USER MOD reduce.3.24.130724 H: found=0, std=0, add=1004, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1002 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0998 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.121 USER MOD Single : A 13 MET CE :methyl 150:sc= -1.73 (180deg=-3.68!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.25 X(o=-0.25,f=-0.02) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.177 K(o=-0.18,f=-1.4) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 88:sc= 0.28 USER MOD Single : A 43 HIS : no HD1:sc= -0.427 X(o=-0.43,f=-0.16) USER MOD Single : A 48 TYR OH : rot 30:sc= -2.09 USER MOD Single : A 49 GLN : amide:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 52 GLN : amide:sc= -1.86 K(o=-1.9,f=-7.1!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.14) USER MOD Single : A 58 GLN : amide:sc= -0.0829 X(o=-0.083,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.128 USER MOD Single : B 11 THR OG1 : rot 180:sc= -0.119 USER MOD Single : B 13 MET CE :methyl 146:sc= -1.77 (180deg=-3.63!) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 ASN : amide:sc= -0.17 X(o=-0.17,f=-0.033) USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 ASN : amide:sc= -0.184 K(o=-0.18,f=-1.4) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot 90:sc= 0.292 USER MOD Single : B 43 HIS : no HD1:sc= -0.349 X(o=-0.35,f=-0.18) USER MOD Single : B 48 TYR OH : rot 30:sc= -2.06 USER MOD Single : B 49 GLN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : B 52 GLN : amide:sc= -1.93 K(o=-1.9,f=-7.3!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 57 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : B 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 SER OG : rot 17:sc= 0.577 USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.282 -10.052 -5.846 1.00 0.00 N ATOM 2 CA MET A 1 -2.248 -10.309 -4.382 1.00 0.00 C ATOM 3 C MET A 1 -0.832 -10.628 -3.912 1.00 0.00 C ATOM 4 O MET A 1 -0.327 -11.728 -4.135 1.00 0.00 O ATOM 5 CB MET A 1 -3.184 -11.478 -4.071 1.00 0.00 C ATOM 6 CG MET A 1 -3.819 -11.397 -2.692 1.00 0.00 C ATOM 7 SD MET A 1 -5.515 -12.009 -2.672 1.00 0.00 S ATOM 8 CE MET A 1 -5.911 -11.853 -0.933 1.00 0.00 C ATOM 0 H1 MET A 1 -3.257 -9.838 -6.138 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.668 -9.244 -6.071 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.945 -10.895 -6.354 1.00 0.00 H new ATOM 0 HA MET A 1 -2.576 -9.414 -3.853 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.972 -11.512 -4.823 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.626 -12.411 -4.151 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.221 -11.973 -1.986 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.806 -10.362 -2.350 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.932 -12.194 -0.760 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.222 -12.461 -0.347 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.821 -10.809 -0.632 1.00 0.00 H new ATOM 20 N LEU A 2 -0.199 -9.660 -3.258 1.00 0.00 N ATOM 21 CA LEU A 2 1.158 -9.838 -2.754 1.00 0.00 C ATOM 22 C LEU A 2 1.210 -9.612 -1.246 1.00 0.00 C ATOM 23 O LEU A 2 0.945 -8.509 -0.767 1.00 0.00 O ATOM 24 CB LEU A 2 2.114 -8.872 -3.457 1.00 0.00 C ATOM 25 CG LEU A 2 1.980 -8.822 -4.980 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.872 -7.863 -5.386 1.00 0.00 C ATOM 27 CD2 LEU A 2 3.300 -8.415 -5.617 1.00 0.00 C ATOM 0 H LEU A 2 -0.604 -8.744 -3.064 1.00 0.00 H new ATOM 0 HA LEU A 2 1.467 -10.862 -2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 2 1.951 -7.870 -3.060 1.00 0.00 H new ATOM 0 HB3 LEU A 2 3.137 -9.151 -3.207 1.00 0.00 H new ATOM 0 HG LEU A 2 1.719 -9.818 -5.337 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.791 -7.840 -6.473 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -0.073 -8.197 -4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 2 1.103 -6.863 -5.018 1.00 0.00 H new ATOM 0 HD21 LEU A 2 3.187 -8.384 -6.701 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.590 -7.429 -5.254 1.00 0.00 H new ATOM 0 HD23 LEU A 2 4.070 -9.140 -5.353 1.00 0.00 H new ATOM 39 N ILE A 3 1.560 -10.656 -0.498 1.00 0.00 N ATOM 40 CA ILE A 3 1.650 -10.551 0.953 1.00 0.00 C ATOM 41 C ILE A 3 3.107 -10.454 1.400 1.00 0.00 C ATOM 42 O ILE A 3 3.841 -11.442 1.399 1.00 0.00 O ATOM 43 CB ILE A 3 0.956 -11.741 1.653 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.843 -11.487 3.158 1.00 0.00 C ATOM 45 CG2 ILE A 3 1.698 -13.042 1.382 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.423 -12.051 3.773 1.00 0.00 C ATOM 0 H ILE A 3 1.784 -11.578 -0.871 1.00 0.00 H new ATOM 0 HA ILE A 3 1.131 -9.639 1.246 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.049 -11.836 1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 3 1.707 -11.925 3.658 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.879 -10.413 3.341 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.189 -13.863 1.886 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.719 -13.232 0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 3 2.719 -12.964 1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.436 -11.834 