13.072 -0.729 -10.899 1.00 0.00 O ATOM 817 CB GLU A 51 -15.051 -1.233 -13.612 1.00 0.00 C ATOM 818 CG GLU A 51 -15.413 -2.412 -12.703 1.00 0.00 C ATOM 819 CD GLU A 51 -16.497 -3.312 -13.325 1.00 0.00 C ATOM 820 OE1 GLU A 51 -17.671 -2.874 -13.419 1.00 0.00 O ATOM 821 OE2 GLU A 51 -16.186 -4.470 -13.696 1.00 0.00 O ATOM 0 H GLU A 51 -12.375 -1.862 -13.201 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.018 0.580 -13.611 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.923 -0.585 -13.707 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.828 -1.616 -14.608 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.520 -3.005 -12.506 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.763 -2.034 -11.742 1.00 0.00 H new ATOM 828 N ASP A 52 -14.646 0.849 -11.199 1.00 0.00 N ATOM 829 CA ASP A 52 -14.640 1.459 -9.869 1.00 0.00 C ATOM 830 C ASP A 52 -14.715 0.432 -8.751 1.00 0.00 C ATOM 831 O ASP A 52 -14.029 0.572 -7.737 1.00 0.00 O ATOM 832 CB ASP A 52 -15.803 2.461 -9.769 1.00 0.00 C ATOM 833 CG ASP A 52 -15.454 3.800 -10.433 1.00 0.00 C ATOM 834 OD1 ASP A 52 -15.252 3.813 -11.670 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.353 4.826 -9.727 1.00 0.00 O ATOM 0 H ASP A 52 -15.377 1.236 -11.795 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.689 1.977 -9.742 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.689 2.039 -10.243 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.051 2.628 -8.721 1.00 0.00 H new ATOM 840 N GLY A 53 -15.499 -0.622 -8.962 1.00 0.00 N ATOM 841 CA GLY A 53 -15.767 -1.646 -7.965 1.00 0.00 C ATOM 842 C GLY A 53 -14.624 -2.641 -7.757 1.00 0.00 C ATOM 843 O GLY A 53 -14.744 -3.521 -6.903 1.00 0.00 O ATOM 0 H GLY A 53 -15.974 -0.788 -9.849 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.988 -1.161 -7.014 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.662 -2.195 -8.258 1.00 0.00 H new ATOM 847 N ARG A 54 -13.536 -2.544 -8.528 1.00 0.00 N ATOM 848 CA ARG A 54 -12.437 -3.507 -8.522 1.00 0.00 C ATOM 849 C ARG A 54 -11.265 -2.923 -7.763 1.00 0.00 C ATOM 850 O ARG A 54 -11.329 -1.778 -7.336 1.00 0.00 O ATOM 851 CB ARG A 54 -12.127 -3.870 -9.976 1.00 0.00 C ATOM 852 CG ARG A 54 -13.244 -4.756 -10.551 1.00 0.00 C ATOM 853 CD ARG A 54 -12.965 -5.167 -11.997 1.00 0.00 C ATOM 854 NE ARG A 54 -14.076 -5.938 -12.567 1.00 0.00 N ATOM 855 CZ ARG A 54 -14.208 -7.266 -12.595 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.292 -8.064 -12.051 1.00 0.00 N ATOM 857 NH2 ARG A 54 -15.284 -7.790 -13.175 1.00 0.00 N ATOM 0 H ARG A 54 -13.395 -1.777 -9.186 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.694 -4.431 -8.004 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.029 -2.963 -10.572 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.172 -4.393 -10.032 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.351 -5.649 -9.935 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -14.192 -4.220 -10.503 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -12.792 -4.276 -12.601 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.052 -5.761 -12.037 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.832 -5.399 -12.989 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -12.469 -7.663 -11.601 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.413 -9.076 -12.084 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -15.989 -7.179 -13.588 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -15.404 -8.802 -13.207 1.00 0.00 H new ATOM 871 N THR A 55 -10.184 -3.667 -7.591 1.00 0.00 N ATOM 872 CA THR A 55 -9.048 -3.250 -6.782 1.00 0.00 C ATOM 873 C THR A 55 -7.770 -3.449 -7.564 1.00 0.00 C ATOM 874 O THR A 55 -7.757 -4.117 -8.596 1.00 0.00 O ATOM 875 CB THR A 55 -9.015 -4.067 -5.487 1.00 0.00 C ATOM 876 OG1 THR A 55 -9.107 -5.446 -5.805 1.00 0.00 O ATOM 877 CG2 THR A 55 -10.137 -3.698 -4.520 1.00 0.00 C ATOM 0 H THR A 55 -10.069 -4.588 -8.014 1.00 0.00 H new ATOM 0 HA THR A 55 -9.144 -2.194 -6.529 1.00 0.00 H new ATOM 0 HB THR A 55 -8.073 -3.841 -4.987 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.085 -5.974 -4.980 1.00 0.00 H new ATOM 0 HG21 THR A 55 -10.060 -4.311 -3.622 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.053 -2.646 -4.249 1.00 0.00 H new ATOM 0 HG23 THR A 55 -11.101 -3.874 -4.997 1.00 0.00 H new ATOM 885 N LEU A 56 -6.681 -2.882 -7.058 1.00 0.00 N ATOM 886 CA LEU A 56 -5.383 -3.031 -7.722 1.00 0.00 C ATOM 887 C LEU A 56 -4.991 -4.510 -7.832 1.00 0.00 C ATOM 888 O LEU A 56 -4.612 -4.978 -8.905 1.00 0.00 O ATOM 889 CB LEU A 56 -4.336 -2.175 -6.983 1.00 0.00 C ATOM 890 CG LEU A 56 -4.751 -0.702 -6.881 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.638 0.125 -6.255 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.097 -0.129 -8.264 1.00 0.00 C ATOM 0 H LEU A 56 -6.665 -2.323 -6.205 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.442 -2.665 -8.747 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.184 -2.577 -5.981 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.381 -2.245 -7.503 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.637 -0.652 -6.248 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.951 1.167 -6.191 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.423 -0.251 -5.255 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.741 0.053 -6.870 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.388 0.917 -8.162 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.227 -0.202 -8.916 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.922 -0.695 -8.696 1.00 0.00 H new ATOM 904 N SER A 57 -5.200 -5.268 -6.765 1.00 0.00 N ATOM 905 CA SER A 57 -5.031 -6.712 -6.693 1.00 0.00 C ATOM 906 C SER A 57 -5.925 -7.456 -7.682 1.00 0.00 C ATOM 907 O SER A 57 -5.483 -8.471 -8.221 1.00 0.00 O ATOM 908 CB SER A 57 -5.338 -7.201 -5.275 1.00 0.00 C ATOM 909 OG SER A 57 -4.203 -7.037 -4.455 1.00 0.00 O ATOM 0 H SER A 57 -5.509 -4.870 -5.878 1.00 0.00 H new ATOM 0 HA SER A 57 -3.995 -6.925 -6.956 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.179 -6.643 -4.863 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.632 -8.250 -5.298 1.00 0.00 H new ATOM 0 HG SER A 57 -4.406 -7.350 -3.549 1.00 0.00 H new ATOM 915 N ASP A 58 -7.130 -6.963 -7.991 1.00 0.00 N ATOM 916 CA ASP A 58 -7.996 -7.619 -8.966 1.00 0.00 C ATOM 917 C ASP A 58 -7.377 -7.575 -10.370 1.00 0.00 C ATOM 918 O ASP A 58 -7.675 -8.422 -11.216 1.00 0.00 O ATOM 919 CB ASP A 58 -9.374 -6.975 -8.955 1.00 0.00 C ATOM 920 CG ASP A 58 -10.381 -7.860 -9.708 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.642 -9.001 -9.259 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.958 -7.396 -10.716 1.00 0.00 O ATOM 0 H ASP A 58 -7.522 -6.116 -7.580 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.101 -8.668 -8.687 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.706 -6.827 -7.927 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.327 -5.990 -9.419 1.00 0.00 H new ATOM 927 N TYR A 59 -6.440 -6.639 -10.572 1.00 0.00 N ATOM 928 CA TYR A 59 -5.630 -6.467 -11.770 1.00 0.00 C ATOM 929 C TYR A 59 -4.159 -6.867 -11.537 1.00 0.00 C ATOM 930 O TYR A 59 -3.322 -6.698 -12.420 1.00 0.00 O ATOM 931 CB TYR A 59 -5.803 -5.016 -12.235 1.00 0.00 C ATOM 932 CG TYR A 59 -7.195 -4.750 -12.762 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.512 -5.191 -14.059 1.00 0.00 C ATOM 934 CD2 TYR A 59 -8.186 -4.149 -11.955 1.00 0.00 C ATOM 935 CE1 TYR A 59 -8.815 -5.041 -14.559 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.495 -4.020 -12.443 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.816 -4.467 -13.749 1.00 0.00 C ATOM 938 OH TYR A 59 -11.082 -4.322 -14.233 1.00 0.00 O ATOM 0 H TYR A 59 -6.220 -5.945 -9.858 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.966 -7.138 -12.561 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.596 -4.342 -11.404 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.073 -4.796 -13.014 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.750 -5.647 -14.673 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.937 -3.790 -10.967 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.050 -5.365 -15.562 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.260 -3.579 -11.822 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.502 -5.203 -14.321 1.00 0.00 H new ATOM 948 N ASN A 60 -3.848 -7.436 -10.361 1.00 0.00 N ATOM 949 CA ASN A 60 -2.523 -7.897 -9.907 1.00 0.00 C ATOM 950 C ASN A 60 -1.457 -6.791 -9.909 1.00 0.00 C ATOM 951 O ASN A 60 -0.253 -7.055 -9.878 1.00 0.00 O ATOM 952 CB ASN A 60 -2.118 -9.202 -10.628 1.00 0.00 C ATOM 953 CG ASN A 60 -2.368 -10.438 -9.765 1.00 0.00 C ATOM 954 OD1 ASN A 60 -1.489 -11.283 -9.609 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.549 -10.576 -9.174 1.00 0.00 N ATOM 0 H ASN A 60 -4.564 -7.598 -9.653 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.601 -8.153 -8.850 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.679 -9.291 -11.558 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.062 -9.155 -10.896 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.733 -11.388 -8.585 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.273 -9.870 -9.309 1.00 0.00 H new ATOM 962 N ILE A 61 -1.913 -5.541 -9.898 1.00 0.00 N ATOM 963 CA ILE A 61 -1.105 -4.354 -9.687 1.00 0.00 C ATOM 964 C ILE A 61 -0.630 -4.424 -8.238 1.00 0.00 C ATOM 965 