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= 0.322 K(o=0.073,f=-5.1!) USER MOD Set 1.2: B 711 HIS : no HE2:sc= -0.0116 K(o=0.073,f=-0.69) USER MOD Set 1.3: B 714 HIS : no HD1:sc= -0.237 K(o=0.073,f=-1.9!) USER MOD Set 2.1: A 7 THR OG1 : rot 133:sc= 1.9 USER MOD Set 2.2: A 9 THR OG1 : rot 177:sc= 0.685 USER MOD Set 3.1: A 6 LYS NZ :NH3+ -163:sc= 1.19 (180deg=1.11) USER MOD Set 3.2: B 686 GLN : amide:sc= 1.29 K(o=2.5,f=0.24) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.113 (180deg=-0.269) USER MOD Single : A 1 MET N :NH3+ 174:sc= 1.09 (180deg=1.06) USER MOD Single : A 2 GLN : amide:sc= 0.1 X(o=0.1,f=0) USER MOD Single : A 11 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000291) 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= 0.0374 USER MOD Single : A 25 ASN : amide:sc= -0.448 K(o=-0.45,f=-2.2!) USER MOD Single : A 27 LYS NZ :NH3+ -160:sc= 1.78 (180deg=1.23) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 1.01 (180deg=0.949) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ -160:sc= 1 (180deg=0.753) USER MOD Single : A 41 GLN : amide:sc= 0.848 K(o=0.85,f=-4.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.15 K(o=1.1,f=-7.1!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= -0.0509 USER MOD Single : A 59 TYR OH : rot 80:sc= -0.146 USER MOD Single : A 60 ASN : amide:sc= 0.249 X(o=0.25,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.00806 X(o=0.0081,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 160:sc= 1.24 (180deg=1.04) USER MOD Single : A 65 SER OG : rot 59:sc= 1.08 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.0992 X(o=-0.099,f=-0.45) USER MOD Single : B -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -2 HIS : no HD1:sc= -0.0873 X(o=-0.087,f=-0.11) 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=0.000364 USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.0854 X(o=-0.085,f=-0.16) 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= -0.115 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD Single : B 715 LYS NZ :NH3+ -176:sc= 1.05 (180deg=1.02) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.976 1.184 0.311 1.00 0.00 N ATOM 2 CA MET A 1 1.832 1.135 -0.921 1.00 0.00 C ATOM 3 C MET A 1 1.604 2.359 -1.810 1.00 0.00 C ATOM 4 O MET A 1 0.721 3.147 -1.518 1.00 0.00 O ATOM 5 CB MET A 1 1.652 -0.162 -1.750 1.00 0.00 C ATOM 6 CG MET A 1 0.331 -0.350 -2.518 1.00 0.00 C ATOM 7 SD MET A 1 0.239 -1.948 -3.363 1.00 0.00 S ATOM 8 CE MET A 1 -0.996 -1.639 -4.651 1.00 0.00 C ATOM 0 H1 MET A 1 1.078 0.295 0.840 1.00 0.00 H new ATOM 0 H2 MET A 1 1.275 1.980 0.910 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.019 1.311 0.037 1.00 0.00 H new ATOM 0 HA MET A 1 2.860 1.140 -0.558 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.468 -0.214 -2.471 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.769 -1.009 -1.074 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.505 -0.262 -1.824 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.223 0.451 -3.250 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.352 -2.589 -5.049 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.834 -1.087 -4.226 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.546 -1.055 -5.454 1.00 0.00 H new ATOM 20 N GLN A 2 2.301 2.487 -2.949 1.00 0.00 N ATOM 21 CA GLN A 2 2.038 3.545 -3.929 1.00 0.00 C ATOM 22 C GLN A 2 2.027 2.991 -5.333 1.00 0.00 C ATOM 23 O GLN A 2 2.690 1.983 -5.583 1.00 0.00 O ATOM 24 CB GLN A 2 3.054 4.699 -3.773 1.00 0.00 C ATOM 25 CG GLN A 2 4.375 4.642 -4.564 1.00 0.00 C ATOM 26 CD GLN A 2 5.362 3.691 -3.912 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.221 4.068 -3.125 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.192 2.421 -4.211 1.00 0.00 N ATOM 0 H GLN A 2 3.061 1.860 -3.214 1.00 0.00 H new ATOM 0 HA GLN A 2 1.046 3.954 -3.737 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.546 5.624 -4.046 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.307 4.775 -2.715 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.177 4.320 -5.586 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.811 5.639 -4.622 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.465 2.145 -4.872 1.00 0.00 H new ATOM 0 HE22 GLN A 2 5.787 1.712 -3.782 1.00 0.00 H new ATOM 37 N ILE A 3 1.371 3.699 -6.243 1.00 0.00 N ATOM 38 CA ILE A 3 1.350 3.364 -7.668 1.00 0.00 C ATOM 39 C ILE A 3 1.464 4.654 -8.462 1.00 0.00 C ATOM 40 O ILE A 3 1.149 5.727 -7.960 1.00 0.00 O ATOM 41 CB ILE A 3 0.095 2.525 -8.008 1.00 0.00 C ATOM 42 CG1 ILE A 3 -1.184 3.121 -7.397 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.268 1.085 -7.493 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.380 3.039 -8.340 1.00 0.00 C ATOM 0 H ILE A 3 0.831 4.533 -6.013 1.00 0.00 H new ATOM 0 HA ILE A 3 2.198 2.735 -7.939 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.009 2.532 -9.093 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.419 2.595 -6.472 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.005 4.163 -7.134 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.620 0.502 -7.737 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.140 0.632 -7.965 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.407 1.099 -6.412 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.255 3.474 -7.857 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.160 3.589 -9.255 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.581 1.996 -8.583 1.00 0.00 H new ATOM 56 N PHE A 4 1.957 4.527 -9.683 1.00 0.00 N ATOM 57 CA PHE A 4 2.367 5.612 -10.557 1.00 0.00 C ATOM 58 C PHE A 4 1.348 5.728 -11.671 1.00 0.00 C ATOM 59 O PHE A 4 1.379 4.985 -12.644 1.00 0.00 O ATOM 60 CB PHE A 4 3.765 5.301 -11.108 1.00 0.00 C ATOM 61 CG PHE A 4 4.766 4.716 -10.134 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.013 5.375 -8.923 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.460 3.532 -10.434 1.00 0.00 C ATOM 64 CE1 PHE A 4 5.925 4.849 -7.997 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.413 3.040 -9.528 1.00 0.00 C ATOM 66 CZ PHE A 4 6.648 3.691 -8.307 1.00 0.00 C ATOM 0 H PHE A 4 2.089 3.612 -10.114 1.00 0.00 H new ATOM 0 HA PHE A 4 2.415 6.560 -10.022 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.655 4.607 -11.941 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.183 6.222 -11.514 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.496 6.297 -8.700 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.262 3.004 -11.355 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.070 5.337 -7.045 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.972 2.149 -9.774 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.379 3.303 -7.614 1.00 0.00 H new ATOM 76 N VAL A 5 0.402 6.636 -11.565 1.00 0.00 N ATOM 77 CA VAL A 5 -0.564 6.838 -12.642 1.00 0.00 C ATOM 78 C VAL A 5 0.103 7.801 -13.613 1.00 0.00 C ATOM 79 O VAL A 5 0.250 8.983 -13.324 1.00 0.00 O ATOM 80 CB VAL A 5 -1.930 7.272 -12.091 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.983 7.322 -13.213 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.356 6.282 -10.992 1.00 0.00 C ATOM 0 H VAL A 5 0.275 7.244 -10.756 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.811 5.923 -13.181 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.850 8.275 -11.672 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.942 7.632 -12.798 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.669 8.036 -13.975 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.084 6.334 -13.662 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.325 6.578 -10.591 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.429 5.279 -11.414 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.616 6.286 -10.192 1.00 0.00 H new ATOM 92 N LYS A 6 0.583 7.295 -14.749 1.00 0.00 N ATOM 93 CA LYS A 6 1.079 8.156 -15.808 1.00 0.00 C ATOM 94 C LYS A 6 -0.156 8.793 -16.423 1.00 0.00 C ATOM 95 O LYS A 6 -1.061 8.072 -16.852 1.00 0.00 O ATOM 96 CB LYS A 6 1.922 7.328 -16.801 1.00 0.00 C ATOM 97 CG LYS A 6 2.706 8.271 -17.730 1.00 0.00 C ATOM 98 CD LYS A 6 3.655 7.573 -18.719 1.00 0.00 C ATOM 99 CE LYS A 6 4.594 8.594 -19.395 1.00 0.00 C ATOM 100 NZ LYS A 6 5.654 7.939 -20.212 1.00 0.00 N ATOM 0 H LYS A 6 0.636 6.297 -14.954 1.00 0.00 H new ATOM 0 HA LYS A 6 1.750 8.940 -15.456 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.611 6.682 -16.257 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.274 6.679 -17.389 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.995 8.872 -18.296 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.288 8.959 -17.117 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.245 6.822 -18.194 1.00 0.00 H new ATOM 0 HD3 LYS A 6 3.074 7.049 -19.478 1.00 0.00 H new ATOM 0 HE2 LYS A 6 4.007 9.257 -20.031 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.061 9.215 -18.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.415 8.621 -20.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.042 7.127 -19.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.247 7.611 -21.111 1.00 0.00 H new ATOM 114 N THR A 7 -0.249 10.118 -16.449 1.00 0.00 N ATOM 115 CA THR A 7 -1.309 10.727 -17.224 1.00 0.00 C ATOM 116 C THR A 7 -1.036 10.455 -18.681 1.00 0.00 C ATOM 117 O THR A 7 0.079 10.131 -19.071 1.00 0.00 O ATOM 118 CB THR A 7 -1.448 12.226 -16.982 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.237 12.856 -17.298 1.00 0.00 O ATOM 120 CG2 THR A 7 -1.824 12.498 -15.546 1.00 0.00 C ATOM 0 H THR A 7 0.372 10.764 -15.962 1.00 0.00 H new ATOM 0 HA THR A 7 -2.256 10.287 -16.910 1.00 0.00 H new ATOM 0 HB THR A 7 -2.240 12.622 -17.618 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.413 13.641 -17.857 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.919 13.573 -15.392 1.00 0.00 H new ATOM 0 HG22 THR A 7 -2.774 12.014 -15.321 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.051 12.104 -14.887 1.00 0.00 H new ATOM 128 N LEU A 8 -2.045 10.664 -19.496 1.00 0.00 N ATOM 129 CA LEU A 8 -1.859 10.672 -20.931 1.00 0.00 C ATOM 130 C LEU A 8 -0.974 11.878 -21.330 1.00 0.00 C ATOM 131 O LEU A 8 -0.506 11.856 -22.460 1.00 0.00 O ATOM 132 CB LEU A 8 -3.246 10.680 -21.593 1.00 0.00 C ATOM 133 CG LEU A 8 -3.814 9.424 -22.253 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.263 9.677 -22.697 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.101 9.038 -23.534 1.00 0.00 C ATOM 0 H LEU A 8 -3.004 10.831 -19.190 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.334 9.782 -21.278 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.961 10.990 -20.831 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.232 11.461 -22.354 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.706 8.641 -21.502 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.662 8.778 -23.167 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.870 9.933 -21.829 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.286 10.500 -23.411 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.557 8.138 -23.947 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.184 9.851 -24.256 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.049 8.847 -23.322 1.00 0.00 H new ATOM 147 N THR A 9 -0.705 12.918 -20.509 1.00 0.00 N ATOM 148 CA THR A 9 0.334 13.907 -20.861 1.00 0.00 C ATOM 149 C THR A 9 1.689 13.252 -20.678 1.00 0.00 C ATOM 150 O THR A 9 2.644 13.527 -21.402 1.00 0.00 O ATOM 151 CB THR A 9 0.365 15.165 -19.973 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.558 15.083 -18.916 1.00 0.00 O ATOM 153 CG2 THR A 9 0.119 16.420 -20.792 1.00 0.00 C ATOM 0 H THR A 9 -1.179 13.091 -19.622 1.00 0.00 H new ATOM 0 HA THR A 9 0.105 14.217 -21.880 1.00 0.00 H new ATOM 0 HB THR A 9 1.364 15.223 -19.540 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.475 15.876 -18.347 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.147 17.292 -20.139 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.892 16.514 -21.555 1.00 0.00 H new ATOM 0 HG23 THR A 9 -0.858 16.356 -21.271 1.00 0.00 H new ATOM 161 N GLY A 10 1.756 12.405 -19.658 1.00 0.00 N ATOM 162 CA GLY A 10 2.939 11.729 -19.226 1.00 0.00 C ATOM 163 C GLY A 10 3.453 12.304 -17.919 1.00 0.00 C ATOM 164 O GLY A 10 4.631 12.139 -17.609 1.00 0.00 O ATOM 0 H GLY A 10 0.940 12.171 -19.093 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.729 10.667 -19.101 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.710 11.814 -19.992 1.00 0.00 H new ATOM 168 N LYS A 11 2.582 12.980 -17.156 1.00 0.00 N ATOM 169 CA LYS A 11 2.916 13.390 -15.804 1.00 0.00 C ATOM 170 C LYS A 11 2.635 12.177 -14.958 1.00 0.00 C ATOM 171 O LYS A 11 1.495 11.726 -14.906 1.00 0.00 O ATOM 172 CB LYS A 11 2.066 14.590 -15.361 1.00 0.00 C ATOM 173 CG LYS A 11 2.546 15.064 -13.969 1.00 0.00 C ATOM 174 CD LYS A 11 1.550 14.833 -12.819 1.00 0.00 C ATOM 175 CE LYS A 11 0.284 15.706 -12.873 1.00 0.00 C ATOM 176 NZ LYS A 11 0.549 17.163 -12.717 1.00 0.00 N ATOM 0 H LYS A 11 1.646 13.249 -17.460 1.00 0.00 H new ATOM 0 HA LYS A 11 3.952 13.718 -15.718 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.153 15.400 -16.085 1.00 0.00 H new ATOM 0 HB3 LYS A 11 1.013 14.311 -15.321 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.478 14.552 -13.730 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.773 16.129 -14.024 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.251 13.785 -12.822 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.060 15.017 -11.873 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.221 15.538 -13.824 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.401 15.385 -12.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.350 17.685 -12.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.019 17.335 -11.