4.841 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.292 -11.595 3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.452 -13.130 3.621 1.00 0.00 H new ATOM 58 N LEU A 4 3.511 -9.250 1.790 1.00 0.00 N ATOM 59 CA LEU A 4 4.872 -9.007 2.254 1.00 0.00 C ATOM 60 C LEU A 4 4.872 -8.368 3.639 1.00 0.00 C ATOM 61 O LEU A 4 4.264 -7.316 3.841 1.00 0.00 O ATOM 62 CB LEU A 4 5.621 -8.113 1.266 1.00 0.00 C ATOM 63 CG LEU A 4 7.143 -8.111 1.423 1.00 0.00 C ATOM 64 CD1 LEU A 4 7.772 -9.180 0.542 1.00 0.00 C ATOM 65 CD2 LEU A 4 7.712 -6.739 1.091 1.00 0.00 C ATOM 0 H LEU A 4 2.913 -8.424 1.794 1.00 0.00 H new ATOM 0 HA LEU A 4 5.381 -9.969 2.319 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.376 -8.431 0.253 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.258 -7.091 1.376 1.00 0.00 H new ATOM 0 HG LEU A 4 7.382 -8.339 2.462 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.855 -9.164 0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.388 -10.159 0.828 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.524 -8.984 -0.501 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.796 -6.756 1.208 1.00 0.00 H new ATOM 0 HD22 LEU A 4 7.462 -6.481 0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 4 7.286 -5.996 1.765 1.00 0.00 H new ATOM 77 N THR A 5 5.556 -8.993 4.591 1.00 0.00 N ATOM 78 CA THR A 5 5.624 -8.452 5.944 1.00 0.00 C ATOM 79 C THR A 5 6.152 -7.022 5.918 1.00 0.00 C ATOM 80 O THR A 5 7.057 -6.700 5.147 1.00 0.00 O ATOM 81 CB THR A 5 6.512 -9.327 6.832 1.00 0.00 C ATOM 82 OG1 THR A 5 6.762 -10.579 6.216 1.00 0.00 O ATOM 83 CG2 THR A 5 5.905 -9.596 8.191 1.00 0.00 C ATOM 0 H THR A 5 6.066 -9.865 4.454 1.00 0.00 H new ATOM 0 HA THR A 5 4.617 -8.447 6.361 1.00 0.00 H new ATOM 0 HB THR A 5 7.436 -8.765 6.965 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.333 -11.122 6.799 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.581 -10.221 8.774 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.745 -8.652 8.711 1.00 0.00 H new ATOM 0 HG23 THR A 5 4.951 -10.109 8.068 1.00 0.00 H new ATOM 91 N ARG A 6 5.579 -6.165 6.756 1.00 0.00 N ATOM 92 CA ARG A 6 5.995 -4.769 6.812 1.00 0.00 C ATOM 93 C ARG A 6 5.764 -4.174 8.197 1.00 0.00 C ATOM 94 O ARG A 6 4.770 -4.476 8.858 1.00 0.00 O ATOM 95 CB ARG A 6 5.236 -3.951 5.765 1.00 0.00 C ATOM 96 CG ARG A 6 5.935 -3.885 4.416 1.00 0.00 C ATOM 97 CD ARG A 6 4.957 -4.088 3.271 1.00 0.00 C ATOM 98 NE ARG A 6 3.880 -3.100 3.288 1.00 0.00 N ATOM 99 CZ ARG A 6 4.007 -1.857 2.829 1.00 0.00 C ATOM 100 NH1 ARG A 6 5.161 -1.445 2.317 1.00 0.00 N ATOM 101 NH2 ARG A 6 2.978 -1.022 2.882 1.00 0.00 N ATOM 0 H ARG A 6 4.829 -6.411 7.402 1.00 0.00 H new ATOM 0 HA ARG A 6 7.063 -4.731 6.599 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.244 -4.382 5.629 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.095 -2.938 6.141 1.00 0.00 H new ATOM 0 HG2 ARG A 6 6.428 -2.919 4.308 1.00 0.00 H new ATOM 0 HG3 ARG A 6 6.713 -4.647 4.371 1.00 0.00 H new ATOM 0 HD2 ARG A 6 5.491 -4.026 2.323 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.531 -5.089 3.332 1.00 0.00 H new ATOM 0 HE ARG A 6 2.978 -3.379 3.674 1.00 0.00 H new ATOM 0 HH11 ARG A 6 5.956 -2.082 2.274 1.00 0.00 H new ATOM 0 HH12 ARG A 6 5.252 -0.491 1.967 1.00 0.00 H new ATOM 0 HH21 ARG A 6 2.089 -1.332 3.275 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.075 -0.070 2.530 1.00 0.00 H new ATOM 115 N ARG A 7 6.692 -3.316 8.616 1.00 0.00 N ATOM 116 CA ARG A 7 6.612 -2.648 9.918 1.00 0.00 C ATOM 117 C ARG A 7 7.886 -1.853 10.229 1.00 0.00 C ATOM 118 O ARG A 7 7.982 -1.220 11.280 1.00 0.00 O ATOM 119 CB ARG A 7 6.363 -3.660 11.039 1.00 0.00 C ATOM 120 CG ARG A 7 6.052 -3.009 12.379 1.00 0.00 C ATOM 121 CD ARG A 7 7.045 -3.426 13.454 1.00 0.00 C ATOM 122 NE ARG A 7 7.966 -2.345 13.797 1.00 0.00 N ATOM 123 CZ ARG A 7 8.654 -2.290 14.935 1.00 0.00 C ATOM 124 NH1 ARG A 7 8.531 -3.252 15.841 1.00 0.00 N ATOM 125 NH2 ARG A 7 9.469 -1.270 15.168 1.00 0.00 N ATOM 0 H ARG A 7 7.515 -3.064 8.069 1.00 0.00 H new ATOM 0 HA ARG A 7 5.774 -1.954 9.864 1.00 0.00 H new ATOM 0 HB2 ARG A 7 5.533 -4.308 10.756 1.00 0.00 H new ATOM 0 HB3 ARG A 7 7.242 -4.296 11.147 1.00 0.00 H new ATOM 0 HG2 ARG A 7 6.069 -1.925 12.269 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.044 -3.282 12.690 1.00 0.00 H new ATOM 0 HD2 ARG A 7 6.503 -3.738 14.347 1.00 0.00 H new ATOM 0 HD3 ARG A 7 7.613 -4.290 13.108 1.00 0.00 H new ATOM 0 HE ARG A 7 8.089 -1.588 13.125 1.00 0.00 H new ATOM 0 HH11 ARG A 7 7.906 -4.039 15.667 1.00 0.00 H new ATOM 0 HH12 ARG A 7 9.061 -3.204 16.711 1.00 0.00 H new ATOM 0 HH21 ARG A 7 9.568 -0.528 14.475 1.00 0.00 H new ATOM 0 HH22 ARG A 7 9.996 -1.227 16.040 1.00 0.00 H new ATOM 139 N VAL A 8 8.859 -1.883 9.318 1.00 0.00 N ATOM 140 CA VAL A 8 10.111 -1.163 9.513 1.00 0.00 C ATOM 141 C VAL A 8 10.688 -0.702 8.179 1.00 0.00 C ATOM 142 O VAL A 8 11.036 -1.519 7.327 1.00 0.00 O ATOM 143 CB VAL A 8 11.156 -2.035 10.235 1.00 0.00 C ATOM 144 CG1 VAL A 8 12.361 -1.200 10.639 1.00 0.00 C ATOM 145 CG2 VAL A 8 10.539 -2.716 11.447 1.00 0.00 C ATOM 0 H VAL A 8 8.801 -2.398 8.440 1.00 0.00 H new ATOM 0 HA VAL A 8 9.885 -0.295 