O ILE A 61 -1.416 -4.718 -7.332 1.00 0.00 O ATOM 966 CB ILE A 61 -1.997 -3.122 -9.932 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.487 -3.048 -11.386 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.314 -1.791 -9.560 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.766 -2.223 -11.477 1.00 0.00 C ATOM 0 H ILE A 61 -2.899 -5.324 -10.043 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.248 -4.287 -10.357 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.851 -3.258 -9.269 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.715 -2.603 -12.014 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.668 -4.053 -11.767 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.997 -0.964 -9.757 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.051 -1.800 -8.502 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.411 -1.666 -10.157 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.099 -2.181 -12.514 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.541 -2.685 -10.865 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.574 -1.212 -11.117 1.00 0.00 H new ATOM 981 N GLN A 62 0.646 -4.125 -8.025 1.00 0.00 N ATOM 982 CA GLN A 62 1.309 -4.150 -6.733 1.00 0.00 C ATOM 983 C GLN A 62 1.895 -2.759 -6.490 1.00 0.00 C ATOM 984 O GLN A 62 1.507 -1.781 -7.130 1.00 0.00 O ATOM 985 CB GLN A 62 2.370 -5.270 -6.761 1.00 0.00 C ATOM 986 CG GLN A 62 1.720 -6.652 -6.888 1.00 0.00 C ATOM 987 CD GLN A 62 2.679 -7.653 -7.518 1.00 0.00 C ATOM 988 OE1 GLN A 62 3.575 -8.200 -6.877 1.00 0.00 O ATOM 989 NE2 GLN A 62 2.520 -7.885 -8.810 1.00 0.00 N ATOM 0 H GLN A 62 1.271 -3.847 -8.782 1.00 0.00 H new ATOM 0 HA GLN A 62 0.632 -4.372 -5.908 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.050 -5.108 -7.597 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.968 -5.230 -5.851 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.415 -7.006 -5.903 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.817 -6.578 -7.494 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.770 -7.421 -9.323 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.147 -8.528 -9.294 1.00 0.00 H new ATOM 998 N LYS A 63 2.786 -2.641 -5.513 1.00 0.00 N ATOM 999 CA LYS A 63 3.538 -1.424 -5.276 1.00 0.00 C ATOM 1000 C LYS A 63 4.426 -1.117 -6.470 1.00 0.00 C ATOM 1001 O LYS A 63 4.921 -2.005 -7.163 1.00 0.00 O ATOM 1002 CB LYS A 63 4.386 -1.555 -3.999 1.00 0.00 C ATOM 1003 CG LYS A 63 5.621 -2.458 -4.134 1.00 0.00 C ATOM 1004 CD LYS A 63 6.392 -2.508 -2.807 1.00 0.00 C ATOM 1005 CE LYS A 63 7.772 -3.162 -2.967 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.715 -4.638 -3.163 1.00 0.00 N ATOM 0 H LYS A 63 3.005 -3.394 -4.861 1.00 0.00 H new ATOM 0 HA LYS A 63 2.836 -0.602 -5.140 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.712 -0.561 -3.693 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.755 -1.944 -3.199 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.315 -3.464 -4.423 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.270 -2.083 -4.925 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.513 -1.496 -2.420 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.811 -3.063 -2.071 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.282 -2.711 -3.818 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.372 -2.944 -2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.680 -5.012 -3.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.256 -5.080 -2.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.169 -4.853 -4.021 1.00 0.00 H new ATOM 1020 N GLU A 64 4.721 0.175 -6.549 1.00 0.00 N ATOM 1021 CA GLU A 64 5.605 0.789 -7.522 1.00 0.00 C ATOM 1022 C GLU A 64 5.213 0.304 -8.921 1.00 0.00 C ATOM 1023 O GLU A 64 6.055 -0.134 -9.712 1.00 0.00 O ATOM 1024 CB GLU A 64 7.089 0.562 -7.180 1.00 0.00 C ATOM 1025 CG GLU A 64 7.558 1.083 -5.822 1.00 0.00 C ATOM 1026 CD GLU A 64 9.048 0.778 -5.594 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.911 1.590 -6.007 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.363 -0.269 -4.976 1.00 0.00 O ATOM 0 H GLU A 64 4.327 0.856 -5.899 1.00 0.00 H new ATOM 0 HA GLU A 64 5.485 1.872 -7.497 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.290 -0.508 -7.224 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.695 1.032 -7.955 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.391 2.159 -5.765 1.00 0.00 H new ATOM 0 HG3 GLU A 64 6.965 0.626 -5.030 1.00 0.00 H new ATOM 1035 N SER A 65 3.908 0.357 -9.193 1.00 0.00 N ATOM 1036 CA SER A 65 3.351 -0.147 -10.452 1.00 0.00 C ATOM 1037 C SER A 65 2.695 1.008 -11.185 1.00 0.00 C ATOM 1038 O SER A 65 2.156 1.911 -10.547 1.00 0.00 O ATOM 1039 CB SER A 65 2.358 -1.298 -10.218 1.00 0.00 C ATOM 1040 OG SER A 65 2.981 -2.458 -9.690 1.00 0.00 O ATOM 0 H SER A 65 3.213 0.746 -8.555 1.00 0.00 H new ATOM 0 HA SER A 65 4.156 -0.558 -11.061 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.578 -0.966 -9.533 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.870 -1.549 -11.160 1.00 0.00 H new ATOM 0 HG SER A 65 3.547 -2.208 -8.930 1.00 0.00 H new ATOM 1046 N THR A 66 2.744 0.982 -12.511 1.00 0.00 N ATOM 1047 CA THR A 66 2.332 2.100 -13.346 1.00 0.00 C ATOM 1048 C THR A 66 0.938 1.841 -13.908 1.00 0.00 C ATOM 1049 O THR A 66 0.614 0.730 -14.315 1.00 0.00 O ATOM 1050 CB THR A 66 3.369 2.377 -14.460 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.670 2.400 -13.897 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.132 3.711 -15.201 1.00 0.00 C ATOM 0 H THR A 66 3.074 0.175 -13.041 1.00 0.00 H new ATOM 0 HA THR A 66 2.285 3.001 -12.735 1.00 0.00 H new ATOM 0 HB THR A 66 3.262 1.574 -15.190 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.328 2.574 -14.602 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.895 3.841 -15.968 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.147 3.698 -15.667 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.187 4.536 -14.491 1.00 0.00 H new ATOM 1060 N LEU A 67 0.133 2.896 -13.956 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.241 2.952 -14.427 1.00 0.00 C ATOM 1062 C LEU A 67 -1.384 4.058 -15.467 1.00 0.00 C ATOM 1063 O LEU A 67 -0.470 4.865 -15.619 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.107 3.286 -13.199 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.323 2.396 -13.033 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.892 0.979 -12.684 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.166 2.946 -11.886 1.00 0.00 C ATOM 0 H LEU A 67 0.455 3.810 -13.639 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.542 2.010 -14.885 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.491 3.210 -12.303 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.437 4.322 -13.273 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.892 2.379 -13.963 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.774 0.349 -12.567 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.266 0.582 -13.483 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.328 0.990 -11.752 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.047 2.319 -11.749 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.576 2.948 -10.969 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.477 3.964 -12.119 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.553 4.184 -16.096 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.799 5.216 -17.114 1.00 0.00 C ATOM 1081 C HIS A 68 -4.123 5.932 -16.862 1.00 0.00 C ATOM 1082 O HIS A 68 -5.124 5.280 -16.581 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.832 4.584 -18.522 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.503 4.493 -19.230 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -1.043 3.368 -19.918 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.626 5.522 -19.422 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.118 3.738 -20.483 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.397 5.019 -20.195 1.00 0.00 N ATOM 0 H HIS A 68 -3.355 3.579 -15.918 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.986 5.939 -17.052 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.248 3.580 -18.440 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.515 5.163 -19.144 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.495 2.455 -19.979 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.717 6.529 -19.043 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.741 3.094 -21.086 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.137 7.265 -16.995 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.375 8.059 -17.023 1.00 0.00 C ATOM 1098 C LEU A 69 -5.776 8.130 -18.485 1.00 0.00 C ATOM 1099 O LEU A 69 -4.987 8.592 -19.301 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.176 9.498 -16.457 1.00 0.00 C ATOM 1101 CG LEU A 69 -5.921 10.685 -17.157 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.433 10.596 -16.924 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.460 12.037 -16.633 1.00 0.00 C ATOM 0 H LEU A 69 -3.289 7.825 -17.086 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.136 7.595 -16.396 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.479 9.487 -15.410 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.109 9.718 -16.478 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.687 10.603 -18.218 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.927 