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.164 17.489 -13.490 1.00 0.00 H new ATOM 190 N THR A 12 3.643 11.619 -14.330 1.00 0.00 N ATOM 191 CA THR A 12 3.435 10.481 -13.466 1.00 0.00 C ATOM 192 C THR A 12 3.030 11.026 -12.104 1.00 0.00 C ATOM 193 O THR A 12 3.829 11.634 -11.394 1.00 0.00 O ATOM 194 CB THR A 12 4.694 9.610 -13.473 1.00 0.00 C ATOM 195 OG1 THR A 12 5.267 9.567 -14.776 1.00 0.00 O ATOM 196 CG2 THR A 12 4.287 8.193 -13.109 1.00 0.00 C ATOM 0 H THR A 12 4.611 11.933 -14.400 1.00 0.00 H new ATOM 0 HA THR A 12 2.634 9.821 -13.800 1.00 0.00 H new ATOM 0 HB THR A 12 5.416 10.024 -12.769 1.00 0.00 H new ATOM 0 HG1 THR A 12 6.071 9.007 -14.761 1.00 0.00 H new ATOM 0 HG21 THR A 12 5.168 7.551 -13.107 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.832 8.188 -12.119 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.569 7.822 -13.840 1.00 0.00 H new ATOM 204 N ILE A 13 1.751 10.844 -11.782 1.00 0.00 N ATOM 205 CA ILE A 13 1.206 11.177 -10.488 1.00 0.00 C ATOM 206 C ILE A 13 1.296 9.900 -9.680 1.00 0.00 C ATOM 207 O ILE A 13 0.649 8.906 -9.998 1.00 0.00 O ATOM 208 CB ILE A 13 -0.207 11.793 -10.602 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.063 11.629 -9.324 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.048 11.472 -11.844 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.320 10.763 -9.401 1.00 0.00 C ATOM 0 H ILE A 13 1.064 10.456 -12.428 1.00 0.00 H new ATOM 0 HA ILE A 13 1.762 11.964 -9.979 1.00 0.00 H new ATOM 0 HB ILE A 13 0.068 12.839 -10.734 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.422 11.216 -8.545 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.364 12.624 -8.995 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.010 11.979 -11.773 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.524 11.813 -12.737 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.208 10.396 -11.907 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.810 10.746 -8.428 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.002 11.177 -10.144 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.045 9.748 -9.686 1.00 0.00 H new ATOM 223 N THR A 14 2.122 9.927 -8.649 1.00 0.00 N ATOM 224 CA THR A 14 2.256 8.810 -7.736 1.00 0.00 C ATOM 225 C THR A 14 1.209 9.011 -6.645 1.00 0.00 C ATOM 226 O THR A 14 0.970 10.141 -6.211 1.00 0.00 O ATOM 227 CB THR A 14 3.698 8.772 -7.209 1.00 0.00 C ATOM 228 OG1 THR A 14 4.580 8.775 -8.320 1.00 0.00 O ATOM 229 CG2 THR A 14 3.958 7.512 -6.366 1.00 0.00 C ATOM 0 H THR A 14 2.717 10.724 -8.423 1.00 0.00 H new ATOM 0 HA THR A 14 2.080 7.843 -8.208 1.00 0.00 H new ATOM 0 HB THR A 14 3.861 9.643 -6.574 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.507 8.753 -8.002 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.988 7.519 -6.010 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.279 7.498 -5.513 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.791 6.625 -6.977 1.00 0.00 H new ATOM 237 N LEU A 15 0.567 7.922 -6.217 1.00 0.00 N ATOM 238 CA LEU A 15 -0.491 7.973 -5.218 1.00 0.00 C ATOM 239 C LEU A 15 -0.366 6.782 -4.310 1.00 0.00 C ATOM 240 O LEU A 15 0.002 5.713 -4.783 1.00 0.00 O ATOM 241 CB LEU A 15 -1.864 8.071 -5.913 1.00 0.00 C ATOM 242 CG LEU A 15 -2.335 6.866 -6.739 1.00 0.00 C ATOM 243 CD1 LEU A 15 -3.152 5.893 -5.894 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.279 7.333 -7.838 1.00 0.00 C ATOM 0 H LEU A 15 0.770 6.982 -6.556 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.397 8.864 -4.597 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.614 8.266 -5.147 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.846 8.941 -6.570 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.438 6.386 -7.130 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.469 5.052 -6.511 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.542 5.527 -5.068 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.030 6.403 -5.498 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.611 6.474 -8.422 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.143 7.824 -7.391 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.760 8.036 -8.489 1.00 0.00 H new ATOM 256 N GLU A 16 -0.690 6.947 -3.033 1.00 0.00 N ATOM 257 CA GLU A 16 -0.535 5.901 -2.039 1.00 0.00 C ATOM 258 C GLU A 16 -1.904 5.318 -1.699 1.00 0.00 C ATOM 259 O GLU A 16 -2.857 6.045 -1.403 1.00 0.00 O ATOM 260 CB GLU A 16 0.247 6.401 -0.815 1.00 0.00 C ATOM 261 CG GLU A 16 1.764 6.277 -1.036 1.00 0.00 C ATOM 262 CD GLU A 16 2.549 6.901 0.130 1.00 0.00 C ATOM 263 OE1 GLU A 16 2.842 8.119 0.086 1.00 0.00 O ATOM 264 OE2 GLU A 16 2.884 6.173 1.095 1.00 0.00 O ATOM 0 H GLU A 16 -1.070 7.817 -2.660 1.00 0.00 H new ATOM 0 HA GLU A 16 0.069 5.090 -2.447 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -0.010 7.441 -0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -0.043 5.827 0.065 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.034 5.226 -1.139 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.040 6.770 -1.968 1.00 0.00 H new ATOM 271 N VAL A 17 -1.978 3.999 -1.836 1.00 0.00 N ATOM 272 CA VAL A 17 -3.158 3.134 -1.783 1.00 0.00 C ATOM 273 C VAL A 17 -2.734 1.762 -1.256 1.00 0.00 C ATOM 274 O VAL A 17 -1.597 1.568 -0.831 1.00 0.00 O ATOM 275 CB VAL A 17 -3.794 3.030 -3.190 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.653 4.254 -3.489 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.739 2.789 -4.277 1.00 0.00 C ATOM 0 H VAL A 17 -1.133 3.453 -2.003 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.909 3.551 -1.112 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.449 2.159 -3.195 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -5.089 4.158 -4.483 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.450 4.329 -2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.035 5.151 -3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.227 2.722 -5.249 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.028 3.615 -4.284 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.211 1.858 -4.071 1.00 0.00 H new ATOM 287 N GLU A 18 -3.621 0.785 -1.353 1.00 0.00 N ATOM 288 CA GLU A 18 -3.401 -0.608 -0.961 1.00 0.00 C ATOM 289 C GLU A 18 -3.742 -1.487 -2.165 1.00 0.00 C ATOM 290 O GLU A 18 -4.501 -1.033 -3.025 1.00 0.00 O ATOM 291 CB GLU A 18 -4.305 -0.973 0.232 1.00 0.00 C ATOM 292 CG GLU A 18 -4.259 0.009 1.408 1.00 0.00 C ATOM 293 CD GLU A 18 -2.847 0.275 1.969 1.00 0.00 C ATOM 294 OE1 GLU A 18 -1.980 -0.632 1.949 1.00 0.00 O ATOM 295 OE2 GLU A 18 -2.605 1.398 2.474 1.00 0.00 O ATOM 0 H GLU A 18 -4.558 0.943 -1.723 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.365 -0.759 -0.658 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.334 -1.045 -0.121 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -4.022 -1.962 0.593 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.693 0.957 1.090 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.888 -0.376 2.211 1.00 0.00 H new ATOM 302 N PRO A 19 -3.263 -2.739 -2.260 1.00 0.00 N ATOM 303 CA PRO A 19 -3.688 -3.648 -3.326 1.00 0.00 C ATOM 304 C PRO A 19 -5.211 -3.829 -3.390 1.00 0.00 C ATOM 305 O PRO A 19 -5.787 -3.952 -4.463 1.00 0.00 O ATOM 306 CB PRO A 19 -2.973 -4.971 -3.054 1.00 0.00 C ATOM 307 CG PRO A 19 -1.811 -4.623 -2.135 1.00 0.00 C ATOM 308 CD PRO A 19 -2.316 -3.400 -1.373 1.00 0.00 C ATOM 0 HA PRO A 19 -3.424 -3.239 -4.301 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.644 -5.690 -2.584 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.619 -5.424 -3.980 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.571 -5.446 -1.461 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.906 -4.399 -2.699 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.795 -3.693 -0.439 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.493 -2.734 -1.114 1.00 0.00 H new ATOM 316 N SER A 20 -5.891 -3.758 -2.252 1.00 0.00 N ATOM 317 CA SER A 20 -7.323 -3.995 -2.145 1.00 0.00 C ATOM 318 C SER A 20 -8.054 -2.662 -2.090 1.00 0.00 C ATOM 319 O SER A 20 -9.239 -2.630 -1.743 1.00 0.00 O ATOM 320 CB SER A 20 -7.600 -4.881 -0.921 1.00 0.00 C ATOM 321 OG SER A 20 -6.787 -6.050 -0.959 1.00 0.00 O ATOM 0 H SER A 20 -5.452 -3.529 -1.360 1.00 0.00 H new ATOM 0 HA SER A 20 -7.695 -4.528 -3.020 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.401 -4.322 -0.007 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.653 -5.163 -0.899 1.00 0.00 H new ATOM 0 HG SER A 20 -6.973 -6.604 -0.172 1.00 0.00 H new ATOM 327 N ASP A 21 -7.372 -1.563 -2.428 1.00 0.00 N ATOM 328 CA ASP A 21 -8.036 -0.295 -2.556 1.00 0.00 C ATOM 329 C ASP A 21 -8.662 -0.271 -3.944 1.00 0.00 C ATOM 330 O ASP A 21 -8.102 -0.807 -4.919 1.00 0.00 O ATOM 331 CB ASP A 21 -7.055 0.855 -2.300 1.00 0.00 C ATOM 332 CG ASP A 21 -7.579 1.911 -1.311 1.00 0.00 C ATOM 333 OD1 ASP A 21 -8.790 1.939 -0.988 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.740 2.728 -0.868 1.00 0.00 O ATOM 0 H ASP A 21 -6.369 -1.542 -2.613 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.821 -0.163 -1.811 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.121 0.444 -1.917 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.825 1.341 -3.248 1.00 0.00 H new ATOM 339 N THR A 22 -9.872 0.273 -4.013 1.00 0.00 N ATOM 340 CA THR A 22 -10.696 0.218 -5.200 1.00 0.00 C ATOM 341 C THR A 22 -10.289 1.256 -6.216 1.00 0.00 C ATOM 342 O THR A 22 -9.782 2.325 -5.876 1.00 0.00 O ATOM 343 CB THR A 22 -12.179 0.392 -4.855 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.330 1.410 -3.881 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.742 -0.921 -4.333 1.00 0.00 C ATOM 0 H THR A 22 -10.307 0.768 -3.234 1.00 0.00 H new ATOM 0 HA THR A 22 -10.546 -0.769 -5.638 1.00 0.00 H new ATOM 0 HB THR A 22 -12.726 0.680 -5.753 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.280 1.518 -3.665 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.797 -0.793 -4.089 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.637 -1.691 -5.097 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.196 -1.221 -3.438 1.00 0.00 H new ATOM 353 N ILE A 23 -10.607 0.963 -7.469 1.00 0.00 N ATOM 354 CA ILE A 23 -10.502 1.908 -8.562 1.00 0.00 C ATOM 355 C ILE A 23 -11.332 3.162 -8.285 1.00 0.00 C ATOM 356 O ILE A 23 -10.851 4.239 -8.608 1.00 0.00 O ATOM 357 CB ILE A 23 -10.923 1.215 -9.860 1.00 0.00 C ATOM 358 CG1 ILE A 23 -10.117 -0.064 -10.160 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.851 2.161 -11.069 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.661 -0.140 -9.692 1.00 0.00 C ATOM 0 H ILE A 23 -10.950 0.046 -7.755 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.468 2.239 -8.664 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.960 0.922 -9.696 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.652 -0.904 -9.716 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -10.126 -0.215 -11.239 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.158 1.627 -11.968 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.515 3.010 -10.907 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.828 2.518 -11.191 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.236 -1.102 -9.980 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.088 0.663 -10.155 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.621 -0.036 -8.608 1.00 0.00 H new ATOM 372 N GLU A 24 -12.510 3.062 -7.664 1.00 0.00 N ATOM 373 CA GLU A 24 -13.295 4.236 -7.276 1.00 0.00 C ATOM 374 C GLU A 24 -12.431 5.183 -6.443 1.00 0.00 C ATOM 375 O GLU A 24 -12.303 6.367 -6.753 1.00 0.00 O ATOM 376 CB GLU A 24 -14.538 3.778 -6.490 1.00 0.00 C ATOM 377 CG GLU A 24 -15.458 4.940 -6.091 1.00 0.00 C ATOM 378 CD GLU A 24 -16.720 4.437 -5.364 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.692 4.315 -4.114 1.00 0.00 O ATOM 380 OE2 GLU A 24 -17.750 4.176 -6.030 1.00 0.00 O ATOM 0 H GLU A 24 -12.944 2.172 -7.418 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.626 4.775 -8.164 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.101 3.067 -7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.219 3.250 -5.592 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.915 5.630 -5.445 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.748 5.498 -6.981 1.00 0.00 H new ATOM 387 N ASN A 25 -11.767 4.630 -5.423 1.00 0.00 N ATOM 388 CA ASN A 25 -10.895 5.394 -4.536 1.00 0.00 C ATOM 389 C ASN A 25 -9.673 5.925 -5.291 1.00 0.00 C ATOM 390 O ASN A 25 -9.303 7.079 -5.128 1.00 0.00 O ATOM 391 CB ASN A 25 -10.533 4.562 -3.291 1.00 0.00 C ATOM 392 CG ASN A 25 -9.033 4.475 -3.062 1.00 0.00 C ATOM 393 OD1 ASN A 25 -8.433 5.321 -2.410 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.395 3.481 -3.663 1.00 0.00 N ATOM 0 H ASN A 25 -11.822 3.638 -5.192 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.430 6.274 -4.177 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.006 5.003 -2.414 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.939 3.556 -3.400 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.380 3.407 -3.589 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.919 2.790 -4.200 1.00 0.00 H new ATOM 401 N VAL A 26 -9.070 5.118 -6.166 1.00 0.00 N ATOM 402 CA VAL A 26 -7.893 5.514 -6.935 1.00 0.00 C ATOM 403 C VAL A 26 -8.274 6.699 -7.816 1.00 0.00 C ATOM 404 O VAL A 26 -7.638 7.742 -7.747 1.00 0.00 O ATOM 405 CB VAL A 26 -7.431 4.305 -7.756 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.405 4.672 -8.827 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.835 3.179 -6.901 1.00 0.00 C ATOM 0 H VAL A 26 -9.387 4.168 -6.361 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.068 5.823 -6.293 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.346 3.949 -8.229 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.115 3.776 -9.376 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.841 5.395 -9.517 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.525 5.108 -8.354 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.529 2.355 -7.546 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.969 3.555 -6.357 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.583 2.826 -6.192 1.00 0.00 H new ATOM 417 N LYS A 27 -9.333 6.582 -8.618 1.00 0.00 N ATOM 418 CA LYS A 27 -9.799 7.674 -9.456 1.00 0.00 C ATOM 419 C LYS A 27 -10.133 8.906 -8.627 1.00 0.00 C ATOM 420 O LYS A 27 -9.884 10.014 -9.089 1.00 0.00 O ATOM 421 CB LYS A 27 -11.064 7.249 -10.215 1.00 0.00 C ATOM 422 CG LYS A 27 -10.914 6.173 -11.300 1.00 0.00 C ATOM 423 CD LYS A 27 -12.315 5.908 -11.881 1.00 0.00 C ATOM 424 CE LYS A 27 -12.296 5.018 -13.133 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.636 4.985 -13.794 1.00 0.00 N ATOM 0 H LYS A 27 -9.886 5.729 -8.701 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.996 7.917 -10.152 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.790 6.891 -9.485 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.491 8.137 -10.680 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.231 6.508 -12.081 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.494 5.260 -10.879 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.934 5.436 -11.118 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -12.784 6.860 -12.128 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.550 5.390 -13.835 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.998 4.006 -12.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.700 4.148 -14.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.380 4.940 -13.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.762 5.844 -14.366 1.00 0.00 H new ATOM 439 N ALA A 28 -10.664 8.758 -7.414 1.00 0.00 N ATOM 440 CA ALA A 28 -10.902 9.901 -6.537 1.00 0.00 C ATOM 441 C ALA A 28 -9.576 10.563 -6.151 1.00 0.00 C ATOM 442 O ALA A 28 -9.479 11.787 -6.144 1.00 0.00 O ATOM 443 CB ALA A 28 -11.697 9.478 -5.297 1.00 0.00 C ATOM 0 H ALA A 28 -10.937 7.859 -7.018 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.500 10.635 -7.077 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.863 10.345 -4.658 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.658 9.065 -5.604 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.137 8.723 -4.746 1.00 0.00 H new ATOM 449 N LYS A 29 -8.517 9.780 -5.919 1.00 0.00 N ATOM 450 CA LYS A 29 -7.175 10.333 -5.701 1.00 0.00 C ATOM 451 C LYS A 29 -6.691 11.027 -6.974 1.00 0.00 C ATOM 452 O LYS A 29 -6.083 12.084 -6.897 1.00 0.00 O ATOM 453 CB LYS A 29 -6.196 9.245 -5.209 1.00 0.00 C ATOM 454 CG LYS A 29 -6.590 8.714 -3.819 1.00 0.00 C ATOM 455 CD LYS A 29 -5.746 7.533 -3.304 1.00 0.00 C ATOM 456 CE LYS A 29 -6.081 7.284 -1.820 1.00 0.00 C ATOM 457 NZ LYS A 29 -5.051 7.816 -0.880 1.00 0.00 N ATOM 0 H LYS A 29 -8.563 8.762 -5.877 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.218 11.082 -4.910 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.179 8.421 -5.922 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.186 9.654 -5.170 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.518 9.531 -3.102 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.635 8.407 -3.848 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.953 6.638 -3.892 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.684 7.751 -3.418 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.043 7.743 -1.591 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.192 6.212 -1.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.399 7.737 0.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.173 7.267 -0.