10.132 1.00 0.00 H new ATOM 0 HB VAL A 8 11.494 -2.809 9.546 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.088 -1.833 11.148 1.00 0.00 H new ATOM 0 HG12 VAL A 8 12.817 -0.765 9.750 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.042 -0.402 11.310 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.292 -3.327 11.944 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.170 -1.960 12.140 1.00 0.00 H new ATOM 0 HG23 VAL A 8 9.712 -3.349 11.127 1.00 0.00 H new ATOM 155 N GLY A 9 10.786 0.612 8.004 1.00 0.00 N ATOM 156 CA GLY A 9 11.323 1.160 6.771 1.00 0.00 C ATOM 157 C GLY A 9 10.597 0.652 5.539 1.00 0.00 C ATOM 158 O GLY A 9 11.190 -0.022 4.695 1.00 0.00 O ATOM 0 H GLY A 9 10.503 1.308 8.694 1.00 0.00 H new ATOM 0 HA2 GLY A 9 11.258 2.248 6.803 1.00 0.00 H new ATOM 0 HA3 GLY A 9 12.380 0.906 6.695 1.00 0.00 H new ATOM 162 N GLU A 10 9.313 0.977 5.433 1.00 0.00 N ATOM 163 CA GLU A 10 8.506 0.551 4.294 1.00 0.00 C ATOM 164 C GLU A 10 8.227 1.725 3.361 1.00 0.00 C ATOM 165 O GLU A 10 8.552 2.868 3.680 1.00 0.00 O ATOM 166 CB GLU A 10 7.187 -0.058 4.774 1.00 0.00 C ATOM 167 CG GLU A 10 7.343 -0.991 5.964 1.00 0.00 C ATOM 168 CD GLU A 10 8.312 -2.125 5.693 1.00 0.00 C ATOM 169 OE1 GLU A 10 8.582 -2.406 4.506 1.00 0.00 O ATOM 170 OE2 GLU A 10 8.802 -2.733 6.668 1.00 0.00 O ATOM 0 H GLU A 10 8.808 1.534 6.122 1.00 0.00 H new ATOM 0 HA GLU A 10 9.067 -0.205 3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.502 0.746 5.041 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.729 -0.607 3.951 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.689 -0.420 6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.369 -1.405 6.226 1.00 0.00 H new ATOM 177 N THR A 11 7.616 1.435 2.212 1.00 0.00 N ATOM 178 CA THR A 11 7.282 2.470 1.230 1.00 0.00 C ATOM 179 C THR A 11 6.949 1.860 -0.127 1.00 0.00 C ATOM 180 O THR A 11 7.842 1.498 -0.893 1.00 0.00 O ATOM 181 CB THR A 11 8.436 3.469 1.071 1.00 0.00 C ATOM 182 OG1 THR A 11 8.291 4.219 -0.122 1.00 0.00 O ATOM 183 CG2 THR A 11 9.799 2.811 1.035 1.00 0.00 C ATOM 0 H THR A 11 7.342 0.492 1.937 1.00 0.00 H new ATOM 0 HA THR A 11 6.403 2.996 1.603 1.00 0.00 H new ATOM 0 HB THR A 11 8.383 4.111 1.951 1.00 0.00 H new ATOM 0 HG1 THR A 11 9.036 4.851 -0.204 1.00 0.00 H new ATOM 0 HG21 THR A 11 10.569 3.574 0.921 1.00 0.00 H new ATOM 0 HG22 THR A 11 9.964 2.265 1.964 1.00 0.00 H new ATOM 0 HG23 THR A 11 9.847 2.119 0.194 1.00 0.00 H new ATOM 191 N LEU A 12 5.658 1.769 -0.424 1.00 0.00 N ATOM 192 CA LEU A 12 5.204 1.225 -1.697 1.00 0.00 C ATOM 193 C LEU A 12 4.635 2.345 -2.564 1.00 0.00 C ATOM 194 O LEU A 12 4.174 3.361 -2.044 1.00 0.00 O ATOM 195 CB LEU A 12 4.164 0.112 -1.467 1.00 0.00 C ATOM 196 CG LEU A 12 2.699 0.479 -1.753 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.032 -0.598 -2.596 1.00 0.00 C ATOM 198 CD2 LEU A 12 1.934 0.689 -0.456 1.00 0.00 C ATOM 0 H LEU A 12 4.907 2.065 0.200 1.00 0.00 H new ATOM 0 HA LEU A 12 6.051 0.782 -2.221 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.431 -0.740 -2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.238 -0.217 -0.430 1.00 0.00 H new ATOM 0 HG LEU A 12 2.686 1.414 -2.314 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.996 -0.320 -2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.562 -0.699 -3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.060 -1.548 -2.062 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.899 0.948 -0.682 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.958 -0.228 0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.395 1.498 0.111 1.00 0.00 H new ATOM 210 N MET A 13 4.667 2.166 -3.881 1.00 0.00 N ATOM 211 CA MET A 13 4.149 3.183 -4.783 1.00 0.00 C ATOM 212 C MET A 13 3.223 2.575 -5.830 1.00 0.00 C ATOM 213 O MET A 13 3.677 2.010 -6.824 1.00 0.00 O ATOM 214 CB MET A 13 5.301 3.918 -5.471 1.00 0.00 C ATOM 215 CG MET A 13 4.847 5.059 -6.367 1.00 0.00 C ATOM 216 SD MET A 13 5.687 5.070 -7.963 1.00 0.00 S ATOM 217 CE MET A 13 5.706 6.824 -8.323 1.00 0.00 C ATOM 0 H MET A 13 5.042 1.336 -4.341 1.00 0.00 H new ATOM 0 HA MET A 13 3.573 3.893 -4.189 1.00 0.00 H new ATOM 0 HB2 MET A 13 5.976 4.311 -4.710 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.872 3.205 -6.066 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.772 4.983 -6.528 1.00 0.00 H new ATOM 0 HG3 MET A 13 5.027 6.007 -5.860 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.583 7.062 -8.925 1.00 0.00 H new ATOM 0 HE2 MET A 13 4.804 7.092 -8.873 1.00 0.00 H new ATOM 0 HE3 MET A 13 5.743 7.387 -7.390 1.00 0.00 H new ATOM 227 N ILE A 14 1.922 2.702 -5.599 1.00 0.00 N ATOM 228 CA ILE A 14 0.928 2.172 -6.520 1.00 0.00 C ATOM 229 C ILE A 14 0.048 3.293 -7.067 1.00 0.00 C ATOM 230 O ILE A 14 -0.690 3.935 -6.320 1.00 0.00 O ATOM 231 CB ILE A 14 0.040 1.108 -5.841 1.00 0.00 C ATOM 232 CG1 ILE A 14 -0.950 0.516 -6.846 1.00 0.00 C ATOM 233 CG2 ILE A 14 -0.697 1.706 -4.651 1.00 0.00 C ATOM 234 CD1 ILE A 14 -0.282 -0.098 -8.055 1.00 0.00 C ATOM 0 H ILE A 14 1.532 3.168 -4.780 1.00 0.00 H new ATOM 0 HA ILE A 14 1.467 1.701 -7.342 1.00 0.00 H new ATOM 0 HB ILE A 14 0.682 0.305 -5.477 