11.431 -17.420 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.809 9.658 -17.332 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.639 10.636 -15.854 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.003 12.831 -17.146 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.655 12.098 -15.562 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.391 12.152 -16.814 1.00 0.00 H new ATOM 1115 N VAL A 70 -7.015 7.769 -18.780 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.685 7.948 -20.060 1.00 0.00 C ATOM 1117 C VAL A 70 -9.062 8.521 -19.709 1.00 0.00 C ATOM 1118 O VAL A 70 -9.494 8.463 -18.561 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.636 6.580 -20.772 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.424 6.537 -22.067 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -6.174 6.181 -21.070 1.00 0.00 C ATOM 0 H VAL A 70 -7.616 7.316 -18.092 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.239 8.645 -20.769 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.101 5.874 -20.083 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.343 5.544 -22.510 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.472 6.758 -21.863 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -8.025 7.277 -22.760 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.156 5.214 -21.572 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.716 6.932 -21.713 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.617 6.115 -20.135 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.755 9.129 -20.660 1.00 0.00 N ATOM 1132 CA LEU A 71 -11.080 9.702 -20.429 1.00 0.00 C ATOM 1133 C LEU A 71 -12.123 8.617 -20.695 1.00 0.00 C ATOM 1134 O LEU A 71 -11.891 7.731 -21.505 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.229 10.896 -21.390 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.470 11.763 -21.121 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -12.084 12.946 -20.240 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -13.109 12.258 -22.414 1.00 0.00 C ATOM 0 H LEU A 71 -9.417 9.241 -21.616 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.216 10.051 -19.406 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.339 11.521 -21.318 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.274 10.523 -22.413 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.208 11.145 -20.609 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.964 13.560 -20.050 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.685 12.580 -19.294 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.326 13.544 -20.746 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.982 12.866 -22.179 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.388 12.858 -22.970 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.414 11.404 -23.019 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.290 8.691 -20.060 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.441 7.817 -20.369 1.00 0.00 C ATOM 1152 C ARG A 72 -15.075 8.152 -21.716 1.00 0.00 C ATOM 1153 O ARG A 72 -15.697 7.287 -22.319 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.496 7.960 -19.251 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.401 6.721 -19.110 1.00 0.00 C ATOM 1156 CD ARG A 72 -17.148 6.819 -17.778 1.00 0.00 C ATOM 1157 NE ARG A 72 -18.185 5.783 -17.618 1.00 0.00 N ATOM 1158 CZ ARG A 72 -19.062 5.742 -16.605 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -19.045 6.708 -15.692 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -19.952 4.757 -16.515 1.00 0.00 N ATOM 0 H ARG A 72 -13.474 9.359 -19.312 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.078 6.791 -20.426 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -14.989 8.142 -18.303 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.116 8.834 -19.454 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.108 6.671 -19.938 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.804 5.809 -19.144 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.432 6.737 -16.960 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.611 7.803 -17.699 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.239 5.049 -18.325 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.370 7.469 -15.767 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.707 6.688 -14.916 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.972 4.022 -17.222 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.614 4.737 -15.739 1.00 0.00 H new ATOM 1174 N LEU A 73 -14.924 9.412 -22.157 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.653 9.985 -23.296 1.00 0.00 C ATOM 1176 C LEU A 73 -17.151 9.827 -22.969 1.00 0.00 C ATOM 1177 O LEU A 73 -17.949 9.494 -23.845 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.247 9.389 -24.677 1.00 0.00 C ATOM 1179 CG LEU A 73 -13.790 9.457 -25.186 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.273 10.843 -25.587 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -12.801 8.722 -24.292 1.00 0.00 C ATOM 0 H LEU A 73 -14.279 10.072 -21.722 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.395 11.037 -23.418 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.530 8.336 -24.664 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.869 9.876 -25.428 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.853 8.914 -26.129 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.240 10.762 -25.927 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.890 11.242 -26.392 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.321 11.512 -24.728 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.798 8.811 -24.709 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.819 9.159 -23.294 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.077 7.669 -24.232 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.531 9.992 -21.682 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.919 9.781 -21.233 1.00 0.00 C ATOM 1195 C ARG A 74 -19.860 10.698 -22.026 1.00 0.00 C ATOM 1196 O ARG A 74 -20.935 10.277 -22.450 1.00 0.00 O ATOM 1197 CB ARG A 74 -19.024 9.979 -19.704 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.443 10.148 -19.129 1.00 0.00 C ATOM 1199 CD ARG A 74 -21.383 8.950 -19.337 1.00 0.00 C ATOM 1200 NE ARG A 74 -22.767 9.361 -19.064 1.00 0.00 N ATOM 1201 CZ ARG A 74 -23.482 9.203 -17.946 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -23.061 8.417 -16.956 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -24.629 9.860 -17.834 1.00 0.00 N ATOM 0 H ARG A 74 -16.892 10.271 -20.938 1.00 0.00 H new ATOM 0 HA ARG A 74 -19.227 8.754 -21.432 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.558 9.123 -19.216 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -18.439 10.858 -19.433 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -20.363 10.345 -18.060 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -20.898 11.029 -19.582 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -21.297 8.580 -20.359 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -21.098 8.131 -18.676 1.00 0.00 H new ATOM 0 HE ARG A 74 -23.247 9.831 -19.832 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.175 7.919 -17.042 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -23.625 8.313 -16.113 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -24.945 10.467 -18.590 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -25.195 9.758 -16.992 1.00 0.00 H new ATOM 1217 N GLY A 75 -19.427 11.943 -22.226 1.00 0.00 N ATOM 1218 CA GLY A 75 -20.109 12.957 -23.026 1.00 0.00 C ATOM 1219 C GLY A 75 -21.295 13.587 -22.286 1.00 0.00 C ATOM 1220 O GLY A 75 -21.340 14.810 -22.135 1.00 0.00 O ATOM 0 H GLY A 75 -18.557 12.285 -21.818 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -19.399 13.738 -23.300 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -20.461 12.507 -23.954 1.00 0.00 H new ATOM 1224 N GLY A 76 -22.230 12.779 -21.784 1.00 0.00 N ATOM 1225 CA GLY A 76 -23.435 13.200 -21.083 1.00 0.00 C ATOM 1226 C GLY A 76 -24.143 11.967 -20.536 1.00 0.00 C ATOM 1227 O GLY A 76 -24.846 12.081 -19.511 1.00 0.00 O ATOM 1228 OXT GLY A 76 -23.970 10.871 -21.110 1.00 0.00 O ATOM 0 H GLY A 76 -22.160 11.764 -21.861 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -23.180 13.880 -20.270 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -24.094 13.744 -21.759 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -12.807 23.157 -42.426 1.00 0.00 N ATOM 1234 CA GLY B -3 -12.987 21.766 -42.911 1.00 0.00 C ATOM 1235 C GLY B -3 -14.170 21.076 -42.238 1.00 0.00 C ATOM 1236 O GLY B -3 -15.323 21.283 -42.639 1.00 0.00 O ATOM 0 H1 GLY B -3 -11.993 23.590 -42.908 1.00 0.00 H new ATOM 0 H2 GLY B -3 -13.664 23.709 -42.630 1.00 0.00 H new ATOM 0 H3 GLY B -3 -12.637 23.148 -41.400 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -13.138 21.775 -43.990 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -12.078 21.195 -42.721 1.00 0.00 H new ATOM 1242 N HIS B -2 -13.908 20.229 -41.232 1.00 0.00 N ATOM 1243 CA HIS B -2 -14.913 19.403 -40.554 1.00 0.00 C ATOM 1244 C HIS B -2 -14.492 19.186 -39.100 1.00 0.00 C ATOM 1245 O HIS B -2 -13.308 19.308 -38.773 1.00 0.00 O ATOM 1246 CB HIS B -2 -15.034 18.066 -41.310 1.00 0.00 C ATOM 1247 CG HIS B -2 -16.082 17.131 -40.760 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -17.341 17.509 -40.282 