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.862 8.815 -1.101 1.00 0.00 H new ATOM 471 N ILE A 30 -7.019 10.518 -8.165 1.00 0.00 N ATOM 472 CA ILE A 30 -6.680 11.207 -9.420 1.00 0.00 C ATOM 473 C ILE A 30 -7.391 12.544 -9.468 1.00 0.00 C ATOM 474 O ILE A 30 -6.777 13.522 -9.831 1.00 0.00 O ATOM 475 CB ILE A 30 -7.001 10.378 -10.677 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.439 8.957 -10.670 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.504 11.071 -11.956 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.035 8.838 -10.111 1.00 0.00 C ATOM 0 H ILE A 30 -7.516 9.636 -8.290 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.600 11.355 -9.426 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.089 10.306 -10.664 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.104 8.320 -10.087 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.444 8.573 -11.690 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.749 10.456 -12.822 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.986 12.044 -12.054 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.424 11.206 -11.900 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.717 7.796 -10.145 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.353 9.445 -10.707 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.024 9.188 -9.079 1.00 0.00 H new ATOM 490 N GLN A 31 -8.653 12.636 -9.088 1.00 0.00 N ATOM 491 CA GLN A 31 -9.381 13.894 -9.047 1.00 0.00 C ATOM 492 C GLN A 31 -8.693 14.863 -8.093 1.00 0.00 C ATOM 493 O GLN A 31 -8.598 16.045 -8.415 1.00 0.00 O ATOM 494 CB GLN A 31 -10.838 13.672 -8.635 1.00 0.00 C ATOM 495 CG GLN A 31 -11.691 14.949 -8.830 1.00 0.00 C ATOM 496 CD GLN A 31 -12.332 15.380 -7.521 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.772 16.142 -6.736 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.515 14.859 -7.253 1.00 0.00 N ATOM 0 H GLN A 31 -9.208 11.832 -8.796 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.381 14.326 -10.048 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.262 12.858 -9.223 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -10.878 13.364 -7.590 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.065 15.754 -9.215 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.465 14.764 -9.575 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -13.958 14.229 -7.922 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -13.986 15.086 -6.377 1.00 0.00 H new ATOM 507 N ASP A 32 -8.152 14.367 -6.977 1.00 0.00 N ATOM 508 CA ASP A 32 -7.405 15.224 -6.071 1.00 0.00 C ATOM 509 C ASP A 32 -6.158 15.781 -6.774 1.00 0.00 C ATOM 510 O ASP A 32 -5.793 16.938 -6.542 1.00 0.00 O ATOM 511 CB ASP A 32 -7.004 14.483 -4.795 1.00 0.00 C ATOM 512 CG ASP A 32 -6.025 15.323 -3.952 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.495 16.200 -3.187 1.00 0.00 O ATOM 514 OD2 ASP A 32 -4.790 15.103 -4.047 1.00 0.00 O ATOM 0 H ASP A 32 -8.219 13.391 -6.688 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.056 16.050 -5.785 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.894 14.256 -4.207 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.542 13.530 -5.054 1.00 0.00 H new ATOM 519 N LYS A 33 -5.515 14.998 -7.658 1.00 0.00 N ATOM 520 CA LYS A 33 -4.211 15.370 -8.192 1.00 0.00 C ATOM 521 C LYS A 33 -4.306 16.069 -9.555 1.00 0.00 C ATOM 522 O LYS A 33 -3.482 16.928 -9.876 1.00 0.00 O ATOM 523 CB LYS A 33 -3.353 14.105 -8.252 1.00 0.00 C ATOM 524 CG LYS A 33 -3.293 13.291 -6.926 1.00 0.00 C ATOM 525 CD LYS A 33 -1.933 13.269 -6.207 1.00 0.00 C ATOM 526 CE LYS A 33 -1.383 14.658 -5.871 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.041 15.263 -4.674 1.00 0.00 N ATOM 0 H LYS A 33 -5.880 14.113 -8.010 1.00 0.00 H new ATOM 0 HA LYS A 33 -3.747 16.105 -7.534 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.738 13.459 -9.041 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.338 14.385 -8.536 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.037 13.696 -6.240 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.584 12.263 -7.141 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.030 12.695 -5.285 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.211 12.745 -6.834 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.310 14.587 -5.694 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.521 15.317 -6.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.898 16.293 -4.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.060 15.055 -4.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.624 14.863 -3.809 1.00 0.00 H new ATOM 541 N GLU A 34 -5.357 15.764 -10.315 1.00 0.00 N ATOM 542 CA GLU A 34 -5.535 16.116 -11.718 1.00 0.00 C ATOM 543 C GLU A 34 -6.752 17.007 -11.960 1.00 0.00 C ATOM 544 O GLU A 34 -6.736 17.853 -12.859 1.00 0.00 O ATOM 545 CB GLU A 34 -5.693 14.808 -12.514 1.00 0.00 C ATOM 546 CG GLU A 34 -4.470 13.884 -12.419 1.00 0.00 C ATOM 547 CD GLU A 34 -3.125 14.627 -12.549 1.00 0.00 C ATOM 548 OE1 GLU A 34 -2.888 15.294 -13.585 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.318 14.551 -11.596 1.00 0.00 O ATOM 0 H GLU A 34 -6.148 15.236 -9.946 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.663 16.686 -12.040 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.571 14.274 -12.151 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.877 15.049 -13.561 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.495 13.359 -11.464 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.535 13.127 -13.201 1.00 0.00 H new ATOM 556 N GLY A 35 -7.805 16.833 -11.159 1.00 0.00 N ATOM 557 CA GLY A 35 -8.984 17.690 -11.174 1.00 0.00 C ATOM 558 C GLY A 35 -10.034 17.171 -12.147 1.00 0.00 C ATOM 559 O GLY A 35 -10.757 17.972 -12.737 1.00 0.00 O ATOM 0 H GLY A 35 -7.860 16.080 -10.473 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.409 17.744 -10.172 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -8.696 18.703 -11.453 1.00 0.00 H new ATOM 563 N ILE A 36 -10.110 15.844 -12.336 1.00 0.00 N ATOM 564 CA ILE A 36 -11.072 15.216 -13.234 1.00 0.00 C ATOM 565 C ILE A 36 -11.933 14.347 -12.337 1.00 0.00 C ATOM 566 O ILE A 36 -11.361 13.546 -11.597 1.00 0.00 O ATOM 567 CB ILE A 36 -10.350 14.338 -14.267 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.323 15.115 -15.105 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.382 13.685 -15.203 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.319 14.111 -15.647 1.00 0.00 C ATOM 0 H ILE A 36 -9.498 15.179 -11.863 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.653 15.954 -13.787 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.801 13.580 -13.708 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.816 15.643 -15.922 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.822 15.867 -14.496 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.867 13.063 -15.935 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.064 13.068 -14.618 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.947 14.461 -15.720 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.573 14.631 -16.249 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.827 13.604 -14.817 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.836 13.377 -16.265 1.00 0.00 H new ATOM 582 N PRO A 37 -13.265 14.418 -12.398 1.00 0.00 N ATOM 583 CA PRO A 37 -14.129 13.558 -11.604 1.00 0.00 C ATOM 584 C PRO A 37 -13.892 12.083 -11.930 1.00 0.00 C ATOM 585 O PRO A 37 -13.578 11.757 -13.077 1.00 0.00 O ATOM 586 CB PRO A 37 -15.565 14.007 -11.886 1.00 0.00 C ATOM 587 CG PRO A 37 -15.450 15.258 -12.756 1.00 0.00 C ATOM 588 CD PRO A 37 -14.039 15.207 -13.333 1.00 0.00 C ATOM 0 HA PRO A 37 -13.915 13.649 -10.539 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.125 13.225 -12.399 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.096 14.224 -10.959 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.200 15.260 -13.547 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.604 16.163 -12.169 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.037 14.754 -14.324 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.623 16.209 -13.440 1.00 0.00 H new ATOM 596 N PRO A 38 -14.073 11.159 -10.970 1.00 0.00 N ATOM 597 CA PRO A 38 -13.872 9.741 -11.229 1.00 0.00 C ATOM 598 C PRO A 38 -14.818 9.226 -12.299 1.00 0.00 C ATOM 599 O PRO A 38 -14.420 8.408 -13.123 1.00 0.00 O ATOM 600 CB PRO A 38 -14.111 9.040 -9.896 1.00 0.00 C ATOM 601 CG PRO A 38 -14.959 10.015 -9.077 1.00 0.00 C ATOM 602 CD PRO A 38 -14.498 11.378 -9.589 1.00 0.00 C ATOM 0 HA PRO A 38 -12.868 9.549 -11.609 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.628 8.091 -10.037 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.170 8.818 -9.393 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -16.025 9.861 -9.242 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -14.783 9.904 -8.007 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.305 12.108 -9.539 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.679 11.767 -8.984 1.00 0.00 H new ATOM 610 N ASP A 39 -16.032 9.770 -12.349 1.00 0.00 N ATOM 611 CA ASP A 39 -17.043 9.312 -13.299 1.00 0.00 C ATOM 612 C ASP A 39 -16.673 9.633 -14.752 1.00 0.00 C ATOM 613 O ASP A 39 -17.247 9.057 -15.674 1.00 0.00 O ATOM 614 CB ASP A 39 -18.405 9.901 -12.911 1.00 0.00 C ATOM 615 CG ASP A 39 -19.565 9.338 -13.754 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.862 8.124 -13.637 1.00 0.00 O ATOM 617 OD2 ASP A 39 -20.195 10.118 -14.505 1.00 0.00 O ATOM 0 H ASP A 39 -16.340 10.530 -11.742 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.097 8.225 -13.246 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.596 9.697 -11.857 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.372 10.984 -13.025 1.00 0.00 H new ATOM 622 N GLN A 40 -15.663 10.490 -14.977 1.00 0.00 N ATOM 623 CA GLN A 40 -15.153 10.819 -16.319 1.00 0.00 C ATOM 624 C GLN A 40 -13.831 10.106 -16.612 1.00 0.00 C ATOM 625 O GLN A 40 -13.399 10.096 -17.762 1.00 0.00 O ATOM 626 CB GLN A 40 -15.028 12.349 -16.452 1.00 0.00 C ATOM 627 CG GLN A 40 -14.610 12.875 -17.847 1.00 0.00 C ATOM 628 CD GLN A 40 -15.605 12.557 -18.954 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.419 11.658 -19.770 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.710 13.279 -18.993 1.00 0.00 N ATOM 0 H GLN A 40 -15.174 10.978 -14.227 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.860 10.460 -17.067 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -15.986 12.797 -16.189 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.300 12.700 -15.720 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.478 13.955 -17.791 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.642 12.448 -18.109 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -16.857 14.024 -18.312 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.417 13.092 -19.704 1.00 0.00 H new ATOM 639 N GLN A 41 -13.166 9.498 -15.628 1.00 0.00 N ATOM 640 CA GLN A 41 -11.912 8.810 -15.888 1.00 0.00 C ATOM 641 C GLN A 41 -12.200 7.432 -16.451 1.00 0.00 C ATOM 642 O GLN A 41 -13.124 6.745 -16.026 1.00 0.00 O ATOM 643 CB GLN A 41 -11.106 8.677 -14.585 1.00 0.00 C ATOM 644 CG GLN A 41 -10.430 9.983 -14.136 1.00 0.00 C ATOM 645 CD GLN A 41 -10.036 9.888 -12.675 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.389 8.931 -12.287 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.446 10.810 -11.821 1.00 0.00 N ATOM 0 H GLN A 41 -13.475 9.471 -14.656 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.330 9.385 -16.609 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.770 8.331 -13.792 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.342 7.911 -14.718 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.548 10.174 -14.747 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.109 10.823 -14.284 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.987 11.608 -12.153 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.221 10.723 -10.830 1.00 0.00 H new ATOM 656 N ARG A 42 -11.305 6.997 -17.327 1.00 0.00 N ATOM 657 CA ARG A 42 -11.253 5.662 -17.902 1.00 0.00 C ATOM 658 C ARG A 42 -9.854 5.207 -17.560 1.00 0.00 C ATOM 659 O ARG A 42 -8.899 5.685 -18.146 1.00 0.00 O ATOM 660 CB ARG A 42 -11.544 5.810 -19.398 1.00 0.00 C ATOM 661 CG ARG A 42 -11.668 4.498 -20.185 1.00 0.00 C ATOM 662 CD ARG A 42 -12.063 4.818 -21.640 1.00 0.00 C ATOM 663 NE ARG A 42 -12.457 3.628 -22.418 1.00 0.00 N ATOM 664 CZ ARG A 42 -13.112 3.608 -23.593 1.00 0.00 C ATOM 665 NH1 ARG A 42 -13.443 4.731 -24.229 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.436 2.438 -24.127 1.00 0.00 N ATOM 0 H ARG A 42 -10.557 7.598 -17.673 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.973 4.929 -17.537 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.471 6.372 -19.515 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.750 6.408 -19.846 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.723 3.955 -20.163 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.417 3.853 -19.725 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.889 5.529 -21.636 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.224 5.306 -22.137 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.206 2.722 -22.022 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.200 5.636 -23.826 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.940 4.686 -25.119 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.189 1.572 -23.647 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.933 2.404 -25.017 1.00 0.00 H new ATOM 680 N LEU A 43 -9.702 4.451 -16.485 1.00 0.00 N ATOM 681 CA LEU A 43 -8.375 4.118 -15.974 1.00 0.00 C ATOM 682 C LEU A 43 -7.934 2.918 -16.784 1.00 0.00 C ATOM 683 O LEU A 43 -8.748 2.035 -17.023 1.00 0.00 O ATOM 684 CB LEU A 43 -8.482 3.815 -14.466 1.00 0.00 C ATOM 685 CG LEU A 43 -7.341 4.382 -13.614 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.290 5.922 -13.648 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.604 3.932 -12.173 1.00 0.00 C ATOM 0 H LEU A 43 -10.475 4.056 -15.949 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.648 4.924 -16.072 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.426 4.214 -14.096 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.517 2.734 -14.328 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.390 4.020 -14.004 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.464 6.272 -13.029 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.142 6.259 -14.674 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.227 6.326 -13.265 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.815 4.312 -11.523 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.567 4.320 -11.840 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.617 2.843 -12.129 1.00 0.00 H new ATOM 699 N ILE A 44 -6.679 2.870 -17.196 1.00 0.00 N ATOM 700 CA ILE A 44 -6.139 1.793 -18.026 1.00 0.00 C ATOM 701 C ILE A 44 -4.926 1.241 -17.304 1.00 0.00 C ATOM 702 O ILE A 44 -4.235 1.963 -16.588 1.00 0.00 O ATOM 703 CB ILE A 44 -5.888 2.311 -19.467 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.279 2.631 -20.066 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.109 1.355 -20.393 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.362 2.875 -21.580 1.00 0.00 C ATOM 0 H ILE A 44 -5.991 3.586 -16.963 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.835 0.965 -18.161 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.239 3.184 -19.398 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.948 1.806 -19.822 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.667 3.516 -19.561 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.990 1.815 -21.374 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.127 1.154 -19.965 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.659 0.419 -20.496 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.394 3.087 -21.858 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.732 3.724 -21.847 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.018 1.987 -22.111 1.00 0.00 H new ATOM 718 N PHE A 45 -4.676 -0.051 -17.493 1.00 0.00 N ATOM 719 CA PHE A 45 -3.498 -0.712 -16.981 1.00 0.00 C ATOM 720 C PHE A 45 -3.076 -1.734 -18.016 1.00 0.00 C ATOM 721 O PHE A 45 -3.836 -2.661 -18.281 1.00 0.00 O ATOM 722 CB PHE A 45 -3.826 -1.399 -15.651 1.00 0.00 C ATOM 723 CG PHE A 45 -2.707 -2.265 -15.144 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.465 -1.668 -14.885 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.883 -3.650 -14.974 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.398 -2.455 -14.420 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.830 -4.429 -14.473 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.597 -3.828 -14.178 1.00 0.00 C ATOM 0 H PHE A 45 -5.298 -0.669 -18.014 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.694 0.001 -16.799 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -4.057 -0.640 -14.904 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.722 -2.008 -15.774 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.329 -0.608 -15.042 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.826 -4.112 -15.228 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.571 -2.009 -14.249 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.968 -5.488 -14.315 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.204 -4.422 -13.763 1.00 0.00 H new ATOM 738 N ALA A 46 -1.896 -1.562 -18.612 1.00 0.00 N ATOM 739 CA ALA A 46 -1.288 -2.530 -19.537 1.00 0.00 C ATOM 740 C ALA A 46 -2.203 -2.943 -20.707 1.00 0.00 C ATOM 741 O ALA A 46 -2.096 -4.049 -21.243 1.00 0.00 O ATOM 742 CB ALA A 46 -0.801 -3.728 -18.715 1.00 0.00 C ATOM 0 H ALA A 46 -1.322 -0.732 -18.465 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.445 -2.051 -20.034 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.345 -4.463 -19.378 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.065 -3.393 -17.984 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.646 -4.182 -18.197 1.00 0.00 H new ATOM 748 N GLY A 47 -3.126 -2.054 -21.085 1.00 0.00 N ATOM 749 CA GLY A 47 -4.093 -2.250 -22.167 1.00 0.00 C ATOM 750 C GLY A 47 -5.470 -2.710 -21.698 1.00 0.00 C ATOM 751 O GLY A 47 -6.402 -2.752 -22.501 1.00 0.00 O ATOM 0 H GLY A 47 -3.223 -1.147 -20.630 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.202 -1.315 -22.716 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.695 -2.985 -22.866 1.00 0.00 H new ATOM 755 N LYS A 48 -5.632 -3.019 -20.409 1.00 0.00 N ATOM 756 CA LYS A 48 -6.933 -3.284 -19.797 1.00 0.00 C ATOM 757 C LYS A 48 -7.488 -1.950 -19.346 1.00 0.00 C ATOM 758 O LYS A 48 -6.722 -1.033 -19.103 1.00 0.00 O ATOM 759 CB LYS A 48 -6.778 -4.252 -18.608 1.00 0.00 C ATOM 760 CG LYS A 48 -6.259 -5.617 -19.077 1.00 0.00 C ATOM 761 CD LYS A 48 -6.157 -6.630 -17.927 1.00 0.00 C ATOM 762 CE LYS A 48 -5.637 -7.969 -18.475 1.00 0.00 C ATOM 763 NZ LYS A 48 -5.530 -9.015 -17.423 1.00 0.00 N ATOM 0 H LYS A 48 -4.853 -3.093 -19.755 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.612 -3.757 -20.506 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.090 -3.829 -17.877 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.738 -4.376 -18.107 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.923 -6.010 -19.847 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.278 -5.492 -19.536 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.486 -6.255 -17.155 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.133 -6.769 -17.461 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.304 -8.318 -19.263 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.659 -7.816 -18.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.175 -9.897 -17.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.873 -8.697 -16.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.467 -9.184 -17.005 1.00 0.00 H new ATOM 777 N GLN A 49 -8.788 -1.845 -19.162 1.00 0.00 N ATOM 778 CA GLN A 49 -9.469 -0.719 -18.536 1.00 0.00 C ATOM 779 C GLN A 49 -10.071 -1.233 -17.241 1.00 0.00 C ATOM 780 O GLN A 49 -10.429 -2.407 -17.145 1.00 0.00 O ATOM 781 CB GLN A 49 -10.582 -0.211 -19.469 1.00 0.00 C ATOM 782 CG GLN A 49 -10.056 0.403 -20.781 1.00 0.00 C ATOM 783 CD GLN A 49 -10.989 0.148 -21.964 1.00 0.00 C ATOM 784 OE1 GLN A 49 -11.972 0.861 -22.152 1.00 0.00 O ATOM 785 NE2 GLN A 49 -10.709 -0.841 -22.797 1.00 0.00 N ATOM 0 H GLN A 49 -9.435 -2.576 -19.458 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.781 0.104 -18.343 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.250 -1.038 -19.707 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.175 0.536 -18.940 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.928 1.477 -20.649 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.072 -0.011 -21.003 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.891 -1.429 -22.634 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.311 -1.016 -23.602 1.00 0.00 H new ATOM 794 N LEU A 50 -10.157 -0.351 -16.246 1.00 0.00 N ATOM 795 CA LEU A 50 -10.509 -0.754 -14.893 1.00 0.00 C ATOM 796 C LEU A 50 -11.806 -0.073 -14.494 1.00 0.00 C ATOM 797 O LEU A 50 -11.957 1.124 -14.745 1.00 0.00 O ATOM 798 CB LEU A 50 -9.384 -0.442 -13.890 1.00 0.00 C ATOM 799 CG LEU A 50 -7.955 -0.913 -14.181 1.00 0.00 C ATOM 800 CD1 LEU A 50 -7.230 -0.087 -15.242 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.105 -0.771 -12.913 1.00 0.00 C ATOM 0 H LEU A 50 -9.987 0.649 -16.356 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.647 -1.835 -14.875 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.351 0.640 -13.764 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.677 -0.866 -12.930 1.00 0.00 H new ATOM 0 HG LEU A 50 -8.060 -1.939 -14.533 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.226 -0.485 -15.389 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.781 -0.136 -16.181 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.165 0.950 -14.914 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.088 -1.105 -13.117 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.088 0.273 -12.602 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.534 -1.380 -12.117 1.00 0.00 H new ATOM 813 N GLU A 51 -12.715 -0.806 -13.844 1.00 0.00 N ATOM 814 CA GLU A 51 -14.016 -0.280 -13.442 1.00 0.00 C ATOM 815 C GLU A 51 -13.982 0.039 -11.948 1.00 0.00 C ATOM 816 O GLU A 51 -13.211 -0.552 -11.194 1.00 0.00 O ATOM 817 CB GLU A 51 -15.165 -1.216 -13.882 1.00 0.00 C ATOM 818 CG GLU A 51 -15.228 -2.529 -13.103 1.00 0.00 C ATOM 819 CD GLU A 51 -16.285 -3.544 -13.585 1.00 0.00 C ATOM 820 OE1 GLU A 51 -17.196 -3.187 -14.372 1.00 0.00 O ATOM 821 OE2 GLU A 51 -16.214 -4.719 -13.144 1.00 0.00 O ATOM 0 H GLU A 51 -12.566 -1.781 -13.583 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.227 0.656 -13.959 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -16.113 -0.691 -13.766 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -15.052 -1.440 -14.943 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.248 -3.004 -13.148 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.423 -2.299 -12.055 1.00 0.00 H new ATOM 828 N ASP A 52 -14.826 0.976 -11.522 1.00 0.00 N ATOM 829 CA ASP A 52 -14.817 1.596 -10.193 1.00 0.00 C ATOM 830 C ASP A 52 -14.925 0.564 -9.077 1.00 0.00 C ATOM 831 O ASP A 52 -14.272 0.701 -8.043 1.00 0.00 O ATOM 832 CB ASP A 52 -15.958 2.619 -10.081 1.00 0.00 C ATOM 833 CG ASP A 52 -15.589 3.962 -10.716 1.00 0.00 C ATOM 834 OD1 ASP A 52 -15.404 4.002 -11.955 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.452 4.971 -9.989 1.00 0.00 O ATOM 0 H ASP A 52 -15.569 1.342 -12.118 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.859 2.103 -10.075 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.850 2.222 -10.566 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.207 2.771 -9.031 1.00 0.00 H new ATOM 840 N GLY A 53 -15.713 -0.488 -9.309 1.00 0.00 N ATOM 841 CA GLY A 53 -16.033 -1.514 -8.327 1.00 0.00 C ATOM 842 C GLY A 53 -14.939 -2.566 -8.136 1.00 0.00 C ATOM 843 O GLY A 53 -15.186 -3.576 -7.470 1.00 0.00 O ATOM 0 H GLY A 53 -16.157 -0.650 -10.213 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -16.230 -1.034 -7.369 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.953 -2.014 -8.628 1.00 0.00 H new ATOM 847 N ARG A 54 -13.754 -2.369 -8.722 1.00 0.00 N ATOM 848 CA ARG A 54 -12.657 -3.339 -8.702 1.00 0.00 C ATOM 849 C ARG A 54 -11.503 -2.777 -7.907 1.00 0.00 C ATOM 850 O ARG A 54 -11.565 -1.633 -7.479 1.00 0.00 O ATOM 851 CB ARG A 54 -12.272 -3.638 -10.151 1.00 0.00 C ATOM 852 CG ARG A 54 -13.373 -4.336 -10.955 1.00 0.00 C ATOM 853 CD ARG A 54 -13.746 -5.734 -10.483 1.00 0.00 C ATOM 854 NE ARG A 54 -14.626 -6.386 -11.465 1.00 0.00 N ATOM 855 CZ ARG A 54 -14.650 -7.686 -11.782 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.807 -8.560 -11.229 1.00 0.00 N ATOM 857 NH2 ARG A 54 -15.549 -8.100 -12.669 1.00 0.00 N ATOM 0 H ARG A 54 -13.527 -1.515 -9.232 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.953 -4.270 -8.219 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.010 -2.703 -10.647 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.379 -4.263 -10.158 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -14.267 -3.713 -10.930 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -13.055 -4.396 -11.996 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -12.844 -6.330 -10.340 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.247 -5.677 -9.517 1.00 0.00 H new ATOM 0 HE ARG A 54 -15.287 -5.784 -11.956 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -13.120 -8.243 -10.545 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.849 -9.545 -11.491 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.197 -7.433 -13.088 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -15.591 -9.085 -12.931 1.00 0.00 H new ATOM 871 N THR A 55 -10.429 -3.533 -7.730 1.00 0.00 N ATOM 872 CA THR A 55 -9.298 -3.148 -6.901 1.00 0.00 C ATOM 873 C THR A 55 -8.021 -3.367 -7.673 1.00 0.00 C ATOM 874 O THR A 55 -8.013 -4.038 -8.702 1.00 0.00 O ATOM 875 CB THR A 55 -9.296 -3.993 -5.624 1.00 0.00 C ATOM 876 OG1 THR A 55 -9.424 -5.363 -5.968 1.00 0.00 O ATOM 877 CG2 THR A 55 -10.422 -3.605 -4.674 1.00 0.00 C ATOM 0 H THR A 55 -10.318 -4.448 -8.167 1.00 0.00 H new ATOM 0 HA THR A 55 -9.375 -2.095 -6.630 1.00 0.00 H new ATOM 0 HB THR A 55 -8.352 -3.812 -5.109 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.421 -5.907 -5.153 1.00 0.00 H new ATOM 0 HG21 THR A 55 -10.379 -4.232 -3.783 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.312 -2.559 -4.387 1.00 0.00 H new ATOM 0 HG23 THR A 55 -11.382 -3.746 -5.171 1.00 0.00 H new ATOM 885 N LEU A 56 -6.925 -2.824 -7.159 1.00 0.00 N ATOM 886 CA LEU A 56 -5.630 -3.001 -7.820 1.00 0.00 C ATOM 887 C LEU A 56 -5.277 -4.489 -7.947 1.00 0.00 C ATOM 888 O LEU A 56 -4.908 -4.957 -9.021 1.00 0.00 O ATOM 889 CB LEU A 56 -4.567 -2.176 -7.071 1.00 0.00 C ATOM 890 CG LEU A 56 -4.950 -0.695 -6.952 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.826 0.087 -6.295 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.270 -0.091 -8.328 1.00 0.00 C ATOM 0 H LEU A 56 -6.900 -2.268 -6.304 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.673 -2.626 -8.843 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.425 -2.592 -6.074 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.613 -2.261 -7.591 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.845 -0.629 -6.333 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.110 1.136 -6.217 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.638 -0.314 -5.299 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.922 0.000 -6.898 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.538 0.959 -8.211 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.396 -0.173 -8.974 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.104 -0.630 -8.777 1.00 0.00 H new ATOM 904 N SER A 57 -5.518 -5.250 -6.889 1.00 0.00 N ATOM 905 CA SER A 57 -5.377 -6.698 -6.818 1.00 0.00 C ATOM 906 C SER A 57 -6.259 -7.428 -7.826 1.00 0.00 C ATOM 907 O SER A 57 -5.823 -8.450 -8.357 1.00 0.00 O ATOM 908 CB SER A 57 -5.743 -7.168 -5.410 1.00 0.00 C ATOM 909 OG SER A 57 -4.641 -7.017 -4.543 1.00 0.00 O ATOM 0 H SER A 57 -5.836 -4.850 -6.006 1.00 0.00 H new ATOM 0 HA SER A 57 -4.340 -6.934 -7.058 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.590 -6.593 -5.036 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.053 -8.213 -5.437 1.00 0.00 H new ATOM 0 HG SER A 57 -4.888 -7.320 -3.644 1.00 0.00 H new ATOM 915 N ASP A 58 -7.453 -6.917 -8.155 1.00 0.00 N ATOM 916 CA ASP A 58 -8.304 -7.544 -9.168 1.00 0.00 C ATOM 917 C ASP A 58 -7.582 -7.575 -10.516 1.00 0.00 C ATOM 918 O ASP A 58 -7.695 -8.541 -11.278 1.00 0.00 O ATOM 919 CB ASP A 58 -9.617 -6.776 -9.296 1.00 0.00 C ATOM 920 CG ASP A 58 -10.606 -7.529 -10.202 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.605 -7.326 -11.436 1.00 0.00 O ATOM 922 OD2 ASP A 58 -11.454 -8.285 -9.667 1.00 0.00 O ATOM 0 H ASP A 58 -7.848 -6.075 -7.735 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.521 -8.567 -8.861 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -10.057 -6.633 -8.309 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.425 -5.784 -9.706 1.00 0.00 H new ATOM 927 N TYR A 59 -6.745 -6.558 -10.743 1.00 0.00 N ATOM 928 CA TYR A 59 -5.911 -6.395 -11.928 1.00 0.00 C ATOM 929 C TYR A 59 -4.462 -6.846 -11.674 1.00 0.00 C ATOM 930 O TYR A 59 -3.609 -6.702 -12.547 1.00 0.00 O ATOM 931 CB TYR A 59 -6.045 -4.942 -12.400 1.00 0.00 C ATOM 932 CG TYR A 59 -7.451 -4.601 -12.861 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.905 -5.063 -14.114 1.00 0.00 C ATOM 934 CD2 TYR A 59 -8.330 -3.887 -12.018 1.00 0.00 C ATOM 935 CE1 TYR A 59 -9.240 -4.852 -14.512 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.654 -3.667 -12.420 1.00 0.00 C ATOM 937 CZ TYR A 59 -10.132 -4.170 -13.650 1.00 0.00 C ATOM 938 OH TYR A 59 -11.435 -3.960 -13.997 1.00 0.00 O ATOM 0 H TYR A 59 -6.628 -5.796 -10.075 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.250 -7.047 -12.733 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.762 -4.273 -11.587 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.346 -4.764 -13.217 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.225 -5.582 -14.773 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.983 -3.512 -11.067 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.582 -5.210 -15.472 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.318 -3.105 -11.780 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.953 -4.776 -13.833 1.00 0.00 H new ATOM 948 N ASN A 60 -4.186 -7.430 -10.497 1.00 0.00 N ATOM 949 CA ASN A 60 -2.886 -7.935 -10.031 1.00 0.00 C ATOM 950 C ASN A 60 -1.789 -6.863 -10.004 1.00 0.00 C ATOM 951 O ASN A 60 -0.593 -7.159 -9.945 1.00 0.00 O ATOM 952 CB ASN A 60 -2.507 -9.246 -10.756 1.00 0.00 C ATOM 953 CG ASN A 60 -2.811 -10.484 -9.919 1.00 0.00 C ATOM 954 OD1 ASN A 60 -1.969 -11.366 -9.769 1.00 0.00 O ATOM 955 ND2 ASN A 60 -4.002 -10.588 -9.343 1.00 0.00 N ATOM 0 H ASN A 60 -4.916 -7.571 -9.798 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.990 -8.200 -8.979 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -3.050 -9.306 -11.699 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.445 -9.228 -11.001 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -4.223 -11.404 -8.772 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.697 -9.852 -9.471 1.00 0.00 H new ATOM 962 N ILE A 61 -2.207 -5.598 -9.997 1.00 0.00 N ATOM 963 CA ILE A 61 -1.364 -4.443 -9.754 1.00 0.00 C ATOM 964 C ILE A 61 -0.926 -4.555 -8.296 1.00 0.00 C ATOM 965 O ILE A 61 -1.741 -4.810 -7.406 1.00 0.00 O ATOM 966 CB ILE A 61 -2.196 -3.172 -9.989 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.665 -3.060 -11.447 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.453 -1.882 -9.590 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.922 -2.209 -11.532 1.00 0.00 C ATOM 0 H ILE A 61 -3.181 -5.347 -10.168 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.497 -4.399 -10.413 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.065 -3.273 -9.338 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.877 -2.619 -12.057 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.862 -4.053 -11.850 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.093 -1.020 -9.780 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.201 -1.920 -8.530 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.539 -1.792 -10.177 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.244 -2.138 -12.571 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.713 -2.667 -10.938 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.712 -1.211 -11.148 1.00 0.00 H new ATOM 981 N GLN A 62 0.359 -4.323 -8.061 1.00 0.00 N ATOM 982 CA GLN A 62 0.974 -4.324 -6.741 1.00 0.00 C ATOM 983 C GLN A 62 1.559 -2.931 -6.524 1.00 0.00 C ATOM 984 O GLN A 62 1.228 -1.981 -7.230 1.00 0.00 O ATOM 985 CB GLN A 62 2.019 -5.454 -6.707 1.00 0.00 C ATOM 986 CG GLN A 62 1.337 -6.827 -6.825 1.00 0.00 C ATOM 987 CD GLN A 62 2.303 -7.881 -7.355 1.00 0.00 C ATOM 988 OE1 GLN A 62 3.088 -8.478 -6.622 1.00 0.00 O ATOM 989 NE2 GLN A 62 2.272 -8.105 -8.660 1.00 0.00 N ATOM 0 H GLN A 62 1.023 -4.122 -8.809 1.00 0.00 H new ATOM 0 HA GLN A 62 0.274 -4.520 -5.929 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.730 -5.324 -7.523 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.587 -5.403 -5.778 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.960 -7.134 -5.849 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.476 -6.752 -7.490 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.612 -7.598 -9.249 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.908 -8.785 -9.076 1.00 0.00 H new ATOM 998 N LYS A 63 2.409 -2.786 -5.516 1.00 0.00 N ATOM 999 CA LYS A 63 3.152 -1.566 -5.278 1.00 0.00 C ATOM 1000 C LYS A 63 4.065 -1.255 -6.447 1.00 0.00 C ATOM 1001 O LYS A 63 4.382 -2.113 -7.268 1.00 0.00 O ATOM 1002 CB LYS A 63 3.955 -1.685 -3.974 1.00 0.00 C ATOM 1003 CG LYS A 63 5.124 -2.679 -3.975 1.00 0.00 C ATOM 1004 CD LYS A 63 6.005 -2.396 -2.748 1.00 0.00 C ATOM 1005 CE LYS A 63 7.030 -3.493 -2.435 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.952 -3.793 -3.564 1.00 0.00 N ATOM 0 H LYS A 63 2.601 -3.522 -4.837 1.00 0.00 H new ATOM 0 HA LYS A 63 2.446 -0.742 -5.178 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.347 -0.699 -3.724 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.269 -1.967 -3.176 1.00 0.00 H new ATOM 0 HG2 LYS A 63 4.751 -3.703 -3.946 1.00 0.00 H new ATOM 0 HG3 LYS A 63 5.706 -2.578 -4.891 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.534 -1.456 -2.905 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.362 -2.258 -1.879 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.618 -3.191 -1.568 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.500 -4.405 -2.