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.552 -0.244 -6.348 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.633 1.298 -7.176 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.318 0.941 -4.185 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.026 2.078 -3.925 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.328 2.528 -4.989 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.042 -0.499 -8.726 1.00 0.00 H new ATOM 0 HD12 ILE A 14 0.298 0.664 -8.576 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.380 -0.902 -7.735 1.00 0.00 H new ATOM 246 N GLY A 15 0.129 3.525 -8.375 1.00 0.00 N ATOM 247 CA GLY A 15 -0.662 4.571 -8.999 1.00 0.00 C ATOM 248 C GLY A 15 0.126 5.323 -10.055 1.00 0.00 C ATOM 249 O GLY A 15 0.385 4.797 -11.139 1.00 0.00 O ATOM 0 H GLY A 15 0.730 3.005 -9.015 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -1.550 4.132 -9.453 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.006 5.270 -8.236 1.00 0.00 H new ATOM 253 N ASP A 16 0.514 6.554 -9.738 1.00 0.00 N ATOM 254 CA ASP A 16 1.284 7.375 -10.667 1.00 0.00 C ATOM 255 C ASP A 16 2.196 8.359 -9.929 1.00 0.00 C ATOM 256 O ASP A 16 2.800 9.231 -10.553 1.00 0.00 O ATOM 257 CB ASP A 16 0.344 8.140 -11.600 1.00 0.00 C ATOM 258 CG ASP A 16 1.063 8.707 -12.808 1.00 0.00 C ATOM 259 OD1 ASP A 16 1.551 9.854 -12.724 1.00 0.00 O ATOM 260 OD2 ASP A 16 1.138 8.005 -13.838 1.00 0.00 O ATOM 0 H ASP A 16 0.309 7.005 -8.846 1.00 0.00 H new ATOM 0 HA ASP A 16 1.914 6.706 -11.253 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -0.452 7.475 -11.934 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.129 8.952 -11.048 1.00 0.00 H new ATOM 265 N GLU A 17 2.293 8.208 -8.603 1.00 0.00 N ATOM 266 CA GLU A 17 3.128 9.073 -7.763 1.00 0.00 C ATOM 267 C GLU A 17 2.600 9.072 -6.331 1.00 0.00 C ATOM 268 O GLU A 17 2.133 10.095 -5.829 1.00 0.00 O ATOM 269 CB GLU A 17 3.163 10.512 -8.300 1.00 0.00 C ATOM 270 CG GLU A 17 4.429 10.840 -9.076 1.00 0.00 C ATOM 271 CD GLU A 17 4.258 12.038 -9.989 1.00 0.00 C ATOM 272 OE1 GLU A 17 3.391 11.982 -10.886 1.00 0.00 O ATOM 273 OE2 GLU A 17 4.991 13.033 -9.807 1.00 0.00 O ATOM 0 H GLU A 17 1.796 7.484 -8.084 1.00 0.00 H new ATOM 0 HA GLU A 17 4.144 8.679 -7.781 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.299 10.671 -8.945 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.069 11.205 -7.464 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.241 11.035 -8.375 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.722 9.974 -9.670 1.00 0.00 H new ATOM 280 N VAL A 18 2.658 7.914 -5.681 1.00 0.00 N ATOM 281 CA VAL A 18 2.172 7.780 -4.325 1.00 0.00 C ATOM 282 C VAL A 18 3.139 6.990 -3.451 1.00 0.00 C ATOM 283 O VAL A 18 3.587 5.910 -3.826 1.00 0.00 O ATOM 284 CB VAL A 18 0.818 7.064 -4.312 1.00 0.00 C ATOM 285 CG1 VAL A 18 -0.265 7.943 -4.918 1.00 0.00 C ATOM 286 CG2 VAL A 18 0.911 5.732 -5.043 1.00 0.00 C ATOM 0 H VAL A 18 3.039 7.056 -6.079 1.00 0.00 H new ATOM 0 HA VAL A 18 2.074 8.789 -3.924 1.00 0.00 H new ATOM 0 HB VAL A 18 0.546 6.865 -3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.217 7.413 -4.898 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.350 8.865 -4.342 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.005 8.182 -5.949 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.060 5.238 -5.023 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.210 5.904 -6.077 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.650 5.099 -4.553 1.00 0.00 H new ATOM 296 N THR A 19 3.442 7.527 -2.278 1.00 0.00 N ATOM 297 CA THR A 19 4.338 6.860 -1.342 1.00 0.00 C ATOM 298 C THR A 19 3.580 6.500 -0.068 1.00 0.00 C ATOM 299 O THR A 19 3.087 7.378 0.637 1.00 0.00 O ATOM 300 CB THR A 19 5.532 7.755 -1.010 1.00 0.00 C ATOM 301 OG1 THR A 19 6.141 8.238 -2.193 1.00 0.00 O ATOM 302 CG2 THR A 19 6.599 7.052 -0.198 1.00 0.00 C ATOM 0 H THR A 19 3.081 8.423 -1.951 1.00 0.00 H new ATOM 0 HA THR A 19 4.712 5.947 -1.806 1.00 0.00 H new ATOM 0 HB THR A 19 5.124 8.572 -0.415 1.00 0.00 H new ATOM 0 HG1 THR A 19 6.902 8.810 -1.959 1.00 0.00 H new ATOM 0 HG21 THR A 19 7.418 7.743 0.003 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.172 6.711 0.745 1.00 0.00 H new ATOM 0 HG23 THR A 19 6.976 6.196 -0.757 1.00 0.00 H new ATOM 310 N VAL A 20 3.475 5.206 0.216 1.00 0.00 N ATOM 311 CA VAL A 20 2.756 4.746 1.400 1.00 0.00 C ATOM 312 C VAL A 20 3.704 4.198 2.460 1.00 0.00 C ATOM 313 O VAL A 20 4.301 3.134 2.284 1.00 0.00 O ATOM 314 CB VAL A 20 1.729 3.652 1.051 1.00 0.00 C ATOM 315 CG1 VAL A 20 0.752 3.449 2.199 1.00 0.00 C ATOM 316 CG2 VAL A 20 0.989 3.993 -0.232 1.00 0.00 C ATOM 0 H VAL A 20 3.876 4.461 -0.353 1.00 0.00 H new ATOM 0 HA VAL A 20 2.238 5.619 1.796 1.00 0.00 H new ATOM 0 HB VAL A 20 2.268 2.718 0.891 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.035 2.673 1.933 1.00 0.00 H new ATOM 0 HG12 VAL A 20 1.298 3.148 3.093 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.222 4.381 2.395 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.270 3.206 -0.457 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.464 4.940 -0.108 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.702 4.078 -1.052 1.00 