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -15.961 15.775 -40.672 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -17.952 16.362 -39.934 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -17.144 15.307 -40.148 1.00 0.00 N ATOM 0 H HIS B -2 -12.968 20.097 -40.859 1.00 0.00 H new ATOM 0 HA HIS B -2 -15.885 19.895 -40.552 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -15.262 18.273 -42.355 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -14.068 17.562 -41.289 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -15.104 15.184 -40.958 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -18.954 16.297 -39.537 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -17.369 14.331 -39.955 1.00 0.00 H new ATOM 1259 N MET B -1 -15.440 18.826 -38.225 1.00 0.00 N ATOM 1260 CA MET B -1 -15.201 18.640 -36.789 1.00 0.00 C ATOM 1261 C MET B -1 -14.238 17.482 -36.477 1.00 0.00 C ATOM 1262 O MET B -1 -13.752 17.395 -35.354 1.00 0.00 O ATOM 1263 CB MET B -1 -16.532 18.483 -36.030 1.00 0.00 C ATOM 1264 CG MET B -1 -17.264 17.164 -36.325 1.00 0.00 C ATOM 1265 SD MET B -1 -18.857 16.958 -35.475 1.00 0.00 S ATOM 1266 CE MET B -1 -19.872 18.187 -36.353 1.00 0.00 C ATOM 0 H MET B -1 -16.407 18.654 -38.499 1.00 0.00 H new ATOM 0 HA MET B -1 -14.703 19.544 -36.438 1.00 0.00 H new ATOM 0 HB2 MET B -1 -16.339 18.548 -34.959 1.00 0.00 H new ATOM 0 HB3 MET B -1 -17.186 19.316 -36.287 1.00 0.00 H new ATOM 0 HG2 MET B -1 -17.432 17.092 -37.400 1.00 0.00 H new ATOM 0 HG3 MET B -1 -16.612 16.335 -36.048 1.00 0.00 H new ATOM 0 HE1 MET B -1 -20.913 18.085 -36.046 1.00 0.00 H new ATOM 0 HE2 MET B -1 -19.519 19.190 -36.112 1.00 0.00 H new ATOM 0 HE3 MET B -1 -19.793 18.023 -37.428 1.00 0.00 H new ATOM 1276 N ASP B 674 -13.941 16.610 -37.447 1.00 0.00 N ATOM 1277 CA ASP B 674 -12.933 15.556 -37.335 1.00 0.00 C ATOM 1278 C ASP B 674 -11.569 16.090 -36.904 1.00 0.00 C ATOM 1279 O ASP B 674 -10.820 15.387 -36.224 1.00 0.00 O ATOM 1280 CB ASP B 674 -12.822 14.826 -38.680 1.00 0.00 C ATOM 1281 CG ASP B 674 -11.641 13.838 -38.708 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -11.801 12.693 -38.224 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -10.573 14.183 -39.272 1.00 0.00 O ATOM 0 H ASP B 674 -14.408 16.620 -38.354 1.00 0.00 H new ATOM 0 HA ASP B 674 -13.254 14.865 -36.555 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -13.749 14.288 -38.877 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -12.702 15.557 -39.480 1.00 0.00 H new ATOM 1288 N GLU B 675 -11.255 17.348 -37.238 1.00 0.00 N ATOM 1289 CA GLU B 675 -9.970 17.934 -36.906 1.00 0.00 C ATOM 1290 C GLU B 675 -9.899 18.364 -35.428 1.00 0.00 C ATOM 1291 O GLU B 675 -8.814 18.627 -34.910 1.00 0.00 O ATOM 1292 CB GLU B 675 -9.725 19.107 -37.877 1.00 0.00 C ATOM 1293 CG GLU B 675 -8.307 19.684 -37.798 1.00 0.00 C ATOM 1294 CD GLU B 675 -8.049 20.691 -38.935 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -8.375 21.893 -38.774 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -7.493 20.294 -39.990 1.00 0.00 O ATOM 0 H GLU B 675 -11.884 17.975 -37.741 1.00 0.00 H new ATOM 0 HA GLU B 675 -9.178 17.194 -37.023 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -9.915 18.770 -38.896 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -10.443 19.899 -37.665 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -8.165 20.175 -36.835 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -7.579 18.875 -37.854 1.00 0.00 H new ATOM 1303 N LYS B 676 -11.037 18.435 -34.721 1.00 0.00 N ATOM 1304 CA LYS B 676 -11.135 19.044 -33.391 1.00 0.00 C ATOM 1305 C LYS B 676 -10.605 18.170 -32.243 1.00 0.00 C ATOM 1306 O LYS B 676 -10.970 18.397 -31.084 1.00 0.00 O ATOM 1307 CB LYS B 676 -12.574 19.564 -33.161 1.00 0.00 C ATOM 1308 CG LYS B 676 -13.057 20.650 -34.145 1.00 0.00 C ATOM 1309 CD LYS B 676 -12.714 22.091 -33.732 1.00 0.00 C ATOM 1310 CE LYS B 676 -11.204 22.346 -33.540 1.00 0.00 C ATOM 1311 NZ LYS B 676 -10.897 23.795 -33.380 1.00 0.00 N ATOM 0 H LYS B 676 -11.924 18.066 -35.063 1.00 0.00 H new ATOM 0 HA LYS B 676 -10.454 19.895 -33.376 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -13.260 18.718 -33.216 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -12.640 19.962 -32.148 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -12.620 20.454 -35.124 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -14.138 20.566 -34.255 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -13.094 22.776 -34.490 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -13.233 22.325 -32.802 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -10.854 21.802 -32.663 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -10.658 21.953 -34.398 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -9.872 23.921 -33.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -11.207 24.311 -34.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -11.397 24.166 -32.547 1.00 0.00 H new ATOM 1325 N ILE B 677 -9.725 17.214 -32.542 1.00 0.00 N ATOM 1326 CA ILE B 677 -8.986 16.499 -31.509 1.00 0.00 C ATOM 1327 C ILE B 677 -8.137 17.566 -30.815 1.00 0.00 C ATOM 1328 O ILE B 677 -7.515 18.399 -31.492 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.050 15.408 -32.083 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -8.736 14.440 -33.073 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.360 14.632 -30.937 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.844 13.568 -32.476 1.00 0.00 C ATOM 0 H ILE B 677 -9.508 16.919 -33.494 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.680 15.985 -30.843 1.00 0.00 H new ATOM 0 HB ILE B 677 -7.299 15.936 -32.670 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -9.157 15.023 -33.892 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -7.976 13.788 -33.503 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -6.705 13.869 -31.357 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.771 15.322 -30.333 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.116 14.157 -30.312 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -10.260 12.926 -33.252 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -9.431 12.951 -31.678 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -10.631 14.205 -32.072 1.00 0.00 H new ATOM 1344 N THR B 678 -8.045 17.529 -29.492 1.00 0.00 N ATOM 1345 CA THR B 678 -7.135 18.365 -28.747 1.00 0.00 C ATOM 1346 C THR B 678 -6.407 17.545 -27.676 1.00 0.00 C ATOM 1347 O THR B 678 -6.877 16.511 -27.193 1.00 0.00 O ATOM 1348 CB THR B 678 -7.912 19.599 -28.272 1.00 0.00 C ATOM 1349 OG1 THR B 678 -7.009 20.617 -27.878 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.928 19.349 -27.159 1.00 0.00 C ATOM 0 H THR B 678 -8.608 16.910 -28.908 1.00 0.00 H new ATOM 0 HA THR B 678 -6.316 18.748 -29.356 1.00 0.00 H new ATOM 0 HB THR B 678 -8.504 19.908 -29.134 1.00 0.00 H new ATOM 0 HG1 THR B 678 -7.512 21.402 -27.578 1.00 0.00 H new ATOM 0 HG21 THR B 678 -9.420 20.286 -26.899 1.00 0.00 H new ATOM 0 HG22 THR B 678 -9.673 18.630 -27.501 1.00 0.00 H new ATOM 0 HG23 THR B 678 -8.417 18.952 -26.282 1.00 0.00 H new ATOM 1358 N PHE B 679 -5.214 18.031 -27.335 1.00 0.00 N ATOM 1359 CA PHE B 679 -4.246 17.394 -26.456 1.00 0.00 C ATOM 1360 C PHE B 679 -3.843 18.456 -25.412 1.00 0.00 C ATOM 1361 O PHE B 679 -2.880 19.200 -25.624 1.00 0.00 O ATOM 1362 CB PHE B 679 -3.062 16.852 -27.277 1.00 0.00 C ATOM 1363 CG PHE B 679 -3.332 15.553 -28.026 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -3.252 14.308 -27.369 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.638 15.582 -29.400 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.469 13.110 -28.068 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.843 14.385 -30.109 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.752 13.148 -29.446 1.00 0.00 C ATOM 0 H PHE B 679 -4.883 18.930 -27.686 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.655 16.526 -25.939 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.762 17.613 -27.998 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -2.217 16.697 -26.607 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -3.021 14.276 -26.315 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.716 16.529 -29.913 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.419 12.163 -27.550 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -4.071 14.416 -31.164 1.00 0.00 H new ATOM 0 HZ PHE B 679 -3.899 12.229 -29.994 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.645 18.626 -24.345 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.458 19.636 -23.302 1.00 0.00 C ATOM 1380 C PRO B 680 -3.283 19.281 -22.377 1.00 0.00 C ATOM 1381 O PRO B 680 -2.630 18.252 -22.526 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.784 19.618 -22.520 1.00 0.00 C ATOM 1383 CG PRO B 680 -6.131 18.134 -22.582 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.814 17.816 -24.036 1.00 0.00 C ATOM 0 HA PRO B 680 -4.222 20.615 -23.719 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.665 19.972 -21.496 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.547 20.241 -22.986 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.531 17.542 -21.891 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -7.177 17.945 -22.338 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.608 16.755 -24.173 