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.802 -4.269 -3.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.473 -4.413 -4.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.226 -2.906 -4.034 1.00 0.00 H new ATOM 1020 N GLU A 64 4.520 -0.008 -6.417 1.00 0.00 N ATOM 1021 CA GLU A 64 5.456 0.611 -7.341 1.00 0.00 C ATOM 1022 C GLU A 64 5.131 0.190 -8.778 1.00 0.00 C ATOM 1023 O GLU A 64 5.992 -0.237 -9.550 1.00 0.00 O ATOM 1024 CB GLU A 64 6.911 0.473 -6.830 1.00 0.00 C ATOM 1025 CG GLU A 64 7.625 -0.867 -7.025 1.00 0.00 C ATOM 1026 CD GLU A 64 8.871 -0.976 -6.128 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.944 -0.439 -6.498 1.00 0.00 O ATOM 1028 OE2 GLU A 64 8.787 -1.624 -5.055 1.00 0.00 O ATOM 0 H GLU A 64 4.220 0.643 -5.691 1.00 0.00 H new ATOM 0 HA GLU A 64 5.341 1.694 -7.379 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.509 1.242 -7.318 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.911 0.698 -5.763 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.939 -1.683 -6.798 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.916 -0.977 -8.070 1.00 0.00 H new ATOM 1035 N SER A 65 3.835 0.277 -9.101 1.00 0.00 N ATOM 1036 CA SER A 65 3.313 -0.209 -10.384 1.00 0.00 C ATOM 1037 C SER A 65 2.637 0.942 -11.100 1.00 0.00 C ATOM 1038 O SER A 65 2.123 1.854 -10.451 1.00 0.00 O ATOM 1039 CB SER A 65 2.360 -1.395 -10.172 1.00 0.00 C ATOM 1040 OG SER A 65 3.046 -2.537 -9.689 1.00 0.00 O ATOM 0 H SER A 65 3.126 0.681 -8.489 1.00 0.00 H new ATOM 0 HA SER A 65 4.131 -0.576 -11.004 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.579 -1.113 -9.465 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.866 -1.638 -11.113 1.00 0.00 H new ATOM 0 HG SER A 65 3.491 -2.318 -8.844 1.00 0.00 H new ATOM 1046 N THR A 66 2.644 0.910 -12.426 1.00 0.00 N ATOM 1047 CA THR A 66 2.233 2.039 -13.252 1.00 0.00 C ATOM 1048 C THR A 66 0.843 1.795 -13.824 1.00 0.00 C ATOM 1049 O THR A 66 0.505 0.685 -14.219 1.00 0.00 O ATOM 1050 CB THR A 66 3.276 2.310 -14.362 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.574 2.321 -13.790 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.052 3.645 -15.101 1.00 0.00 C ATOM 0 H THR A 66 2.937 0.094 -12.963 1.00 0.00 H new ATOM 0 HA THR A 66 2.182 2.934 -12.632 1.00 0.00 H new ATOM 0 HB THR A 66 3.167 1.511 -15.096 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.239 2.491 -14.490 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.819 3.771 -15.865 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.068 3.640 -15.571 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.110 4.469 -14.390 1.00 0.00 H new ATOM 1060 N LEU A 67 0.052 2.863 -13.887 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.318 2.945 -14.374 1.00 0.00 C ATOM 1062 C LEU A 67 -1.435 4.044 -15.425 1.00 0.00 C ATOM 1063 O LEU A 67 -0.508 4.835 -15.571 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.194 3.299 -13.161 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.421 2.424 -12.999 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.996 1.019 -12.589 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.308 3.005 -11.899 1.00 0.00 C ATOM 0 H LEU A 67 0.386 3.773 -13.570 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.627 2.005 -14.830 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.589 3.226 -12.257 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.512 4.338 -13.249 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.964 2.386 -13.943 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.879 0.391 -12.473 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.348 0.596 -13.357 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.456 1.064 -11.643 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.193 2.380 -11.777 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.753 3.035 -10.961 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.612 4.015 -12.173 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.594 4.180 -16.075 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.801 5.215 -17.099 1.00 0.00 C ATOM 1081 C HIS A 68 -4.118 5.945 -16.886 1.00 0.00 C ATOM 1082 O HIS A 68 -5.142 5.305 -16.655 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.777 4.590 -18.511 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.415 4.501 -19.154 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -0.895 3.366 -19.780 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.540 5.540 -19.309 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.297 3.744 -20.280 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.538 5.037 -20.005 1.00 0.00 N ATOM 0 H HIS A 68 -3.407 3.586 -15.912 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.988 5.935 -17.010 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.200 3.587 -18.454 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.429 5.174 -19.160 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.327 2.444 -19.845 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.668 6.553 -18.956 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.967 3.097 -20.827 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.101 7.281 -17.002 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.324 8.090 -17.063 1.00 0.00 C ATOM 1098 C LEU A 69 -5.687 8.193 -18.527 1.00 0.00 C ATOM 1099 O LEU A 69 -4.920 8.743 -19.310 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.131 9.498 -16.431 1.00 0.00 C ATOM 1101 CG LEU A 69 -5.768 10.771 -17.090 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.267 10.627 -17.380 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.624 11.938 -16.110 1.00 0.00 C ATOM 0 H LEU A 69 -3.242 7.828 -17.056 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.120 7.621 -16.485 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.508 9.444 -15.410 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.057 9.675 -16.366 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.250 10.926 -18.036 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.639 11.545 -17.835 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.427 9.793 -18.063 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.802 10.441 -16.448 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.061 12.836 -16.547 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.141 11.699 -15.181 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.568 12.112 -15.904 1.00 0.00 H new ATOM 1115 N VAL A 70 -6.886 7.734 -18.856 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.541 7.906 -20.140 1.00 0.00 C ATOM 1117 C VAL A 70 -8.931 8.465 -19.811 1.00 0.00 C ATOM 1118 O VAL A 70 -9.349 8.457 -18.654 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.442 6.548 -20.865 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.262 6.514 -22.138 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -5.966 6.240 -21.180 1.00 0.00 C ATOM 0 H VAL A 70 -7.456 7.204 -18.197 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.104 8.615 -20.843 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.850 5.787 -20.200 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.159 5.537 -22.611 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.311 6.693 -21.900 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -7.907 7.287 -22.820 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.896 5.280 -21.692 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.559 7.023 -21.820 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.397 6.198 -20.251 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.634 9.029 -20.785 1.00 0.00 N ATOM 1132 CA LEU A 71 -10.919 9.690 -20.560 1.00 0.00 C ATOM 1133 C LEU A 71 -12.039 8.721 -20.931 1.00 0.00 C ATOM 1134 O LEU A 71 -11.864 7.892 -21.813 1.00 0.00 O ATOM 1135 CB LEU A 71 -10.936 10.956 -21.437 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.121 11.898 -21.160 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.677 13.059 -20.271 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -12.731 12.425 -22.452 1.00 0.00 C ATOM 0 H LEU A 71 -9.330 9.042 -21.759 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.064 9.975 -19.518 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.007 11.504 -21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.960 10.658 -22.485 1.00 0.00 H new ATOM 0 HG LEU A 71 -12.888 11.324 -20.641 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.525 13.718 -20.083 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.303 12.670 -19.324 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.887 13.619 -20.771 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.565 13.087 -22.217 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -11.976 12.977 -23.012 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.089 11.589 -23.053 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.203 8.824 -20.295 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.405 8.049 -20.663 1.00 0.00 C ATOM 1152 C ARG A 72 -14.989 8.484 -22.004 1.00 0.00 C ATOM 1153 O ARG A 72 -15.602 7.673 -22.687 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.477 8.228 -19.563 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.484 7.068 -19.492 1.00 0.00 C ATOM 1156 CD ARG A 72 -17.257 7.156 -18.171 1.00 0.00 C ATOM 1157 NE ARG A 72 -18.325 6.140 -18.053 1.00 0.00 N ATOM 1158 CZ ARG A 72 -19.159 6.044 -17.007 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -19.067 6.923 -16.015 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -20.074 5.084 -16.963 1.00 0.00 N ATOM 0 H ARG A 72 -13.349 9.450 -19.503 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.109 7.004 -20.755 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -14.982 8.328 -18.597 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.018 9.157 -19.742 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.173 7.116 -20.335 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.963 6.113 -19.560 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.560 7.039 -17.341 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.697 8.149 -18.080 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.434 5.470 -18.815 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.366 7.663 -16.053 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.697 6.858 -15.216 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -20.146 4.413 -17.728 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.705 5.017 -16.164 1.00 0.00 H new ATOM 1174 N LEU A 73 -14.770 9.757 -22.364 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.444 10.436 -23.475 1.00 0.00 C ATOM 1176 C LEU A 73 -16.955 10.339 -23.162 1.00 0.00 C ATOM 1177 O LEU A 73 -17.750 10.037 -24.050 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.082 9.898 -24.893 1.00 0.00 C ATOM 1179 CG LEU A 73 -13.631 9.856 -25.415 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -12.949 11.177 -25.730 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -12.699 8.967 -24.599 1.00 0.00 C ATOM 0 H LEU A 73 -14.103 10.356 -21.877 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.105 11.470 -23.535 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.463 8.878 -24.947 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.654 10.490 -25.607 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.806 9.398 -26.389 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.936 10.988 -26.086 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.512 11.703 -26.501 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.908 11.789 -24.829 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.699 8.993 -25.032 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.659 9.328 -23.571 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.072 7.943 -24.609 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.359 10.511 -21.880 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.769 10.294 -21.496 1.00 0.00 C ATOM 1195 C ARG A 74 -19.687 11.269 -22.251 1.00 0.00 C ATOM 1196 O ARG A 74 -20.802 10.920 -22.634 1.00 0.00 O ATOM 1197 CB ARG A 74 -18.970 10.410 -19.970 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.312 9.790 -19.537 1.00 0.00 C ATOM 1199 CD ARG A 74 -20.496 9.854 -18.015 1.00 0.00 C ATOM 1200 NE ARG A 74 -21.759 9.208 -17.607 1.00 0.00 N ATOM 1201 CZ ARG A 74 -22.927 9.825 -17.373 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -23.072 11.128 -17.595 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -23.966 9.121 -16.929 1.00 0.00 N ATOM 0 H ARG A 74 -16.745 10.792 -21.115 1.00 0.00 H new ATOM 0 HA ARG A 74 -19.039 9.276 -21.778 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.151 9.909 -19.453 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -18.939 11.459 -19.675 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -21.132 10.316 -20.026 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -20.358 8.752 -19.867 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -19.657 9.363 -17.523 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -20.493 10.894 -17.688 1.00 0.00 H new ATOM 0 HE ARG A 74 -21.742 8.195 -17.492 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.288 11.675 -17.949 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -23.968 11.580 -17.411 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -23.871 8.118 -16.769 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.857 9.584 -16.749 1.00 0.00 H new ATOM 1217 N GLY A 75 -19.184 12.490 -22.464 1.00 0.00 N ATOM 1218 CA GLY A 75 -19.843 13.515 -23.280 1.00 0.00 C ATOM 1219 C GLY A 75 -20.992 14.239 -22.570 1.00 0.00 C ATOM 1220 O GLY A 75 -21.672 15.057 -23.195 1.00 0.00 O ATOM 0 H GLY A 75 -18.295 12.798 -22.069 