0.00 H new ATOM 326 N THR A 21 3.823 4.923 3.567 1.00 0.00 N ATOM 327 CA THR A 21 4.682 4.505 4.668 1.00 0.00 C ATOM 328 C THR A 21 3.844 3.906 5.793 1.00 0.00 C ATOM 329 O THR A 21 3.176 4.627 6.535 1.00 0.00 O ATOM 330 CB THR A 21 5.493 5.691 5.193 1.00 0.00 C ATOM 331 OG1 THR A 21 6.095 5.376 6.436 1.00 0.00 O ATOM 332 CG2 THR A 21 4.665 6.943 5.387 1.00 0.00 C ATOM 0 H THR A 21 3.334 5.804 3.725 1.00 0.00 H new ATOM 0 HA THR A 21 5.372 3.746 4.299 1.00 0.00 H new ATOM 0 HB THR A 21 6.245 5.888 4.429 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.610 6.146 6.754 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.301 7.745 5.761 1.00 0.00 H new ATOM 0 HG22 THR A 21 4.227 7.241 4.434 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.870 6.746 6.106 1.00 0.00 H new ATOM 340 N VAL A 22 3.876 2.583 5.908 1.00 0.00 N ATOM 341 CA VAL A 22 3.112 1.884 6.935 1.00 0.00 C ATOM 342 C VAL A 22 3.833 1.919 8.281 1.00 0.00 C ATOM 343 O VAL A 22 4.344 0.902 8.752 1.00 0.00 O ATOM 344 CB VAL A 22 2.843 0.421 6.523 1.00 0.00 C ATOM 345 CG1 VAL A 22 4.146 -0.286 6.187 1.00 0.00 C ATOM 346 CG2 VAL A 22 2.082 -0.328 7.611 1.00 0.00 C ATOM 0 H VAL A 22 4.424 1.972 5.302 1.00 0.00 H new ATOM 0 HA VAL A 22 2.158 2.401 7.039 1.00 0.00 H new ATOM 0 HB VAL A 22 2.218 0.431 5.630 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.937 -1.316 5.899 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.637 0.229 5.362 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.799 -0.279 7.059 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.908 -1.355 7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.668 -0.328 8.530 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.126 0.163 7.790 1.00 0.00 H new ATOM 356 N LEU A 23 3.865 3.098 8.893 1.00 0.00 N ATOM 357 CA LEU A 23 4.517 3.276 10.186 1.00 0.00 C ATOM 358 C LEU A 23 3.510 3.081 11.328 1.00 0.00 C ATOM 359 O LEU A 23 2.625 2.231 11.235 1.00 0.00 O ATOM 360 CB LEU A 23 5.166 4.667 10.250 1.00 0.00 C ATOM 361 CG LEU A 23 6.330 4.835 11.245 1.00 0.00 C ATOM 362 CD1 LEU A 23 6.711 3.510 11.897 1.00 0.00 C ATOM 363 CD2 LEU A 23 7.537 5.451 10.552 1.00 0.00 C ATOM 0 H LEU A 23 3.446 3.947 8.513 1.00 0.00 H new ATOM 0 HA LEU A 23 5.297 2.524 10.301 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.529 4.921 9.254 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.393 5.393 10.502 1.00 0.00 H new ATOM 0 HG LEU A 23 5.993 5.507 12.035 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.535 3.670 12.592 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.853 3.111 12.438 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.017 2.801 11.128 1.00 0.00 H new ATOM 0 HD21 LEU A 23 8.350 5.563 11.269 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.858 4.803 9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.268 6.429 10.153 1.00 0.00 H new ATOM 375 N GLY A 24 3.642 3.863 12.403 1.00 0.00 N ATOM 376 CA GLY A 24 2.730 3.746 13.528 1.00 0.00 C ATOM 377 C GLY A 24 2.608 2.324 14.040 1.00 0.00 C ATOM 378 O GLY A 24 1.653 1.620 13.710 1.00 0.00 O ATOM 0 H GLY A 24 4.365 4.574 12.512 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.074 4.390 14.337 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.745 4.106 13.230 1.00 0.00 H new ATOM 382 N VAL A 25 3.573 1.899 14.851 1.00 0.00 N ATOM 383 CA VAL A 25 3.562 0.558 15.405 1.00 0.00 C ATOM 384 C VAL A 25 3.289 0.580 16.906 1.00 0.00 C ATOM 385 O VAL A 25 4.139 0.990 17.696 1.00 0.00 O ATOM 386 CB VAL A 25 4.896 -0.169 15.147 1.00 0.00 C ATOM 387 CG1 VAL A 25 4.776 -1.646 15.492 1.00 0.00 C ATOM 388 CG2 VAL A 25 5.336 0.014 13.702 1.00 0.00 C ATOM 0 H VAL A 25 4.370 2.468 15.136 1.00 0.00 H new ATOM 0 HA VAL A 25 2.759 0.018 14.903 1.00 0.00 H new ATOM 0 HB VAL A 25 5.657 0.271 15.792 1.00 0.00 H new ATOM 0 HG11 VAL A 25 5.728 -2.142 15.303 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.513 -1.754 16.544 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.001 -2.102 14.876 1.00 0.00 H new ATOM 0 HG21 VAL A 25 6.280 -0.507 13.540 1.00 0.00 H new ATOM 0 HG22 VAL A 25 4.577 -0.396 13.036 1.00 0.00 H new ATOM 0 HG23 VAL A 25 5.467 1.076 13.493 1.00 0.00 H new ATOM 398 N LYS A 26 2.095 0.141 17.289 1.00 0.00 N ATOM 399 CA LYS A 26 1.709 0.115 18.696 1.00 0.00 C ATOM 400 C LYS A 26 0.445 -0.710 18.917 1.00 0.00 C ATOM 401 O LYS A 26 -0.531 -0.585 18.177 1.00 0.00 O ATOM 402 CB LYS A 26 1.497 1.541 19.209 1.00 0.00 C ATOM 403 CG LYS A 26 2.111 1.792 20.577 1.00 0.00 C ATOM 404 CD LYS A 26 1.880 3.222 21.037 1.00 0.00 C ATOM 405 CE LYS A 26 2.509 4.224 20.082 1.00 0.00 C ATOM 406 NZ LYS A 26 3.102 5.383 20.805 1.00 0.00 N ATOM 0 H LYS A 26 1.379 -0.201 16.648 1.00 0.00 H new ATOM 0 HA LYS A 26 2.518 -0.356 19.254 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.925 2.243 18.493 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.428 1.746 19.257 1.00 0.00 H new ATOM 0 HG2 LYS A 26 1.681 1.101 21.302 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.181 1.589 20.539 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.809 3.412 21.112 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.299 3.356 22.034 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.282 3.729 19.494 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.754 4.581 19.