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.652 18.065 -24.688 1.00 0.00 H new ATOM 1392 N SER B 681 -3.115 20.059 -21.309 1.00 0.00 N ATOM 1393 CA SER B 681 -2.218 19.827 -20.174 1.00 0.00 C ATOM 1394 C SER B 681 -2.501 18.535 -19.369 1.00 0.00 C ATOM 1395 O SER B 681 -1.927 18.344 -18.294 1.00 0.00 O ATOM 1396 CB SER B 681 -2.289 21.083 -19.294 1.00 0.00 C ATOM 1397 OG SER B 681 -3.613 21.600 -19.202 1.00 0.00 O ATOM 0 H SER B 681 -3.638 20.929 -21.205 1.00 0.00 H new ATOM 0 HA SER B 681 -1.211 19.657 -20.555 1.00 0.00 H new ATOM 0 HB2 SER B 681 -1.923 20.846 -18.295 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.629 21.849 -19.702 1.00 0.00 H new ATOM 0 HG SER B 681 -3.614 22.397 -18.632 1.00 0.00 H new ATOM 1403 N ASP B 682 -3.341 17.631 -19.886 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.682 16.347 -19.270 1.00 0.00 C ATOM 1405 C ASP B 682 -3.576 15.159 -20.238 1.00 0.00 C ATOM 1406 O ASP B 682 -3.482 14.018 -19.781 1.00 0.00 O ATOM 1407 CB ASP B 682 -5.089 16.398 -18.679 1.00 0.00 C ATOM 1408 CG ASP B 682 -5.127 17.118 -17.323 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -5.248 18.368 -17.312 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.074 16.432 -16.281 1.00 0.00 O ATOM 0 H ASP B 682 -3.818 17.780 -20.775 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.947 16.185 -18.482 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.755 16.906 -19.376 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.467 15.383 -18.559 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.589 15.374 -21.562 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.496 14.318 -22.564 1.00 0.00 C ATOM 1417 C ILE B 683 -2.573 14.828 -23.680 1.00 0.00 C ATOM 1418 O ILE B 683 -2.815 15.911 -24.197 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.901 13.911 -23.085 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.785 13.150 -22.069 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.782 13.027 -24.342 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -6.350 13.900 -20.869 1.00 0.00 C ATOM 0 H ILE B 683 -3.666 16.307 -21.967 1.00 0.00 H new ATOM 0 HA ILE B 683 -3.075 13.409 -22.134 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.388 14.863 -23.295 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -6.626 12.727 -22.618 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -5.200 12.313 -21.687 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.778 12.753 -24.690 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -4.262 13.577 -25.126 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -4.222 12.124 -24.100 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.945 13.218 -20.261 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.531 14.299 -20.271 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.979 14.720 -21.216 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.554 14.059 -24.076 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.534 14.400 -25.080 1.00 0.00 C ATOM 1436 C ASP B 684 -0.323 13.190 -26.007 1.00 0.00 C ATOM 1437 O ASP B 684 -0.480 12.054 -25.543 1.00 0.00 O ATOM 1438 CB ASP B 684 0.784 14.718 -24.372 1.00 0.00 C ATOM 1439 CG ASP B 684 1.912 15.050 -25.352 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.605 14.111 -25.803 1.00 0.00 O ATOM 1441 OD2 ASP B 684 2.103 16.251 -25.659 1.00 0.00 O ATOM 0 H ASP B 684 -1.408 13.129 -23.684 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.860 15.264 -25.659 1.00 0.00 H new ATOM 0 HB2 ASP B 684 0.635 15.560 -23.696 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.078 13.866 -23.760 1.00 0.00 H new ATOM 1446 N PRO B 685 0.003 13.375 -27.302 1.00 0.00 N ATOM 1447 CA PRO B 685 0.180 12.260 -28.224 1.00 0.00 C ATOM 1448 C PRO B 685 1.185 11.199 -27.766 1.00 0.00 C ATOM 1449 O PRO B 685 1.000 10.040 -28.126 1.00 0.00 O ATOM 1450 CB PRO B 685 0.609 12.875 -29.562 1.00 0.00 C ATOM 1451 CG PRO B 685 0.026 14.282 -29.507 1.00 0.00 C ATOM 1452 CD PRO B 685 0.133 14.634 -28.025 1.00 0.00 C ATOM 0 HA PRO B 685 -0.761 11.714 -28.292 1.00 0.00 H new ATOM 0 HB2 PRO B 685 1.694 12.893 -29.666 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.217 12.310 -30.408 1.00 0.00 H new ATOM 0 HG2 PRO B 685 0.588 14.978 -30.130 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -1.007 14.306 -29.855 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.087 15.113 -27.806 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.650 15.334 -27.733 1.00 0.00 H new ATOM 1460 N GLN B 686 2.230 11.529 -26.991 1.00 0.00 N ATOM 1461 CA GLN B 686 3.283 10.564 -26.679 1.00 0.00 C ATOM 1462 C GLN B 686 2.689 9.333 -25.975 1.00 0.00 C ATOM 1463 O GLN B 686 2.841 8.213 -26.466 1.00 0.00 O ATOM 1464 CB GLN B 686 4.450 11.216 -25.902 1.00 0.00 C ATOM 1465 CG GLN B 686 4.131 11.449 -24.419 1.00 0.00 C ATOM 1466 CD GLN B 686 5.147 12.245 -23.617 1.00 0.00 C ATOM 1467 OE1 GLN B 686 6.294 12.463 -24.001 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.722 12.632 -22.423 1.00 0.00 N ATOM 0 H GLN B 686 2.364 12.450 -26.574 1.00 0.00 H new ATOM 0 HA GLN B 686 3.723 10.213 -27.612 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.332 10.580 -25.982 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.701 12.169 -26.368 1.00 0.00 H new ATOM 0 HG2 GLN B 686 3.171 11.961 -24.354 1.00 0.00 H new ATOM 0 HG3 GLN B 686 4.007 10.477 -23.941 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.764 12.436 -22.134 1.00 0.00 H new ATOM 0 HE22 GLN B 686 5.353 13.126 -21.793 1.00 0.00 H new ATOM 1477 N VAL B 687 1.952 9.519 -24.868 1.00 0.00 N ATOM 1478 CA VAL B 687 1.397 8.429 -24.106 1.00 0.00 C ATOM 1479 C VAL B 687 0.370 7.720 -24.970 1.00 0.00 C ATOM 1480 O VAL B 687 0.264 6.508 -24.886 1.00 0.00 O ATOM 1481 CB VAL B 687 0.786 8.983 -22.812 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.524 7.846 -21.819 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.701 10.022 -22.140 1.00 0.00 C ATOM 0 H VAL B 687 1.733 10.440 -24.489 1.00 0.00 H new ATOM 0 HA VAL B 687 2.163 7.707 -23.823 1.00 0.00 H new ATOM 0 HB VAL B 687 -0.149 9.470 -23.087 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.091 8.253 -20.906 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.168 7.129 -22.261 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.463 7.345 -21.583 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.229 10.387 -21.228 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.657 9.560 -21.894 1.00 0.00 H new ATOM 0 HG23 VAL B 687 1.866 10.856 -22.822 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.342 8.444 -25.835 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.305 7.863 -26.748 1.00 0.00 C ATOM 1495 C PHE B 688 -0.644 6.890 -27.733 1.00 0.00 C ATOM 1496 O PHE B 688 -1.179 5.813 -27.992 1.00 0.00 O ATOM 1497 CB PHE B 688 -2.040 8.994 -27.473 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.372 8.565 -28.026 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.315 8.008 -27.151 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.687 8.745 -29.382 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.579 7.639 -27.621 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -4.948 8.351 -29.860 1.00 0.00 C ATOM 1503 CZ PHE B 688 -5.888 7.789 -28.980 1.00 0.00 C ATOM 0 H PHE B 688 -0.260 9.457 -25.916 1.00 0.00 H new ATOM 0 HA PHE B 688 -2.024 7.272 -26.181 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -2.189 9.825 -26.783 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.416 9.363 -28.287 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -4.064 7.863 -26.110 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -2.964 9.184 -30.054 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.315 7.240 -26.939 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -5.195 8.480 -30.904 1.00 0.00 H new ATOM 0 HZ PHE B 688 -6.851 7.472 -29.352 1.00 0.00 H new ATOM 1513 N TYR B 689 0.536 7.234 -28.246 1.00 0.00 N ATOM 1514 CA TYR B 689 1.320 6.379 -29.126 1.00 0.00 C ATOM 1515 C TYR B 689 1.974 5.217 -28.381 1.00 0.00 C ATOM 1516 O TYR B 689 2.344 4.219 -29.002 1.00 0.00 O ATOM 1517 CB TYR B 689 2.382 7.223 -29.837 1.00 0.00 C ATOM 1518 CG TYR B 689 1.867 8.362 -30.706 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.595 8.302 -31.311 1.00 0.00 C ATOM 1520 CD2 TYR B 689 2.689 9.482 -30.933 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.150 9.341 -32.145 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.255 10.526 -31.773 1.00 0.00 C ATOM 1523 CZ TYR B 689 0.982 10.458 -32.388 1.00 0.00 C ATOM 1524 OH TYR B 689 0.547 11.455 -33.215 1.00 0.00 O ATOM 0 H TYR B 689 0.980 8.133 -28.056 1.00 0.00 H new ATOM 0 HA TYR B 689 0.641 5.940 -29.857 1.00 0.00 H new ATOM 0 HB2 TYR B 689 3.048 7.642 -29.082 1.00 0.00 H new ATOM 0 HB3 TYR B 689 2.984 6.562 -30.461 1.00 0.00 H new ATOM 0 HD1 TYR B 689 -0.043 7.449 -31.132 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.658 9.541 -30.460 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.828 9.287 -32.601 1.00 0.00 H new ATOM 0 HE2 TYR B 689 2.894 11.379 -31.948 1.00 0.00 H new ATOM 0 HH TYR B 689 1.234 12.151 -33.278 1.00 0.00 H new ATOM 1534 N GLU B 690 2.126 5.348 -27.066 1.00 0.00 N ATOM 1535 CA GLU B 690 2.917 4.436 -26.248 1.00 0.00 C ATOM 1536 C GLU B 690 2.039 3.401 -25.542 1.00 0.00 C ATOM 1537 O GLU B 690 2.467 2.259 -25.350 1.00 