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -19.100 14.251 -23.589 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -20.227 13.050 -24.188 1.00 0.00 H new ATOM 1224 N GLY A 76 -21.218 13.975 -21.282 1.00 0.00 N ATOM 1225 CA GLY A 76 -22.265 14.572 -20.467 1.00 0.00 C ATOM 1226 C GLY A 76 -22.296 13.879 -19.110 1.00 0.00 C ATOM 1227 O GLY A 76 -21.441 12.993 -18.868 1.00 0.00 O ATOM 1228 OXT GLY A 76 -23.194 14.205 -18.302 1.00 0.00 O ATOM 0 H GLY A 76 -20.648 13.309 -20.760 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -22.081 15.639 -20.340 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -23.231 14.472 -20.963 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -20.359 22.423 -36.369 1.00 0.00 N ATOM 1234 CA GLY B -3 -18.956 22.130 -36.749 1.00 0.00 C ATOM 1235 C GLY B -3 -18.826 20.747 -37.389 1.00 0.00 C ATOM 1236 O GLY B -3 -19.428 19.779 -36.913 1.00 0.00 O ATOM 0 H1 GLY B -3 -20.412 23.368 -35.938 1.00 0.00 H new ATOM 0 H2 GLY B -3 -20.961 22.395 -37.216 1.00 0.00 H new ATOM 0 H3 GLY B -3 -20.689 21.712 -35.686 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -18.600 22.889 -37.446 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -18.320 22.185 -35.866 1.00 0.00 H new ATOM 1242 N HIS B -2 -18.030 20.633 -38.466 1.00 0.00 N ATOM 1243 CA HIS B -2 -17.873 19.399 -39.251 1.00 0.00 C ATOM 1244 C HIS B -2 -16.404 19.191 -39.655 1.00 0.00 C ATOM 1245 O HIS B -2 -16.110 18.595 -40.694 1.00 0.00 O ATOM 1246 CB HIS B -2 -18.833 19.461 -40.453 1.00 0.00 C ATOM 1247 CG HIS B -2 -19.027 18.136 -41.157 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -19.412 16.935 -40.546 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -18.878 17.924 -42.499 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -19.473 16.029 -41.541 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -19.158 16.596 -42.720 1.00 0.00 N ATOM 0 H HIS B -2 -17.470 21.408 -38.820 1.00 0.00 H new ATOM 0 HA HIS B -2 -18.137 18.527 -38.653 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -19.802 19.824 -40.112 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -18.454 20.189 -41.170 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -18.596 18.656 -43.241 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -19.738 14.990 -41.410 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -19.131 16.122 -43.623 1.00 0.00 H new ATOM 1259 N MET B -1 -15.464 19.725 -38.857 1.00 0.00 N ATOM 1260 CA MET B -1 -14.033 19.610 -39.147 1.00 0.00 C ATOM 1261 C MET B -1 -13.552 18.159 -38.996 1.00 0.00 C ATOM 1262 O MET B -1 -12.633 17.755 -39.707 1.00 0.00 O ATOM 1263 CB MET B -1 -13.212 20.544 -38.241 1.00 0.00 C ATOM 1264 CG MET B -1 -13.462 22.033 -38.518 1.00 0.00 C ATOM 1265 SD MET B -1 -12.971 22.594 -40.178 1.00 0.00 S ATOM 1266 CE MET B -1 -13.382 24.358 -40.047 1.00 0.00 C ATOM 0 H MET B -1 -15.675 20.242 -38.003 1.00 0.00 H new ATOM 0 HA MET B -1 -13.881 19.913 -40.183 1.00 0.00 H new ATOM 0 HB2 MET B -1 -13.451 20.330 -37.199 1.00 0.00 H new ATOM 0 HB3 MET B -1 -12.152 20.330 -38.375 1.00 0.00 H new ATOM 0 HG2 MET B -1 -14.523 22.241 -38.379 1.00 0.00 H new ATOM 0 HG3 MET B -1 -12.922 22.622 -37.776 1.00 0.00 H new ATOM 0 HE1 MET B -1 -13.142 24.858 -40.985 1.00 0.00 H new ATOM 0 HE2 MET B -1 -14.446 24.469 -39.838 1.00 0.00 H new ATOM 0 HE3 MET B -1 -12.805 24.807 -39.239 1.00 0.00 H new ATOM 1276 N ASP B 674 -14.173 17.389 -38.086 1.00 0.00 N ATOM 1277 CA ASP B 674 -13.990 15.936 -37.893 1.00 0.00 C ATOM 1278 C ASP B 674 -12.567 15.533 -37.468 1.00 0.00 C ATOM 1279 O ASP B 674 -12.205 14.356 -37.463 1.00 0.00 O ATOM 1280 CB ASP B 674 -14.460 15.200 -39.157 1.00 0.00 C ATOM 1281 CG ASP B 674 -14.643 13.687 -38.945 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -15.465 13.293 -38.079 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -14.040 12.887 -39.705 1.00 0.00 O ATOM 0 H ASP B 674 -14.850 17.780 -37.431 1.00 0.00 H new ATOM 0 HA ASP B 674 -14.608 15.633 -37.048 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -15.404 15.630 -39.490 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -13.736 15.364 -39.955 1.00 0.00 H new ATOM 1288 N GLU B 675 -11.763 16.522 -37.080 1.00 0.00 N ATOM 1289 CA GLU B 675 -10.328 16.390 -36.849 1.00 0.00 C ATOM 1290 C GLU B 675 -9.884 17.145 -35.582 1.00 0.00 C ATOM 1291 O GLU B 675 -8.701 17.167 -35.241 1.00 0.00 O ATOM 1292 CB GLU B 675 -9.674 16.921 -38.141 1.00 0.00 C ATOM 1293 CG GLU B 675 -8.144 16.882 -38.179 1.00 0.00 C ATOM 1294 CD GLU B 675 -7.598 17.084 -39.603 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -7.419 18.251 -40.031 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -7.323 16.073 -40.301 1.00 0.00 O ATOM 0 H GLU B 675 -12.106 17.468 -36.913 1.00 0.00 H new ATOM 0 HA GLU B 675 -10.026 15.360 -36.656 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -10.054 16.342 -38.983 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -9.996 17.951 -38.292 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -7.745 17.657 -37.524 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -7.796 15.925 -37.789 1.00 0.00 H new ATOM 1303 N LYS B 676 -10.821 17.755 -34.844 1.00 0.00 N ATOM 1304 CA LYS B 676 -10.544 18.690 -33.744 1.00 0.00 C ATOM 1305 C LYS B 676 -10.112 18.017 -32.431 1.00 0.00 C ATOM 1306 O LYS B 676 -10.396 18.527 -31.347 1.00 0.00 O ATOM 1307 CB LYS B 676 -11.753 19.638 -33.589 1.00 0.00 C ATOM 1308 CG LYS B 676 -11.834 20.676 -34.721 1.00 0.00 C ATOM 1309 CD LYS B 676 -11.180 22.029 -34.387 1.00 0.00 C ATOM 1310 CE LYS B 676 -9.692 21.919 -34.015 1.00 0.00 C ATOM 1311 NZ LYS B 676 -9.052 23.255 -33.865 1.00 0.00 N ATOM 0 H LYS B 676 -11.818 17.608 -34.999 1.00 0.00 H new ATOM 0 HA LYS B 676 -9.664 19.276 -34.007 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -12.671 19.051 -33.572 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -11.686 20.154 -32.631 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -11.357 20.265 -35.610 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -12.882 20.844 -34.970 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -11.283 22.694 -35.244 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -11.720 22.489 -33.559 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -9.592 21.363 -33.083 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -9.168 21.351 -34.783 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -8.050 23.134 -33.614 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -9.124 23.777 -34.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -9.535 23.789 -33.114 1.00 0.00 H new ATOM 1325 N ILE B 677 -9.435 16.875 -32.517 1.00 0.00 N ATOM 1326 CA ILE B 677 -8.774 16.261 -31.375 1.00 0.00 C ATOM 1327 C ILE B 677 -7.735 17.276 -30.873 1.00 0.00 C ATOM 1328 O ILE B 677 -7.054 17.920 -31.682 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.109 14.934 -31.796 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.189 13.961 -32.319 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.288 14.330 -30.634 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -8.625 12.662 -32.891 1.00 0.00 C ATOM 0 H ILE B 677 -9.331 16.350 -33.385 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.482 16.020 -30.582 1.00 0.00 H new ATOM 0 HB ILE B 677 -7.403 15.123 -32.605 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -9.873 13.721 -31.505 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -9.774 14.463 -33.090 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -6.831 13.395 -30.959 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.508 15.031 -30.336 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -7.945 14.137 -29.786 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -9.444 12.031 -33.237 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -7.963 12.890 -33.727 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -8.065 12.137 -32.117 1.00 0.00 H new ATOM 1344 N THR B 678 -7.566 17.390 -29.562 1.00 0.00 N ATOM 1345 CA THR B 678 -6.569 18.229 -28.939 1.00 0.00 C ATOM 1346 C THR B 678 -5.848 17.480 -27.817 1.00 0.00 C ATOM 1347 O THR B 678 -6.350 16.521 -27.225 1.00 0.00 O ATOM 1348 CB THR B 678 -7.256 19.546 -28.538 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.279 20.547 -28.311 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.190 19.459 -27.330 1.00 0.00 C ATOM 0 H THR B 678 -8.140 16.883 -28.889 1.00 0.00 H new ATOM 0 HA THR B 678 -5.761 18.490 -29.622 1.00 0.00 H new ATOM 0 HB THR B 678 -7.899 19.799 -29.381 1.00 0.00 H new ATOM 0 HG1 THR B 678 -6.721 21.384 -28.058 1.00 0.00 H new ATOM 0 HG21 THR B 678 -8.622 20.440 -27.132 1.00 0.00 H new ATOM 0 HG22 THR B 678 -8.988 18.747 -27.538 1.00 0.00 H new ATOM 0 HG23 THR B 678 -7.627 19.128 -26.458 1.00 0.00 H new ATOM 1358 N PHE B 679 -4.625 17.936 -27.552 1.00 0.00 N ATOM 1359 CA PHE B 679 -3.675 17.355 -26.618 1.00 0.00 C ATOM 1360 C PHE B 679 -3.270 18.472 -25.630 1.00 0.00 C ATOM 1361 O PHE B 679 -2.315 19.210 -25.886 1.00 0.00 O ATOM 1362 CB PHE B 679 -2.489 16.762 -27.392 1.00 0.00 C ATOM 1363 CG PHE B 679 -2.777 15.451 -28.102 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -2.756 14.234 -27.393 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.026 15.435 -29.488 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -2.975 13.013 -28.046 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.233 14.212 -30.153 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.189 13.001 -29.438 1.00 0.00 C ATOM 0 H PHE B 679 -4.254 18.768 -28.012 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.102 16.529 -26.049 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.155 17.492 -28.130 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -1.662 16.608 -26.698 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -2.568 14.242 -26.329 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.058 16.362 -30.041 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -2.980 12.089 -27.486 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -3.426 14.203 -31.216 1.00 0.00 H new ATOM 0 HZ PHE B 679 -3.319 12.063 -29.956 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.058 18.677 -24.553 1.00 0.00 N ATOM 1379 CA PRO B 680 -3.858 19.722 -23.546 1.00 0.00 C ATOM 1380 C PRO B 680 -2.694 19.380 -22.600 1.00 0.00 C ATOM 1381 O PRO B 680 -2.092 18.311 -22.688 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.187 19.746 -22.775 1.00 0.00 C ATOM 1383 CG PRO B 680 -5.542 18.263 -22.768 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.226 17.883 -24.209 1.00 0.00 C ATOM 0 HA PRO B 680 -3.603 20.682 -23.994 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.073 20.148 -21.768 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -5.944 20.350 -23.276 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -4.944 17.699 -22.052 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -6.588 18.090 -22.516 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.021 16.816 -24.301 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.064 18.105 -24.870 1.00 0.00 H new ATOM 1392 N SER B 681 -2.484 20.206 -21.574 1.00 0.00 N ATOM 1393 CA SER B 681 -1.584 19.973 -20.439 1.00 0.00 C ATOM 1394 C SER B 681 -2.005 18.779 -19.542 1.00 0.00 C ATOM 1395 O SER B 681 -1.571 18.693 -18.391 1.00 0.00 O ATOM 1396 CB SER B 681 -1.492 21.275 -19.623 1.00 0.00 C ATOM 1397 OG SER B 681 -1.286 22.400 -20.475 1.00 0.00 O ATOM 0 H SER B 681 -2.962 21.105 -21.507 1.00 0.00 H new ATOM 0 HA SER B 681 -0.607 19.695 -20.835 1.00 0.00 H new ATOM 0 HB2 SER B 681 -2.408 21.413 -19.048 1.00 0.00 H new ATOM 0 HB3 SER B 681 -0.674 21.202 -18.907 1.00 0.00 H new ATOM 0 HG SER B 681 -1.233 23.215 -19.933 1.00 0.00 H new ATOM 1403 N ASP B 682 -2.829 17.853 -20.053 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.236 16.621 -19.381 1.00 0.00 C ATOM 1405 C ASP B 682 -3.159 15.391 -20.294 1.00 0.00 C ATOM 1406 O ASP B 682 -3.160 14.271 -19.786 1.00 0.00 O ATOM 1407 CB ASP B 682 -4.661 16.734 -18.844 1.00 0.00 C ATOM 1408 CG ASP B 682 -4.787 17.636 -17.609 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -4.946 18.869 -17.763 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -4.805 17.121 -16.470 1.00 0.00 O ATOM 0 H ASP B 682 -3.243 17.950 -20.980 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.531 16.487 -18.561 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.307 17.121 -19.632 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.025 15.738 -18.594 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.108 15.553 -21.628 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.021 14.454 -22.580 1.00 0.00 C ATOM 1417 C ILE B 683 -2.098 14.893 -23.718 1.00 0.00 C ATOM 1418 O ILE B 683 -2.314 15.956 -24.279 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.434 14.026 -23.044 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.201 13.302 -21.912 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.350 13.083 -24.259 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -5.961 14.150 -20.907 1.00 0.00 C ATOM 0 H ILE B 683 -3.127 16.471 -22.073 1.00 0.00 H new ATOM 0 HA ILE B 683 -2.590 13.562 -22.125 1.00 0.00 H new ATOM 0 HB ILE B 683 -4.968 14.936 -23.319 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -5.911 12.617 -22.375 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -4.485 12.693 -21.360 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.355 12.796 -24.567 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -3.850 13.594 -25.082 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -3.785 12.191 -23.989 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.446 13.502 -20.177 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.267 14.817 -20.396 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.716 14.740 -21.426 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.094 14.083 -24.067 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.031 14.378 -25.033 1.00 0.00 C ATOM 1436 C ASP B 684 0.172 13.156 -25.945 1.00 0.00 C ATOM 1437 O ASP B 684 -0.004 12.031 -25.465 1.00 0.00 O ATOM 1438 CB ASP B 684 1.266 14.669 -24.273 1.00 0.00 C ATOM 1439 CG ASP B 684 2.463 14.888 -25.202 1.00 0.00 C ATOM 1440 OD1 ASP B 684 3.123 13.883 -25.548 1.00 0.00 O ATOM 1441 OD2 ASP B 684 2.744 16.056 -25.559 1.00 0.00 O ATOM 0 H ASP B 684 -0.996 13.153 -23.661 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.304 15.243 -25.637 1.00 0.00 H new ATOM 0 HB2 ASP B 684 1.127 15.554 -23.652 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.481 13.839 -23.600 1.00 0.00 H new ATOM 1446 N PRO B 685 0.518 13.318 -27.238 1.00 0.00 N ATOM 1447 CA PRO B 685 0.681 12.193 -28.143 1.00 0.00 C ATOM 1448 C PRO B 685 1.641 11.104 -27.648 1.00 0.00 C ATOM 1449 O PRO B 685 1.432 9.944 -27.987 1.00 0.00 O ATOM 1450 CB PRO B 685 1.165 12.783 -29.473 1.00 0.00 C ATOM 1451 CG PRO B 685 0.633 14.209 -29.446 1.00 0.00 C ATOM 1452 CD PRO B 685 0.713 14.567 -27.965 1.00 0.00 C ATOM 0 HA PRO B 685 -0.274 11.676 -28.233 1.00 0.00 H new ATOM 0 HB2 PRO B 685 2.252 12.762 -29.549 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.775 12.226 -30.325 1.00 0.00 H new ATOM 0 HG2 PRO B 685 1.237 14.879 -30.058 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -0.388 14.268 -29.823 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.678 15.013 -27.723 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.051 15.297 -27.698 1.00 0.00 H new ATOM 1460 N GLN B 686 2.688 11.420 -26.869 1.00 0.00 N ATOM 1461 CA GLN B 686 3.697 10.418 -26.551 1.00 0.00 C ATOM 1462 C GLN B 686 3.095 9.258 -25.750 1.00 0.00 C ATOM 1463 O GLN B 686 3.249 8.117 -26.193 1.00 0.00 O ATOM 1464 CB GLN B 686 4.997 11.032 -25.982 1.00 0.00 C ATOM 1465 CG GLN B 686 5.490 10.543 -24.602 1.00 0.00 C ATOM 1466 CD GLN B 686 4.827 11.171 -23.372 1.00 0.00 C ATOM 1467 OE1 GLN B 686 5.022 10.691 -22.261 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.025 12.217 -23.503 1.00 0.00 N ATOM 0 H GLN B 686 2.850 12.340 -26.460 1.00 