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 3.521 6.043 20.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.360 5.871 21.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.840 5.046 21.455 1.00 0.00 H new ATOM 420 N GLY A 27 0.473 -1.548 19.950 1.00 0.00 N ATOM 421 CA GLY A 27 -0.672 -2.382 20.268 1.00 0.00 C ATOM 422 C GLY A 27 -1.100 -3.257 19.108 1.00 0.00 C ATOM 423 O GLY A 27 -0.290 -3.603 18.248 1.00 0.00 O ATOM 0 H GLY A 27 1.271 -1.664 20.574 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -0.430 -3.013 21.123 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.507 -1.747 20.566 1.00 0.00 H new ATOM 427 N ASN A 28 -2.380 -3.615 19.084 1.00 0.00 N ATOM 428 CA ASN A 28 -2.919 -4.456 18.022 1.00 0.00 C ATOM 429 C ASN A 28 -3.101 -3.655 16.738 1.00 0.00 C ATOM 430 O ASN A 28 -2.620 -4.050 15.675 1.00 0.00 O ATOM 431 CB ASN A 28 -4.255 -5.065 18.453 1.00 0.00 C ATOM 432 CG ASN A 28 -4.097 -6.465 19.012 1.00 0.00 C ATOM 433 OD1 ASN A 28 -4.505 -6.746 20.139 1.00 0.00 O ATOM 434 ND2 ASN A 28 -3.501 -7.352 18.224 1.00 0.00 N ATOM 0 H ASN A 28 -3.063 -3.336 19.788 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.208 -5.260 17.831 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -4.717 -4.426 19.206 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -4.932 -5.092 17.599 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -3.366 -8.310 18.546 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -3.179 -7.075 17.297 1.00 0.00 H new ATOM 441 N GLN A 29 -3.800 -2.529 16.842 1.00 0.00 N ATOM 442 CA GLN A 29 -4.046 -1.675 15.687 1.00 0.00 C ATOM 443 C GLN A 29 -2.880 -0.719 15.456 1.00 0.00 C ATOM 444 O GLN A 29 -2.600 0.149 16.283 1.00 0.00 O ATOM 445 CB GLN A 29 -5.342 -0.883 15.879 1.00 0.00 C ATOM 446 CG GLN A 29 -6.586 -1.755 15.922 1.00 0.00 C ATOM 447 CD GLN A 29 -7.797 -1.018 16.460 1.00 0.00 C ATOM 448 OE1 GLN A 29 -8.505 -0.338 15.717 1.00 0.00 O ATOM 449 NE2 GLN A 29 -8.042 -1.150 17.758 1.00 0.00 N ATOM 0 H GLN A 29 -4.205 -2.188 17.714 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.145 -2.314 14.809 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.276 -0.313 16.806 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.441 -0.162 15.067 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.804 -2.120 14.918 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.391 -2.629 16.544 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.429 -1.724 18.337 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -8.843 -0.678 18.176 1.00 0.00 H new ATOM 458 N VAL A 30 -2.197 -0.896 14.331 1.00 0.00 N ATOM 459 CA VAL A 30 -1.049 -0.063 13.987 1.00 0.00 C ATOM 460 C VAL A 30 -1.470 1.122 13.127 1.00 0.00 C ATOM 461 O VAL A 30 -2.268 0.976 12.201 1.00 0.00 O ATOM 462 CB VAL A 30 0.031 -0.867 13.237 1.00 0.00 C ATOM 463 CG1 VAL A 30 0.814 -1.742 14.203 1.00 0.00 C ATOM 464 CG2 VAL A 30 -0.593 -1.706 12.132 1.00 0.00 C ATOM 0 H VAL A 30 -2.419 -1.611 13.639 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.632 0.299 14.926 1.00 0.00 H new ATOM 0 HB VAL A 30 0.724 -0.163 12.777 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.572 -2.302 13.655 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.297 -1.115 14.952 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.135 -2.438 14.696 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.187 -2.265 11.615 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.312 -2.401 12.565 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.102 -1.053 11.423 1.00 0.00 H new ATOM 474 N ARG A 31 -0.923 2.297 13.433 1.00 0.00 N ATOM 475 CA ARG A 31 -1.233 3.499 12.686 1.00 0.00 C ATOM 476 C ARG A 31 -0.507 3.492 11.347 1.00 0.00 C ATOM 477 O ARG A 31 0.700 3.718 11.286 1.00 0.00 O ATOM 478 CB ARG A 31 -0.843 4.741 13.488 1.00 0.00 C ATOM 479 CG ARG A 31 -1.962 5.269 14.370 1.00 0.00 C ATOM 480 CD ARG A 31 -1.419 6.105 15.518 1.00 0.00 C ATOM 481 NE ARG A 31 -2.472 6.859 16.193 1.00 0.00 N ATOM 482 CZ ARG A 31 -2.241 7.848 17.053 1.00 0.00 C ATOM 483 NH1 ARG A 31 -0.997 8.206 17.345 1.00 0.00 N ATOM 484 NH2 ARG A 31 -3.258 8.482 17.622 1.00 0.00 N ATOM 0 H ARG A 31 -0.261 2.435 14.197 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.307 3.524 12.503 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.020 4.505 14.111 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.533 5.526 12.799 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.645 5.871 13.771 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.538 4.434 14.768 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.922 5.454 16.237 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.665 6.795 15.139 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.442 6.613 15.994 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.212 7.722 16.910 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.826 8.965 18.005 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.216 8.211 17.400 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -3.082 