0.00 O ATOM 1538 CB GLU B 690 3.724 5.310 -25.263 1.00 0.00 C ATOM 1539 CG GLU B 690 3.952 4.716 -23.875 1.00 0.00 C ATOM 1540 CD GLU B 690 4.724 5.680 -22.966 1.00 0.00 C ATOM 1541 OE1 GLU B 690 4.085 6.550 -22.331 1.00 0.00 O ATOM 1542 OE2 GLU B 690 5.968 5.573 -22.852 1.00 0.00 O ATOM 0 H GLU B 690 1.696 6.103 -26.531 1.00 0.00 H new ATOM 0 HA GLU B 690 3.596 3.847 -26.864 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.695 5.524 -25.709 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.209 6.264 -25.148 1.00 0.00 H new ATOM 0 HG2 GLU B 690 2.991 4.477 -23.419 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.504 3.780 -23.966 1.00 0.00 H new ATOM 1549 N LEU B 691 0.821 3.787 -25.155 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.161 2.882 -24.584 1.00 0.00 C ATOM 1551 C LEU B 691 -0.565 1.828 -25.626 1.00 0.00 C ATOM 1552 O LEU B 691 -0.239 1.946 -26.813 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.333 3.670 -23.957 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.263 4.504 -24.860 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -3.067 3.695 -25.866 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -3.240 5.276 -23.963 1.00 0.00 C ATOM 0 H LEU B 691 0.492 4.749 -25.233 1.00 0.00 H new ATOM 0 HA LEU B 691 0.270 2.324 -23.753 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.956 2.955 -23.420 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -0.910 4.345 -23.213 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.617 5.159 -25.445 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.692 4.366 -26.456 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.387 3.157 -26.527 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.699 2.982 -25.337 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.908 5.874 -24.583 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -3.826 4.572 -23.372 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.681 5.932 -23.296 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.285 0.807 -25.155 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.741 -0.314 -25.969 1.00 0.00 C ATOM 1570 C ALA B 692 -2.403 0.182 -27.246 1.00 0.00 C ATOM 1571 O ALA B 692 -3.375 0.933 -27.184 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.720 -1.152 -25.144 1.00 0.00 C ATOM 0 H ALA B 692 -1.571 0.738 -24.178 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.887 -0.927 -26.258 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -3.070 -1.995 -25.740 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.218 -1.523 -24.251 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.571 -0.536 -24.853 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.920 -0.267 -28.403 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.420 0.207 -29.691 1.00 0.00 C ATOM 1580 C GLU B 693 -3.920 0.006 -29.788 1.00 0.00 C ATOM 1581 O GLU B 693 -4.622 0.896 -30.246 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.748 -0.548 -30.835 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.353 0.036 -31.108 1.00 0.00 C ATOM 1584 CD GLU B 693 0.389 -0.767 -32.193 1.00 0.00 C ATOM 1585 OE1 GLU B 693 1.104 -1.741 -31.847 1.00 0.00 O ATOM 1586 OE2 GLU B 693 0.276 -0.427 -33.397 1.00 0.00 O ATOM 0 H GLU B 693 -1.178 -0.963 -28.474 1.00 0.00 H new ATOM 0 HA GLU B 693 -2.189 1.270 -29.767 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.665 -1.605 -30.584 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.361 -0.481 -31.734 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.447 1.075 -31.423 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.231 0.033 -30.188 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.427 -1.126 -29.301 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.844 -1.409 -29.425 1.00 0.00 C ATOM 1595 C ALA B 694 -6.682 -0.372 -28.653 1.00 0.00 C ATOM 1596 O ALA B 694 -7.737 0.053 -29.128 1.00 0.00 O ATOM 1597 CB ALA B 694 -6.107 -2.832 -28.938 1.00 0.00 C ATOM 0 H ALA B 694 -3.883 -1.847 -28.826 1.00 0.00 H new ATOM 0 HA ALA B 694 -6.145 -1.335 -30.470 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -7.170 -3.056 -29.027 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.536 -3.535 -29.544 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.803 -2.922 -27.895 1.00 0.00 H new ATOM 1603 N VAL B 695 -6.179 0.085 -27.497 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.784 1.169 -26.719 1.00 0.00 C ATOM 1605 C VAL B 695 -6.673 2.470 -27.508 1.00 0.00 C ATOM 1606 O VAL B 695 -7.661 3.194 -27.587 1.00 0.00 O ATOM 1607 CB VAL B 695 -6.131 1.245 -25.321 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.246 2.603 -24.614 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.754 0.207 -24.384 1.00 0.00 C ATOM 0 H VAL B 695 -5.332 -0.294 -27.074 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.844 0.980 -26.552 1.00 0.00 H new ATOM 0 HB VAL B 695 -5.075 1.061 -25.517 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.756 2.550 -23.642 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.766 3.371 -25.221 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.298 2.854 -24.477 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.283 0.273 -23.403 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.823 0.399 -24.287 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.600 -0.791 -24.793 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.522 2.779 -28.116 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.359 3.978 -28.927 1.00 0.00 C ATOM 1621 C GLN B 696 -6.381 3.988 -30.060 1.00 0.00 C ATOM 1622 O GLN B 696 -7.041 4.997 -30.249 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.926 4.051 -29.463 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.628 5.275 -30.330 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.426 4.995 -31.224 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.526 4.979 -32.447 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -1.281 4.706 -30.627 1.00 0.00 N ATOM 0 H GLN B 696 -4.683 2.203 -28.056 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.536 4.861 -28.312 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -3.236 4.044 -28.619 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.725 3.152 -30.046 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.497 5.520 -30.940 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.429 6.140 -29.698 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -1.218 4.725 -29.609 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.462 4.465 -31.185 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.553 2.890 -30.797 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.508 2.830 -31.907 1.00 0.00 C ATOM 1638 C LYS B 697 -8.929 3.053 -31.399 1.00 0.00 C ATOM 1639 O LYS B 697 -9.666 3.853 -31.969 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.411 1.469 -32.621 1.00 0.00 C ATOM 1641 CG LYS B 697 -6.055 1.200 -33.293 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.629 2.226 -34.359 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.604 2.397 -35.541 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.705 1.179 -36.395 1.00 0.00 N ATOM 0 H LYS B 697 -6.039 2.022 -30.644 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.262 3.619 -32.617 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.607 0.678 -31.897 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.195 1.412 -33.376 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.287 1.164 -32.520 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -6.088 0.214 -33.756 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.498 3.194 -33.875 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.656 1.932 -34.753 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.593 2.647 -35.156 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -6.279 3.238 -36.154 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.374 1.354 -37.172 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.769 0.952 -36.