0.00 H new ATOM 0 HA GLN B 686 4.036 9.964 -27.482 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.794 10.852 -26.704 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.858 12.111 -25.923 1.00 0.00 H new ATOM 0 HG2 GLN B 686 5.346 9.464 -24.552 1.00 0.00 H new ATOM 0 HG3 GLN B 686 6.563 10.725 -24.540 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.859 12.620 -24.425 1.00 0.00 H new ATOM 0 HE22 GLN B 686 3.573 12.619 -22.682 1.00 0.00 H new ATOM 1477 N VAL B 687 2.356 9.487 -24.651 1.00 0.00 N ATOM 1478 CA VAL B 687 1.719 8.392 -23.942 1.00 0.00 C ATOM 1479 C VAL B 687 0.752 7.684 -24.880 1.00 0.00 C ATOM 1480 O VAL B 687 0.631 6.470 -24.795 1.00 0.00 O ATOM 1481 CB VAL B 687 0.995 8.918 -22.700 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.635 7.764 -21.759 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.865 9.910 -21.929 1.00 0.00 C ATOM 0 H VAL B 687 2.193 10.410 -24.248 1.00 0.00 H new ATOM 0 HA VAL B 687 2.474 7.679 -23.611 1.00 0.00 H new ATOM 0 HB VAL B 687 0.091 9.420 -23.044 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.121 8.157 -20.882 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.017 7.062 -22.278 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.545 7.251 -21.447 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.323 10.265 -21.053 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.784 9.418 -21.612 1.00 0.00 H new ATOM 0 HG23 VAL B 687 2.109 10.756 -22.572 1.00 0.00 H new ATOM 1493 N PHE B 688 0.100 8.410 -25.790 1.00 0.00 N ATOM 1494 CA PHE B 688 -0.856 7.818 -26.703 1.00 0.00 C ATOM 1495 C PHE B 688 -0.200 6.824 -27.674 1.00 0.00 C ATOM 1496 O PHE B 688 -0.775 5.777 -27.984 1.00 0.00 O ATOM 1497 CB PHE B 688 -1.594 8.931 -27.448 1.00 0.00 C ATOM 1498 CG PHE B 688 -2.918 8.477 -27.994 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -3.946 8.146 -27.102 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.132 8.386 -29.379 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.203 7.743 -27.569 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -4.387 7.973 -29.858 1.00 0.00 C ATOM 1503 CZ PHE B 688 -5.413 7.641 -28.956 1.00 0.00 C ATOM 0 H PHE B 688 0.224 9.416 -25.908 1.00 0.00 H new ATOM 0 HA PHE B 688 -1.573 7.237 -26.123 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -1.752 9.773 -26.774 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -0.971 9.291 -28.267 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -3.766 8.202 -26.039 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -2.339 8.631 -30.070 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -5.999 7.514 -26.875 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -4.564 7.911 -30.922 1.00 0.00 H new ATOM 0 HZ PHE B 688 -6.369 7.305 -29.331 1.00 0.00 H new ATOM 1513 N TYR B 689 1.017 7.119 -28.137 1.00 0.00 N ATOM 1514 CA TYR B 689 1.796 6.208 -28.962 1.00 0.00 C ATOM 1515 C TYR B 689 2.375 5.051 -28.155 1.00 0.00 C ATOM 1516 O TYR B 689 2.677 3.998 -28.721 1.00 0.00 O ATOM 1517 CB TYR B 689 2.934 6.961 -29.653 1.00 0.00 C ATOM 1518 CG TYR B 689 2.475 8.031 -30.629 1.00 0.00 C ATOM 1519 CD1 TYR B 689 1.494 7.739 -31.596 1.00 0.00 C ATOM 1520 CD2 TYR B 689 3.047 9.311 -30.577 1.00 0.00 C ATOM 1521 CE1 TYR B 689 1.069 8.728 -32.495 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.645 10.305 -31.486 1.00 0.00 C ATOM 1523 CZ TYR B 689 1.641 10.022 -32.448 1.00 0.00 C ATOM 1524 OH TYR B 689 1.250 10.996 -33.317 1.00 0.00 O ATOM 0 H TYR B 689 1.488 8.003 -27.946 1.00 0.00 H new ATOM 0 HA TYR B 689 1.116 5.793 -29.706 1.00 0.00 H new ATOM 0 HB2 TYR B 689 3.561 7.425 -28.892 1.00 0.00 H new ATOM 0 HB3 TYR B 689 3.558 6.243 -30.186 1.00 0.00 H new ATOM 0 HD1 TYR B 689 1.067 6.748 -31.646 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.800 9.534 -29.835 1.00 0.00 H new ATOM 0 HE1 TYR B 689 0.305 8.502 -33.224 1.00 0.00 H new ATOM 0 HE2 TYR B 689 3.100 11.284 -31.452 1.00 0.00 H new ATOM 0 HH TYR B 689 1.751 11.818 -33.134 1.00 0.00 H new ATOM 1534 N GLU B 690 2.543 5.239 -26.848 1.00 0.00 N ATOM 1535 CA GLU B 690 3.282 4.319 -25.992 1.00 0.00 C ATOM 1536 C GLU B 690 2.362 3.317 -25.297 1.00 0.00 C ATOM 1537 O GLU B 690 2.759 2.170 -25.074 1.00 0.00 O ATOM 1538 CB GLU B 690 4.077 5.190 -24.996 1.00 0.00 C ATOM 1539 CG GLU B 690 4.290 4.588 -23.612 1.00 0.00 C ATOM 1540 CD GLU B 690 5.004 5.580 -22.683 1.00 0.00 C ATOM 1541 OE1 GLU B 690 4.311 6.422 -22.067 1.00 0.00 O ATOM 1542 OE2 GLU B 690 6.249 5.522 -22.540 1.00 0.00 O ATOM 0 H GLU B 690 2.165 6.044 -26.349 1.00 0.00 H new ATOM 0 HA GLU B 690 3.962 3.702 -26.579 1.00 0.00 H new ATOM 0 HB2 GLU B 690 5.052 5.408 -25.431 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.559 6.142 -24.882 1.00 0.00 H new ATOM 0 HG2 GLU B 690 3.328 4.309 -23.181 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.879 3.675 -23.696 1.00 0.00 H new ATOM 1549 N LEU B 691 1.141 3.734 -24.945 1.00 0.00 N ATOM 1550 CA LEU B 691 0.128 2.863 -24.380 1.00 0.00 C ATOM 1551 C LEU B 691 -0.250 1.776 -25.387 1.00 0.00 C ATOM 1552 O LEU B 691 0.102 1.850 -26.569 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.059 3.687 -23.835 1.00 0.00 C ATOM 1554 CG LEU B 691 -1.922 4.502 -24.819 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -2.730 3.658 -25.792 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -2.901 5.368 -24.013 1.00 0.00 C ATOM 0 H LEU B 691 0.833 4.701 -25.050 1.00 0.00 H new ATOM 0 HA LEU B 691 0.524 2.335 -23.513 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.721 3.000 -23.309 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -0.664 4.380 -23.093 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.228 5.094 -25.415 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.307 4.310 -26.447 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.055 3.047 -26.392 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.408 3.010 -25.236 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.519 5.951 -24.696 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -3.539 4.726 -23.405 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.341 6.042 -23.365 1.00 0.00 H new ATOM 1568 N ALA B 692 -0.982 0.767 -24.897 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.408 -0.392 -25.674 1.00 0.00 C ATOM 1570 C ALA B 692 -2.024 0.054 -26.996 1.00 0.00 C ATOM 1571 O ALA B 692 -2.979 0.827 -26.995 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.422 -1.192 -24.857 1.00 0.00 C ATOM 0 H ALA B 692 -1.299 0.738 -23.928 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.545 -1.019 -25.897 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -2.746 -2.061 -25.430 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -1.960 -1.523 -23.927 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.284 -0.564 -24.631 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.517 -0.452 -28.119 1.00 0.00 N ATOM 1579 CA GLU B 693 -1.959 -0.011 -29.439 1.00 0.00 C ATOM 1580 C GLU B 693 -3.456 -0.179 -29.596 1.00 0.00 C ATOM 1581 O GLU B 693 -4.119 0.702 -30.131 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.264 -0.820 -30.529 1.00 0.00 C ATOM 1583 CG GLU B 693 0.132 -0.242 -30.805 1.00 0.00 C ATOM 1584 CD GLU B 693 0.915 -1.122 -31.798 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.807 -0.897 -33.029 1.00 0.00 O ATOM 1586 OE2 GLU B 693 1.649 -2.036 -31.352 1.00 0.00 O ATOM 0 H GLU B 693 -0.795 -1.172 -28.139 1.00 0.00 H new ATOM 0 HA GLU B 693 -1.702 1.044 -29.535 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.180 -1.862 -30.222 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -1.860 -0.803 -31.441 1.00 0.00 H new ATOM 0 HG2 GLU B 693 0.038 0.767 -31.206 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.687 -0.163 -29.870 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.008 -1.276 -29.077 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.427 -1.530 -29.224 1.00 0.00 C ATOM 1595 C ALA B 694 -6.244 -0.423 -28.535 1.00 0.00 C ATOM 1596 O ALA B 694 -7.245 0.044 -29.075 1.00 0.00 O ATOM 1597 CB ALA B 694 -5.747 -2.909 -28.653 1.00 0.00 C ATOM 0 H ALA B 694 -3.496 -1.990 -28.559 1.00 0.00 H new ATOM 0 HA ALA B 694 -5.700 -1.520 -30.279 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -6.813 -3.108 -28.760 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.180 -3.667 -29.194 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.476 -2.938 -27.598 1.00 0.00 H new ATOM 1603 N VAL B 695 -5.777 0.051 -27.374 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.383 1.171 -26.660 1.00 0.00 C ATOM 1605 C VAL B 695 -6.210 2.449 -27.476 1.00 0.00 C ATOM 1606 O VAL B 695 -7.159 3.217 -27.559 1.00 0.00 O ATOM 1607 CB VAL B 695 -5.789 1.279 -25.240 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -5.957 2.655 -24.582 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.434 0.238 -24.321 1.00 0.00 C ATOM 0 H VAL B 695 -4.960 -0.338 -26.903 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.454 1.007 -26.539 1.00 0.00 H new ATOM 0 HB VAL B 695 -4.720 1.108 -25.367 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.511 2.640 -23.588 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.462 3.412 -25.190 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.018 2.892 -24.500 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.008 0.322 -23.321 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.509 0.411 -24.273 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.244 -0.761 -24.713 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.045 2.697 -28.082 1.00 0.00 N ATOM 1620 CA GLN B 696 -4.834 3.861 -28.935 1.00 0.00 C ATOM 1621 C GLN B 696 -5.845 3.843 -30.078 1.00 0.00 C ATOM 1622 O GLN B 696 -6.489 4.855 -30.307 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.380 3.857 -29.431 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.032 4.847 -30.544 1.00 0.00 C ATOM 1625 CD GLN B 696 -1.748 4.418 -31.247 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -1.731 4.135 -32.443 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -0.653 4.321 -30.510 1.00 0.00 N ATOM 0 H GLN B 696 -4.226 2.096 -27.993 1.00 0.00 H new ATOM 0 HA GLN B 696 -4.993 4.786 -28.381 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -2.729 4.059 -28.580 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.143 2.853 -29.782 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -3.849 4.899 -31.263 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -2.910 5.847 -30.127 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -0.683 4.559 -29.519 1.00 0.00 H new ATOM 0 HE22 GLN B 696 0.221 4.008 -30.933 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.026 2.719 -30.775 1.00 0.00 N ATOM 1637 CA LYS B 697 -6.976 2.631 -31.888 1.00 0.00 C ATOM 1638 C LYS B 697 -8.394 2.901 -31.395 1.00 0.00 C ATOM 1639 O LYS B 697 -9.101 3.718 -31.985 1.00 0.00 O ATOM 1640 CB LYS B 697 -6.898 1.242 -32.558 1.00 0.00 C ATOM 1641 CG LYS B 697 -5.532 0.930 -33.200 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.075 1.904 -34.300 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.049 2.063 -35.484 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.169 0.827 -36.312 1.00 0.00 N ATOM 0 H LYS B 697 -5.524 1.851 -30.587 1.00 0.00 H new ATOM 0 HA LYS B 697 -6.712 3.387 -32.628 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.121 0.478 -31.813 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -7.671 1.176 -33.324 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -4.776 0.917 -32.415 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -5.570 -0.074 -33.622 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -4.912 2.884 -33.851 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.113 1.566 -34.685 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.033 2.335 -35.103 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -5.713 2.885 -36.116 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -6.837 0.995 -37.092 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.237 0.578 -36.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -6.517 0.045 -35.721 1.00 0.00 H new ATOM 1658 N GLU B 698 -8.799 2.246 -30.311 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.147 2.397 -29.757 1.00 0.00 C ATOM 1660 C GLU B 698 -10.396 3.840 -29.302 1.00 0.00 C ATOM 1661 O GLU B 698 -11.461 4.398 -29.577 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.352 1.421 -28.588 1.00 0.00 C ATOM 1663 CG GLU B 698 -10.562 -0.034 -29.045 1.00 0.00 C ATOM 1664 CD GLU B 698 -11.925 -0.232 -29.732 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -12.945 -0.424 -29.028 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -11.985 -0.206 -30.986 1.00 0.00 O ATOM 0 H GLU B 698 -8.207 1.598 -29.791 1.00 0.00 H new ATOM 0 HA GLU B 698 -10.867 2.163 -30.541 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -9.486 1.467 -27.928 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -11.215 1.740 -28.003 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -9.765 -0.316 -29.733 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -10.490 -0.698 -28.184 1.00 0.00 H new ATOM 1673 N LEU B 699 -9.412 4.470 -28.647 1.00 0.00 N ATOM 1674 CA LEU B 699 -9.512 5.854 -28.197 1.00 0.00 C ATOM 1675 C LEU B 699 -9.542 6.784 -29.382 1.00 0.00 C ATOM 1676 O LEU B 699 -10.361 7.682 -29.404 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.310 6.259 -27.342 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.463 5.853 -25.879 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.083 5.833 -25.206 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.401 6.831 -25.132 1.00 0.00 C ATOM 0 H LEU B 699 -8.523 4.027 -28.416 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.427 5.927 -27.609 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.409 5.801 -27.749 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.174 7.339 -27.403 1.00 0.00 H new ATOM 0 HG LEU B 699 -8.905 4.857 -25.837 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.192 5.543 -24.161 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.440 5.116 -25.716 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -6.636 6.826 -25.262 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.495 6.522 -24.091 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -8.986 7.838 -25.175 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.384 6.823 -25.603 1.00 0.00 H new ATOM 1692 N LEU B 700 -8.667 6.589 -30.358 1.00 0.00 N ATOM 1693 CA LEU B 700 -8.575 7.441 -31.527 1.00 0.00 C ATOM 1694 C LEU B 700 -9.899 7.446 -32.275 1.00 0.00 C ATOM 1695 O LEU B 700 -10.366 8.505 -32.686 1.00 0.00 O ATOM 1696 CB LEU B 700 -7.436 6.909 -32.403 1.00 0.00 C ATOM 1697 CG LEU B 700 -7.220 7.677 -33.714 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -6.924 9.160 -33.449 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.041 7.036 -34.450 1.00 0.00 C ATOM 0 H LEU B 700 -7.993 5.823 -30.357 1.00 0.00 H new ATOM 0 HA LEU B 700 -8.364 8.472 -31.243 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -6.511 6.934 -31.827 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -7.636 5.864 -32.639 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.127 7.625 -34.316 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -6.776 9.677 -34.397 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -7.763 9.609 -32.918 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.022 9.248 -32.843 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -5.866 7.564 -35.387 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.148 7.096 -33.828 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.268 5.991 -34.660 1.00 0.00 H new ATOM 1711 N ALA B 701 -10.522 6.272 -32.403 1.00 0.00 N ATOM 1712 CA ALA B 701 -11.869 6.165 -32.921 1.00 0.00 C ATOM 1713 C ALA B 701 -12.819 6.994 -32.054 1.00 0.00 C ATOM 1714 O ALA B 701 -13.525 7.825 -32.612 1.00 0.00 O ATOM 1715 CB ALA B 701 -12.289 4.695 -33.009 1.00 0.00 C ATOM 0 H ALA B 701 -10.101 