9.240 18.281 1.00 0.00 H new ATOM 498 N ILE A 32 -1.243 3.216 10.279 1.00 0.00 N ATOM 499 CA ILE A 32 -0.655 3.160 8.947 1.00 0.00 C ATOM 500 C ILE A 32 -0.634 4.535 8.292 1.00 0.00 C ATOM 501 O ILE A 32 -1.604 5.288 8.372 1.00 0.00 O ATOM 502 CB ILE A 32 -1.422 2.176 8.043 1.00 0.00 C ATOM 503 CG1 ILE A 32 -1.763 0.900 8.817 1.00 0.00 C ATOM 504 CG2 ILE A 32 -0.605 1.850 6.802 1.00 0.00 C ATOM 505 CD1 ILE A 32 -0.545 0.162 9.327 1.00 0.00 C ATOM 0 H ILE A 32 -2.245 3.028 10.308 1.00 0.00 H new ATOM 0 HA ILE A 32 0.371 2.810 9.066 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.353 2.645 7.726 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.403 1.156 9.661 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.337 0.235 8.172 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.160 1.154 6.173 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.409 2.766 6.244 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.341 1.396 7.098 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.860 -0.732 9.866 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.085 -0.125 8.485 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.019 0.810 9.998 1.00 0.00 H new ATOM 517 N GLY A 33 0.482 4.854 7.643 1.00 0.00 N ATOM 518 CA GLY A 33 0.619 6.137 6.980 1.00 0.00 C ATOM 519 C GLY A 33 0.593 6.013 5.473 1.00 0.00 C ATOM 520 O GLY A 33 1.415 5.308 4.888 1.00 0.00 O ATOM 0 H GLY A 33 1.296 4.244 7.565 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.187 6.797 7.301 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.555 6.604 7.287 1.00 0.00 H new ATOM 524 N VAL A 34 -0.354 6.695 4.841 1.00 0.00 N ATOM 525 CA VAL A 34 -0.479 6.651 3.391 1.00 0.00 C ATOM 526 C VAL A 34 -0.279 8.029 2.773 1.00 0.00 C ATOM 527 O VAL A 34 -1.168 8.879 2.820 1.00 0.00 O ATOM 528 CB VAL A 34 -1.853 6.105 2.962 1.00 0.00 C ATOM 529 CG1 VAL A 34 -1.871 5.822 1.467 1.00 0.00 C ATOM 530 CG2 VAL A 34 -2.202 4.854 3.754 1.00 0.00 C ATOM 0 H VAL A 34 -1.044 7.283 5.308 1.00 0.00 H new ATOM 0 HA VAL A 34 0.301 5.981 3.031 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.608 6.862 3.174 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.850 5.437 1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.670 6.743 0.920 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.106 5.083 1.227 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.176 4.483 3.437 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.447 4.088 3.577 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.233 5.093 4.817 1.00 0.00 H new ATOM 540 N ASN A 35 0.895 8.239 2.189 1.00 0.00 N ATOM 541 CA ASN A 35 1.211 9.510 1.551 1.00 0.00 C ATOM 542 C ASN A 35 0.850 9.463 0.072 1.00 0.00 C ATOM 543 O ASN A 35 1.516 8.797 -0.720 1.00 0.00 O ATOM 544 CB ASN A 35 2.696 9.842 1.723 1.00 0.00 C ATOM 545 CG ASN A 35 2.927 11.304 2.052 1.00 0.00 C ATOM 546 OD1 ASN A 35 3.224 11.656 3.194 1.00 0.00 O ATOM 547 ND2 ASN A 35 2.792 12.166 1.050 1.00 0.00 N ATOM 0 H ASN A 35 1.642 7.546 2.144 1.00 0.00 H new ATOM 0 HA ASN A 35 0.623 10.293 2.031 1.00 0.00 H new ATOM 0 HB2 ASN A 35 3.114 9.223 2.517 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.230 9.590 0.807 1.00 0.00 H new ATOM 0 HD21 ASN A 35 2.936 13.163 1.212 1.00 0.00 H new ATOM 0 HD22 ASN A 35 2.545 11.831 0.119 1.00 0.00 H new ATOM 554 N ALA A 36 -0.215 10.164 -0.292 1.00 0.00 N ATOM 555 CA ALA A 36 -0.671 10.191 -1.676 1.00 0.00 C ATOM 556 C ALA A 36 -1.270 11.545 -2.050 1.00 0.00 C ATOM 557 O ALA A 36 -1.918 12.196 -1.230 1.00 0.00 O ATOM 558 CB ALA A 36 -1.688 9.085 -1.912 1.00 0.00 C ATOM 0 H ALA A 36 -0.779 10.721 0.350 1.00 0.00 H new ATOM 0 HA ALA A 36 0.197 10.027 -2.314 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.023 9.114 -2.949 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.229 8.118 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.543 9.229 -1.251 1.00 0.00 H new ATOM 564 N PRO A 37 -1.065 11.982 -3.306 1.00 0.00 N ATOM 565 CA PRO A 37 -1.589 13.254 -3.798 1.00 0.00 C ATOM 566 C PRO A 37 -3.039 13.136 -4.252 1.00 0.00 C ATOM 567 O PRO A 37 -3.504 12.049 -4.596 1.00 0.00 O ATOM 568 CB PRO A 37 -0.679 13.554 -4.984 1.00 0.00 C ATOM 569 CG PRO A 37 -0.326 12.212 -5.528 1.00 0.00 C ATOM 570 CD PRO A 37 -0.309 11.264 -4.352 1.00 0.00 C ATOM 0 HA PRO A 37 -1.593 14.031 -3.034 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.187 14.164 -5.731 1.00 0.00 H new ATOM 0 HB3 PRO A 37 0.210 14.104 -4.674 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -1.054 11.892 -6.274 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.646 12.236 -6.021 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -0.777 10.311 -4.600 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.709 11.045 -4.030 1.00 0.00 H new ATOM 578 N LYS A 38 -3.752 14.256 -4.251 1.00 0.00 N ATOM 579 CA LYS A 38 -5.150 14.268 -4.664 1.00 0.00 C ATOM 580 C LYS A 38 -5.282 14.548 -6.159 1.00 0.00 C ATOM 581 O LYS A 38 -6.145 15.319 -6.581 1.00 0.00 O ATOM 582 CB LYS A 38 -5.928 15.317 -3.866 1.00 0.00 C ATOM 583 CG LYS A 38 -7.421 15.320 -4.157 1.00 0.00 C ATOM 584 CD LYS A 38 -8.242 15.314 -2.877 1.00 0.00 C ATOM 585 