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -7.042 0.380 -35.821 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.300 2.363 -30.320 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.642 2.457 -29.744 1.00 0.00 C ATOM 1660 C GLU B 698 -10.919 3.893 -29.279 1.00 0.00 C ATOM 1661 O GLU B 698 -11.968 4.466 -29.583 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.768 1.452 -28.586 1.00 0.00 C ATOM 1663 CG GLU B 698 -12.194 1.401 -28.024 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.286 0.456 -26.819 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -12.081 0.932 -25.675 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.593 -0.747 -27.001 1.00 0.00 O ATOM 0 H GLU B 698 -8.680 1.724 -29.822 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.388 2.208 -30.499 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -10.479 0.460 -28.934 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -10.074 1.726 -27.791 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -12.506 2.402 -27.728 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -12.882 1.070 -28.802 1.00 0.00 H new ATOM 1673 N LEU B 699 -9.949 4.498 -28.585 1.00 0.00 N ATOM 1674 CA LEU B 699 -10.023 5.864 -28.090 1.00 0.00 C ATOM 1675 C LEU B 699 -10.126 6.811 -29.258 1.00 0.00 C ATOM 1676 O LEU B 699 -11.025 7.628 -29.276 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.763 6.222 -27.281 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.830 5.754 -25.827 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.432 5.713 -25.206 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.712 6.700 -24.999 1.00 0.00 C ATOM 0 H LEU B 699 -9.072 4.034 -28.350 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.898 5.949 -27.446 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.892 5.775 -27.760 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.620 7.302 -27.302 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.259 4.752 -25.820 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.503 5.377 -24.171 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.804 5.023 -25.769 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -6.992 6.710 -25.235 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.749 6.352 -23.967 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.294 7.706 -25.028 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.720 6.714 -25.414 1.00 0.00 H new ATOM 1692 N LEU B 700 -9.234 6.702 -30.232 1.00 0.00 N ATOM 1693 CA LEU B 700 -9.146 7.613 -31.359 1.00 0.00 C ATOM 1694 C LEU B 700 -10.439 7.621 -32.151 1.00 0.00 C ATOM 1695 O LEU B 700 -10.885 8.685 -32.570 1.00 0.00 O ATOM 1696 CB LEU B 700 -7.989 7.144 -32.243 1.00 0.00 C ATOM 1697 CG LEU B 700 -7.759 7.972 -33.520 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.531 9.456 -33.203 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.533 7.399 -34.235 1.00 0.00 C ATOM 0 H LEU B 700 -8.536 5.959 -30.259 1.00 0.00 H new ATOM 0 HA LEU B 700 -8.974 8.629 -31.005 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -7.073 7.157 -31.652 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -8.169 6.108 -32.529 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.646 7.911 -34.151 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.373 10.006 -34.131 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.404 9.856 -32.688 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.654 9.561 -32.565 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.345 7.967 -35.146 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.665 7.467 -33.579 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.715 6.355 -34.489 1.00 0.00 H new ATOM 1711 N ALA B 701 -11.055 6.454 -32.331 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.364 6.368 -32.947 1.00 0.00 C ATOM 1713 C ALA B 701 -13.372 7.173 -32.124 1.00 0.00 C ATOM 1714 O ALA B 701 -14.114 7.962 -32.693 1.00 0.00 O ATOM 1715 CB ALA B 701 -12.782 4.903 -33.089 1.00 0.00 C ATOM 0 H ALA B 701 -10.661 5.555 -32.055 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.331 6.796 -33.949 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -13.767 4.849 -33.553 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.058 4.377 -33.712 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.819 4.438 -32.104 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.358 7.045 -30.795 1.00 0.00 N ATOM 1722 CA GLU B 702 -14.200 7.844 -29.909 1.00 0.00 C ATOM 1723 C GLU B 702 -13.914 9.340 -30.067 1.00 0.00 C ATOM 1724 O GLU B 702 -14.822 10.143 -30.294 1.00 0.00 O ATOM 1725 CB GLU B 702 -14.008 7.387 -28.450 1.00 0.00 C ATOM 1726 CG GLU B 702 -15.277 7.576 -27.608 1.00 0.00 C ATOM 1727 CD GLU B 702 -16.493 6.812 -28.169 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.570 5.572 -27.994 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -17.376 7.446 -28.794 1.00 0.00 O ATOM 0 H GLU B 702 -12.759 6.381 -30.304 1.00 0.00 H new ATOM 0 HA GLU B 702 -15.242 7.688 -30.187 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -13.719 6.336 -28.436 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -13.189 7.949 -28.000 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -15.083 7.241 -26.589 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.516 8.638 -27.554 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.642 9.729 -30.009 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.204 11.101 -30.042 1.00 0.00 C ATOM 1738 C TRP B 703 -12.608 11.734 -31.384 1.00 0.00 C ATOM 1739 O TRP B 703 -13.073 12.871 -31.410 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.684 11.110 -29.804 1.00 0.00 C ATOM 1741 CG TRP B 703 -10.101 10.477 -28.555 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.740 9.900 -27.508 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.704 10.464 -28.152 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.861 9.598 -26.486 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.597 9.985 -26.817 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.523 10.899 -28.764 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.428 10.063 -26.067 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.321 10.964 -28.033 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.281 10.591 -26.673 1.00 0.00 C ATOM 0 H TRP B 703 -11.870 9.066 -29.935 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.676 11.700 -29.263 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.220 10.620 -30.660 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.361 12.151 -29.819 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.801 9.702 -27.477 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -10.121 9.149 -25.608 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.533 11.187 -29.805 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.405 9.724 -25.042 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.419 11.304 -28.520 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.372 10.712 -26.103 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.510 10.991 -32.495 1.00 0.00 N ATOM 1761 CA LYS B 704 -12.776 11.529 -33.829 1.00 0.00 C ATOM 1762 C LYS B 704 -14.247 11.432 -34.232 1.00 0.00 C ATOM 1763 O LYS B 704 -14.679 12.204 -35.087 1.00 0.00 O ATOM 1764 CB LYS B 704 -11.844 10.873 -34.872 1.00 0.00 C ATOM 1765 CG LYS B 704 -12.374 9.578 -35.513 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.348 8.986 -36.493 1.00 0.00 C ATOM 1767 CE LYS B 704 -11.951 7.781 -37.238 1.00 0.00 C ATOM 1768 NZ LYS B 704 -11.040 7.251 -38.291 1.00 0.00 N ATOM 0 H LYS B 704 -12.245 10.006 -32.491 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.555 12.596 -33.796 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -11.648 11.596 -35.664 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -10.888 10.657 -34.394 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -12.601 8.849 -34.735 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -13.307 9.784 -36.038 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.039 9.747 -37.209 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -10.454 8.677 -35.951 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -12.174 6.990 -36.523 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -12.897 8.075 -37.694 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -11.490 6.441 -38.764 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -10.846 7.996 -38.990 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -10.147 6.945 -37.855 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.023 10.501 -33.657 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.435 10.338 -34.048 1.00 0.00 C ATOM 1784 C ARG B 705 -17.260 11.421 -33.377 1.00 0.00 C ATOM 1785 O ARG B 705 -18.170 11.974 -33.992 1.00 0.00 O ATOM 1786 CB ARG B 705 -16.970 8.919 -33.784 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.125 8.519 -32.308 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.154 6.996 -32.132 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.458 6.425 -32.514 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.515 6.256 -31.703 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -19.456 6.581 -30.412 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -20.646 5.756 -32.200 1.00 0.00 N ATOM 0 H ARG B 705 -14.706 9.858 -32.931 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.517 10.458 -35.128 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -17.941 8.823 -34.269 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.301 8.205 -34.265 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.301 8.936 -31.730 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -18.044 8.949 -31.909 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.368 6.545 -32.738 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -16.938 6.746 -31.093 1.00 0.00 H new ATOM 0 HE ARG B 705 -18.568 6.131 -33.484 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -18.596 6.966 -30.022 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -20.271 6.444 -29.814 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -20.703 5.506 -33.187 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -21.455 5.623 -31.593 1.00 0.00 H new ATOM 1806 N THR B 706 -16.911 11.747 -32.137 1.00 0.00 N ATOM 1807 CA THR B 706 -17.440 12.902 -31.438 1.00 0.00 C ATOM 1808 C THR B 706 -16.880 14.160 -32.122 1.00 0.00 C ATOM 1809 O THR B 706 -17.587 15.149 -32.317 1.00 0.00 O ATOM 1810 CB THR B 706 -17.050 12.790 -29.961 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.651 12.710 -29.836 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.624 11.516 -29.343 1.00 0.00 C ATOM 0 H THR B 706 -16.244 11.207 -31.586 1.00 