5.378 -32.149 1.00 0.00 H new ATOM 0 HA ALA B 701 -11.911 6.567 -33.933 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -13.304 4.629 -33.400 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -11.609 4.161 -33.673 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.253 4.246 -32.016 1.00 0.00 H new ATOM 1721 N GLU B 702 -12.789 6.851 -30.722 1.00 0.00 N ATOM 1722 CA GLU B 702 -13.590 7.632 -29.773 1.00 0.00 C ATOM 1723 C GLU B 702 -13.447 9.133 -30.060 1.00 0.00 C ATOM 1724 O GLU B 702 -14.426 9.833 -30.319 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.184 7.317 -28.317 1.00 0.00 C ATOM 1726 CG GLU B 702 -14.357 7.203 -27.337 1.00 0.00 C ATOM 1727 CD GLU B 702 -15.135 5.885 -27.473 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.019 5.796 -28.361 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -14.878 4.966 -26.655 1.00 0.00 O ATOM 0 H GLU B 702 -12.188 6.167 -30.262 1.00 0.00 H new ATOM 0 HA GLU B 702 -14.636 7.352 -29.899 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -12.625 6.381 -28.304 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -12.509 8.097 -27.965 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -13.980 7.291 -26.318 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.039 8.038 -27.498 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.214 9.627 -30.065 1.00 0.00 N ATOM 1737 CA TRP B 703 -11.849 11.023 -30.180 1.00 0.00 C ATOM 1738 C TRP B 703 -12.274 11.605 -31.543 1.00 0.00 C ATOM 1739 O TRP B 703 -12.549 12.801 -31.652 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.329 11.104 -29.940 1.00 0.00 C ATOM 1741 CG TRP B 703 -9.750 10.522 -28.667 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.399 10.027 -27.587 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.351 10.497 -28.273 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.519 9.715 -26.573 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.249 10.077 -26.920 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.165 10.890 -28.906 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.082 10.188 -26.168 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -5.968 11.006 -28.170 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -5.939 10.711 -26.790 1.00 0.00 C ATOM 0 H TRP B 703 -11.397 9.022 -29.984 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.371 11.631 -29.441 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -9.838 10.611 -30.779 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.046 12.156 -29.978 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.469 9.894 -27.528 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -9.779 9.276 -25.690 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.167 11.105 -29.964 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.058 9.879 -25.133 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.064 11.324 -28.667 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.041 10.887 -26.216 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.387 10.755 -32.571 1.00 0.00 N ATOM 1761 CA LYS B 704 -12.917 11.122 -33.886 1.00 0.00 C ATOM 1762 C LYS B 704 -14.438 11.026 -33.961 1.00 0.00 C ATOM 1763 O LYS B 704 -15.041 11.790 -34.714 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.337 10.210 -34.980 1.00 0.00 C ATOM 1765 CG LYS B 704 -10.887 10.538 -35.353 1.00 0.00 C ATOM 1766 CD LYS B 704 -10.457 9.660 -36.536 1.00 0.00 C ATOM 1767 CE LYS B 704 -9.040 10.032 -37.002 1.00 0.00 C ATOM 1768 NZ LYS B 704 -8.625 9.271 -38.211 1.00 0.00 N ATOM 0 H LYS B 704 -12.107 9.776 -32.509 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.622 12.159 -34.043 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -12.391 9.175 -34.643 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -12.958 10.288 -35.872 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -10.796 11.592 -35.616 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -10.232 10.365 -34.499 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -10.486 8.610 -36.245 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -11.160 9.782 -37.360 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -8.999 11.100 -37.216 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -8.333 9.841 -36.195 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -7.664 9.556 -38.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -8.638 8.252 -38.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -9.283 9.472 -38.991 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.087 10.110 -33.229 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.543 9.906 -33.380 1.00 0.00 C ATOM 1784 C ARG B 705 -17.308 10.970 -32.609 1.00 0.00 C ATOM 1785 O ARG B 705 -18.422 11.334 -32.983 1.00 0.00 O ATOM 1786 CB ARG B 705 -17.023 8.462 -33.102 1.00 0.00 C ATOM 1787 CG ARG B 705 -16.677 7.800 -31.759 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.420 8.268 -30.508 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.839 7.865 -30.528 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.362 6.736 -30.023 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -18.613 5.852 -29.364 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -20.660 6.491 -30.183 1.00 0.00 N ATOM 0 H ARG B 705 -14.641 9.507 -32.538 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.773 10.034 -34.438 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -18.108 8.453 -33.202 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.625 7.826 -33.893 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.845 6.728 -31.864 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -15.610 7.940 -31.584 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.937 7.854 -29.623 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -17.352 9.353 -30.430 1.00 0.00 H new ATOM 0 HE ARG B 705 -19.491 8.512 -30.972 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -17.616 6.025 -29.233 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -19.036 5.002 -28.991 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -21.247 7.157 -30.685 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -21.068 5.637 -29.804 1.00 0.00 H new ATOM 1806 N THR B 706 -16.697 11.476 -31.541 1.00 0.00 N ATOM 1807 CA THR B 706 -17.170 12.639 -30.818 1.00 0.00 C ATOM 1808 C THR B 706 -17.014 13.869 -31.724 1.00 0.00 C ATOM 1809 O THR B 706 -17.890 14.735 -31.773 1.00 0.00 O ATOM 1810 CB THR B 706 -16.341 12.754 -29.538 1.00 0.00 C ATOM 1811 OG1 THR B 706 -14.973 12.666 -29.884 1.00 0.00 O ATOM 1812 CG2 THR B 706 -16.624 11.590 -28.598 1.00 0.00 C ATOM 0 H THR B 706 -15.843 11.077 -31.151 1.00 0.00 H new ATOM 0 HA THR B 706 -18.222 12.559 -30.545 1.00 0.00 H new ATOM 0 HB THR B 706 -16.592 13.697 -29.052 1.00 0.00 H new ATOM 0 HG1 THR B 706 -14.699 11.725 -29.900 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.022 11.696 -27.696 1.00 0.00 H new ATOM 0 HG22 THR B 706 -17.681 11.587 -28.331 1.00 0.00 H new ATOM 0 HG23 THR B 706 -16.372 10.652 -29.094 1.00 0.00 H new ATOM 1820 N GLY B 707 -15.900 13.913 -32.468 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.637 14.867 -33.543 1.00 0.00 C ATOM 1822 C GLY B 707 -14.592 15.893 -33.118 1.00 0.00 C ATOM 1823 O GLY B 707 -13.722 16.272 -33.911 1.00 0.00 O ATOM 0 H GLY B 707 -15.131 13.258 -32.328 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.291 14.335 -34.429 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.561 15.376 -33.817 1.00 0.00 H new ATOM 1827 N SER B 708 -14.638 16.268 -31.837 1.00 0.00 N ATOM 1828 CA SER B 708 -13.741 17.223 -31.200 1.00 0.00 C ATOM 1829 C SER B 708 -13.268 16.682 -29.841 1.00 0.00 C ATOM 1830 O SER B 708 -12.929 17.468 -28.961 1.00 0.00 O ATOM 1831 CB SER B 708 -14.459 18.580 -31.069 1.00 0.00 C ATOM 1832 OG SER B 708 -15.067 18.981 -32.293 1.00 0.00 O ATOM 0 H SER B 708 -15.334 15.895 -31.191 1.00 0.00 H new ATOM 0 HA SER B 708 -12.851 17.369 -31.812 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.219 18.514 -30.291 1.00 0.00 H new ATOM 0 HB3 SER B 708 -13.744 19.340 -30.753 1.00 0.00 H new ATOM 0 HG SER B 708 -15.513 19.845 -32.169 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.316 15.348 -29.646 1.00 0.00 N ATOM 1839 CA ASP B 709 -12.958 14.622 -28.417 1.00 0.00 C ATOM 1840 C ASP B 709 -13.721 15.043 -27.143 1.00 0.00 C ATOM 1841 O ASP B 709 -13.402 14.581 -26.043 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.436 14.573 -28.225 1.00 0.00 C ATOM 1843 CG ASP B 709 -10.748 15.829 -27.617 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.213 16.436 -26.618 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -9.660 16.175 -28.131 1.00 0.00 O ATOM 0 H ASP B 709 -13.623 14.716 -30.385 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.311 13.603 -28.577 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.205 13.721 -27.586 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -10.981 14.377 -29.196 1.00 0.00 H new ATOM 1850 N PHE B 710 -14.798 15.825 -27.303 1.00 0.00 N ATOM 1851 CA PHE B 710 -15.563 16.538 -26.293 1.00 0.00 C ATOM 1852 C PHE B 710 -14.694 17.503 -25.475 1.00 0.00 C ATOM 1853 O PHE B 710 -14.850 18.722 -25.606 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.325 15.573 -25.381 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.385 14.693 -26.016 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.368 15.226 -26.875 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.422 13.328 -25.679 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.379 14.393 -27.388 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.434 12.501 -26.187 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.412 13.031 -27.043 1.00 0.00 C ATOM 0 H PHE B 710 -15.185 15.983 -28.234 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.295 17.144 -26.827 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -15.596 14.924 -24.896 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -16.802 16.159 -24.596 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -18.345 16.273 -27.139 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -16.667 12.915 -25.026 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.131 14.801 -28.048 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.461 11.455 -25.919 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.189 12.393 -27.436 1.00 0.00 H new ATOM 1870 N HIS B 711 -13.807 16.979 -24.623 1.00 0.00 N ATOM 1871 CA HIS B 711 -13.058 17.731 -23.626 1.00 0.00 C ATOM 1872 C HIS B 711 -11.992 16.842 -22.992 1.00 0.00 C ATOM 1873 O HIS B 711 -11.962 16.675 -21.771 1.00 0.00 O ATOM 1874 CB HIS B 711 -13.989 18.368 -22.570 1.00 0.00 C ATOM 1875 CG HIS B 711 -15.124 17.496 -22.065 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -16.477 17.844 -22.122 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -15.005 16.285 -21.439 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -17.141 16.834 -21.532 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -16.280 15.890 -21.105 1.00 0.00 N ATOM 0 H HIS B 711 -13.587 15.983 -24.613 1.00 0.00 H new ATOM 0 HA HIS B 711 -12.554 18.559 -24.125 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -13.383 18.670 -21.716 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.417 19.276 -22.994 1.00 0.00 H new ATOM 0 HD1 HIS B 711 -16.878 18.690 -22.528 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -14.090 15.745 -21.245 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.214 16.786 -21.417 1.00 0.00 H new ATOM 1887 N ILE B 712 -11.116 16.215 -23.778 1.00 0.00 N ATOM 1888 CA ILE B 712 -9.957 15.540 -23.216 1.00 0.00 C ATOM 1889 C ILE B 712 -9.187 16.546 -22.341 1.00 0.00 C ATOM 1890 O ILE B 712 -9.047 17.723 -22.670 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.121 14.854 -24.317 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -9.963 13.710 -24.908 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -7.821 14.243 -23.770 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.240 12.907 -25.978 1.00 0.00 C ATOM 0 H ILE B 712 -11.189 16.163 -24.794 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.256 14.717 -22.566 1.00 0.00 H new ATOM 0 HB ILE B 712 -8.858 15.608 -25.059 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.263 13.039 -24.103 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -10.876 14.126 -25.334 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.269 13.773 -24.584 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.210 15.027 -23.323 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.060 13.495 -23.014 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -9.896 12.119 -26.347 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -8.964 13.565 -26.802 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.341 12.461 -25.553 1.00 0.00 H new ATOM 1906 N GLY B 713 -8.761 16.057 -21.173 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.157 16.818 -20.077 1.00 0.00 C ATOM 1908 C GLY B 713 -9.198 17.346 -19.084 1.00 0.00 C ATOM 1909 O GLY B 713 -8.861 17.549 -17.921 1.00 0.00 O ATOM 0 H GLY B 713 -8.833 15.063 -20.955 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -7.445 16.184 -19.549 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.594 17.656 -20.488 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.455 17.497 -19.524 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.638 17.863 -18.740 1.00 0.00 C ATOM 1915 C HIS B 714 -11.385 19.008 -17.740 1.00 0.00 C ATOM 1916 O HIS B 714 -11.775 18.951 -16.570 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.265 16.600 -18.136 1.00 0.00 C ATOM 1918 CG HIS B 714 -13.677 16.787 -17.631 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -14.175 16.280 -16.427 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -14.683 17.445 -18.283 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -15.464 16.665 -16.380 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -15.795 17.359 -17.480 1.00 0.00 N ATOM 0 H HIS B 714 -10.686 17.356 -20.507 1.00 0.00 H new ATOM 0 HA HIS B 714 -12.380 18.298 -19.410 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -12.262 15.812 -18.889 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -11.639 16.256 -17.312 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.617 17.937 -19.242 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -16.140 16.445 -15.567 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.713 17.754 -17.685 1.00 0.00 H new ATOM 1930 N LYS B 715 -10.676 20.038 -18.214 1.00 0.00 N ATOM 1931 CA LYS B 715 -10.527 21.296 -17.487 1.00 0.00 C ATOM 1932 C LYS B 715 -11.910 21.950 -17.369 1.00 0.00 C ATOM 1933 O LYS B 715 -12.696 21.895 -18.348 1.00 0.00 O ATOM 1934 CB LYS B 715 -9.548 22.241 -18.201 1.00 0.00 C ATOM 1935 CG LYS B 715 -8.129 21.701 -18.473 1.00 0.00 C ATOM 1936 CD LYS B 715 -7.226 21.490 -17.246 1.00 0.00 C ATOM 1937 CE LYS B 715 -7.618 20.291 -16.363 1.00 0.00 C ATOM 1938 NZ LYS B 715 -6.462 19.771 -15.590 1.00 0.00 N ATOM 1939 OXT LYS B 715 -12.199 22.541 -16.305 1.00 0.00 O ATOM 0 H LYS B 715 -10.191 20.020 -19.111 1.00 0.00 H new ATOM 0 HA LYS B 715 -10.118 21.095 -16.497 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -9.990 22.529 -19.155 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -9.457 23.149 -17.605 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -8.221 20.749 -18.996 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -7.626 22.390 -19.152 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -6.199 21.355 -17.585 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -7.244 22.394 -16.638 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -8.409 20.590 -15.676 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -8.023 19.496 -16.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -6.751 18.924 -15.061 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -5.690 19.525 -16.243 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -6.134 20.499 -14.924 1.00 0.00 H new TER 1953 LYS B 715