0.00 H new ATOM 0 HA THR B 706 -18.528 12.959 -31.479 1.00 0.00 H new ATOM 0 HB THR B 706 -17.442 13.671 -29.453 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.369 11.774 -29.904 1.00 0.00 H new ATOM 0 HG21 THR B 706 -17.334 11.458 -28.294 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.711 11.533 -29.419 1.00 0.00 H new ATOM 0 HG23 THR B 706 -17.237 10.647 -29.875 1.00 0.00 H new ATOM 1820 N GLY B 707 -15.612 14.078 -32.535 1.00 0.00 N ATOM 1821 CA GLY B 707 -14.924 15.027 -33.383 1.00 0.00 C ATOM 1822 C GLY B 707 -14.169 16.025 -32.525 1.00 0.00 C ATOM 1823 O GLY B 707 -12.940 16.086 -32.556 1.00 0.00 O ATOM 0 H GLY B 707 -15.013 13.298 -32.265 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -14.232 14.504 -34.044 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -15.640 15.548 -34.019 1.00 0.00 H new ATOM 1827 N SER B 708 -14.920 16.743 -31.687 1.00 0.00 N ATOM 1828 CA SER B 708 -14.383 17.626 -30.670 1.00 0.00 C ATOM 1829 C SER B 708 -13.916 16.860 -29.426 1.00 0.00 C ATOM 1830 O SER B 708 -13.583 17.506 -28.432 1.00 0.00 O ATOM 1831 CB SER B 708 -15.444 18.694 -30.362 1.00 0.00 C ATOM 1832 OG SER B 708 -16.725 18.100 -30.173 1.00 0.00 O ATOM 0 H SER B 708 -15.940 16.721 -31.704 1.00 0.00 H new ATOM 0 HA SER B 708 -13.483 18.118 -31.039 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.160 19.247 -29.467 1.00 0.00 H new ATOM 0 HB3 SER B 708 -15.490 19.413 -31.180 1.00 0.00 H new ATOM 0 HG SER B 708 -17.384 18.799 -29.977 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.907 15.513 -29.458 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.522 14.618 -28.362 1.00 0.00 C ATOM 1840 C ASP B 709 -14.254 14.899 -27.035 1.00 0.00 C ATOM 1841 O ASP B 709 -13.842 14.428 -25.969 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.995 14.506 -28.222 1.00 0.00 C ATOM 1843 CG ASP B 709 -11.243 15.737 -27.648 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.605 16.293 -26.581 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.211 16.100 -28.268 1.00 0.00 O ATOM 0 H ASP B 709 -14.183 14.999 -30.294 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.874 13.626 -28.644 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.776 13.649 -27.585 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.581 14.286 -29.206 1.00 0.00 H new ATOM 1850 N PHE B 710 -15.410 15.574 -27.119 1.00 0.00 N ATOM 1851 CA PHE B 710 -16.202 16.171 -26.061 1.00 0.00 C ATOM 1852 C PHE B 710 -15.397 17.207 -25.264 1.00 0.00 C ATOM 1853 O PHE B 710 -15.701 18.402 -25.340 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.817 15.109 -25.152 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.800 14.143 -25.785 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.955 14.617 -26.435 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.594 12.758 -25.653 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.911 13.710 -26.925 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.561 11.853 -26.125 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.722 12.328 -26.757 1.00 0.00 C ATOM 0 H PHE B 710 -15.848 15.724 -28.028 1.00 0.00 H new ATOM 0 HA PHE B 710 -17.026 16.704 -26.536 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -16.006 14.528 -24.714 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -17.323 15.618 -24.332 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -19.107 15.679 -26.558 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -16.692 12.389 -25.188 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.792 14.076 -27.431 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.411 10.791 -26.001 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.468 11.632 -27.113 1.00 0.00 H new ATOM 1870 N HIS B 711 -14.391 16.759 -24.510 1.00 0.00 N ATOM 1871 CA HIS B 711 -13.641 17.538 -23.532 1.00 0.00 C ATOM 1872 C HIS B 711 -12.554 16.655 -22.920 1.00 0.00 C ATOM 1873 O HIS B 711 -12.522 16.448 -21.705 1.00 0.00 O ATOM 1874 CB HIS B 711 -14.554 18.161 -22.450 1.00 0.00 C ATOM 1875 CG HIS B 711 -15.695 17.295 -21.952 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -17.049 17.637 -22.026 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -15.582 16.075 -21.344 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -17.721 16.616 -21.461 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -16.864 15.668 -21.041 1.00 0.00 N ATOM 0 H HIS B 711 -14.064 15.795 -24.571 1.00 0.00 H new ATOM 0 HA HIS B 711 -13.174 18.380 -24.042 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -13.934 18.434 -21.596 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.974 19.085 -22.848 1.00 0.00 H new ATOM 0 HD1 HIS B 711 -17.447 18.487 -22.426 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -14.668 15.536 -21.141 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.795 16.565 -21.360 1.00 0.00 H new ATOM 1887 N ILE B 712 -11.665 16.073 -23.724 1.00 0.00 N ATOM 1888 CA ILE B 712 -10.491 15.404 -23.183 1.00 0.00 C ATOM 1889 C ILE B 712 -9.739 16.381 -22.266 1.00 0.00 C ATOM 1890 O ILE B 712 -9.629 17.575 -22.538 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.641 14.786 -24.311 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -10.434 13.619 -24.933 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -8.332 14.202 -23.773 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.682 12.852 -26.011 1.00 0.00 C ATOM 0 H ILE B 712 -11.737 16.053 -24.741 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.777 14.554 -22.563 1.00 0.00 H new ATOM 0 HB ILE B 712 -9.417 15.570 -25.034 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.717 12.925 -24.141 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -11.358 14.010 -25.360 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.759 13.775 -24.596 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.750 14.991 -23.296 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.554 13.423 -23.043 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -10.313 12.050 -26.394 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.422 13.529 -26.825 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.772 12.427 -25.588 1.00 0.00 H new ATOM 1906 N GLY B 713 -9.279 15.844 -21.135 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.680 16.562 -20.006 1.00 0.00 C ATOM 1908 C GLY B 713 -9.724 17.069 -19.010 1.00 0.00 C ATOM 1909 O GLY B 713 -9.386 17.282 -17.851 1.00 0.00 O ATOM 0 H GLY B 713 -9.316 14.838 -20.972 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -7.982 15.903 -19.490 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -8.103 17.406 -20.383 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.987 17.198 -19.438 1.00 0.00 N ATOM 1914 CA HIS B 714 -12.146 17.624 -18.649 1.00 0.00 C ATOM 1915 C HIS B 714 -11.839 18.848 -17.768 1.00 0.00 C ATOM 1916 O HIS B 714 -12.167 18.896 -16.579 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.716 16.408 -17.907 1.00 0.00 C ATOM 1918 CG HIS B 714 -14.129 16.607 -17.407 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -14.612 16.175 -16.169 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -15.153 17.187 -18.099 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -15.907 16.531 -16.137 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -16.261 17.130 -17.285 1.00 0.00 N ATOM 0 H HIS B 714 -11.240 16.994 -20.405 1.00 0.00 H new ATOM 0 HA HIS B 714 -12.933 17.990 -19.308 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -12.694 15.545 -18.572 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -12.070 16.175 -17.060 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -15.103 17.609 -19.092 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -16.571 16.359 -15.303 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -17.190 17.482 -17.514 1.00 0.00 H new ATOM 1930 N LYS B 715 -11.137 19.812 -18.376 1.00 0.00 N ATOM 1931 CA LYS B 715 -10.748 21.066 -17.742 1.00 0.00 C ATOM 1932 C LYS B 715 -12.007 21.841 -17.350 1.00 0.00 C ATOM 1933 O LYS B 715 -12.976 21.871 -18.146 1.00 0.00 O ATOM 1934 CB LYS B 715 -9.852 21.910 -18.669 1.00 0.00 C ATOM 1935 CG LYS B 715 -8.633 21.184 -19.275 1.00 0.00 C ATOM 1936 CD LYS B 715 -7.710 20.480 -18.267 1.00 0.00 C ATOM 1937 CE LYS B 715 -6.945 21.473 -17.377 1.00 0.00 C ATOM 1938 NZ LYS B 715 -6.161 20.770 -16.327 1.00 0.00 N ATOM 1939 OXT LYS B 715 -12.014 22.450 -16.257 1.00 0.00 O ATOM 0 H LYS B 715 -10.820 19.735 -19.342 1.00 0.00 H new ATOM 0 HA LYS B 715 -10.165 20.843 -16.848 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -10.465 22.292 -19.485 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -9.494 22.773 -18.108 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -8.992 20.444 -19.990 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -8.043 21.909 -19.836 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -8.303 19.816 -17.638 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -6.997 19.856 -18.806 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -6.275 22.073 -17.992 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -7.649 22.160 -16.908 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -5.457 21.422 -15.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -6.802 20.444 -15.575 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -5.675 19.952 -16.746 1.00 0.00 H new TER 1953 LYS B 715