CE LYS A 38 -8.775 13.926 -2.564 1.00 0.00 C ATOM 586 NZ LYS A 38 -9.713 13.938 -1.407 1.00 0.00 N ATOM 0 H LYS A 38 -3.386 15.166 -3.970 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.568 13.281 -4.464 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.774 15.139 -2.802 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.521 16.304 -4.086 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.675 16.200 -4.748 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.677 14.447 -4.758 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -7.628 15.664 -2.048 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -9.074 16.011 -2.974 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -9.285 13.527 -3.441 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.942 13.257 -2.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -10.054 12.972 -1.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.220 14.295 -0.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -10.522 14.556 -1.622 1.00 0.00 H new ATOM 600 N GLU A 39 -4.426 13.920 -6.961 1.00 0.00 N ATOM 601 CA GLU A 39 -4.456 14.107 -8.407 1.00 0.00 C ATOM 602 C GLU A 39 -4.871 12.820 -9.115 1.00 0.00 C ATOM 603 O GLU A 39 -5.682 12.845 -10.040 1.00 0.00 O ATOM 604 CB GLU A 39 -3.084 14.558 -8.912 1.00 0.00 C ATOM 605 CG GLU A 39 -2.804 16.033 -8.676 1.00 0.00 C ATOM 606 CD GLU A 39 -1.328 16.367 -8.771 1.00 0.00 C ATOM 607 OE1 GLU A 39 -0.857 16.664 -9.889 1.00 0.00 O ATOM 608 OE2 GLU A 39 -0.643 16.331 -7.727 1.00 0.00 O ATOM 0 H GLU A 39 -3.704 13.278 -6.633 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.192 14.879 -8.632 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.312 13.967 -8.419 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.012 14.349 -9.979 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.355 16.625 -9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.175 16.317 -7.691 1.00 0.00 H new ATOM 615 N VAL A 40 -4.312 11.697 -8.673 1.00 0.00 N ATOM 616 CA VAL A 40 -4.630 10.403 -9.265 1.00 0.00 C ATOM 617 C VAL A 40 -5.910 9.831 -8.664 1.00 0.00 C ATOM 618 O VAL A 40 -6.339 10.246 -7.588 1.00 0.00 O ATOM 619 CB VAL A 40 -3.481 9.390 -9.073 1.00 0.00 C ATOM 620 CG1 VAL A 40 -3.669 8.191 -9.988 1.00 0.00 C ATOM 621 CG2 VAL A 40 -2.134 10.053 -9.322 1.00 0.00 C ATOM 0 H VAL A 40 -3.638 11.658 -7.908 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.772 10.569 -10.333 1.00 0.00 H new ATOM 0 HB VAL A 40 -3.501 9.039 -8.041 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.850 7.488 -9.839 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.615 7.701 -9.756 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -3.678 8.523 -11.026 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.337 9.322 -9.182 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.100 10.436 -10.342 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.999 10.877 -8.621 1.00 0.00 H new ATOM 631 N SER A 41 -6.520 8.879 -9.364 1.00 0.00 N ATOM 632 CA SER A 41 -7.753 8.259 -8.893 1.00 0.00 C ATOM 633 C SER A 41 -7.537 7.588 -7.541 1.00 0.00 C ATOM 634 O SER A 41 -7.013 6.476 -7.466 1.00 0.00 O ATOM 635 CB SER A 41 -8.257 7.234 -9.911 1.00 0.00 C ATOM 636 OG SER A 41 -7.685 7.459 -11.188 1.00 0.00 O ATOM 0 H SER A 41 -6.181 8.521 -10.257 1.00 0.00 H new ATOM 0 HA SER A 41 -8.504 9.041 -8.777 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.011 6.228 -9.571 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.343 7.290 -9.981 1.00 0.00 H new ATOM 0 HG SER A 41 -6.830 6.984 -11.252 1.00 0.00 H new ATOM 642 N VAL A 42 -7.946 8.267 -6.473 1.00 0.00 N ATOM 643 CA VAL A 42 -7.799 7.732 -5.126 1.00 0.00 C ATOM 644 C VAL A 42 -9.152 7.645 -4.422 1.00 0.00 C ATOM 645 O VAL A 42 -9.850 8.648 -4.277 1.00 0.00 O ATOM 646 CB VAL A 42 -6.845 8.602 -4.281 1.00 0.00 C ATOM 647 CG1 VAL A 42 -7.371 10.026 -4.175 1.00 0.00 C ATOM 648 CG2 VAL A 42 -6.646 7.996 -2.899 1.00 0.00 C ATOM 0 H VAL A 42 -8.382 9.188 -6.516 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.377 6.731 -5.222 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.877 8.632 -4.781 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.685 10.624 -3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.453 10.459 -5.172 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.353 10.017 -3.701 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.970 8.625 -2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.607 7.930 -2.389 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.218 6.998 -2.997 1.00 0.00 H new ATOM 658 N HIS A 43 -9.513 6.445 -3.976 1.00 0.00 N ATOM 659 CA HIS A 43 -10.775 6.235 -3.277 1.00 0.00 C ATOM 660 C HIS A 43 -10.532 5.508 -1.959 1.00 0.00 C ATOM 661 O HIS A 43 -9.760 4.550 -1.907 1.00 0.00 O ATOM 662 CB HIS A 43 -11.741 5.432 -4.151 1.00 0.00 C ATOM 663 CG HIS A 43 -13.149 5.940 -4.110 1.00 0.00 C ATOM 664 ND1 HIS A 43 -14.245 5.144 -4.366 1.00 0.00 N ATOM 665 CD2 HIS A 43 -13.639 7.174 -3.841 1.00 0.00 C ATOM 666 CE1 HIS A 43 -15.348 5.863 -4.258 1.00 0.00 C ATOM 667 NE2 HIS A 43 -15.007 7.098 -3.939 1.00 0.00 N ATOM 0 H HIS A 43 -8.948 5.603 -4.087 1.00 0.00 H new ATOM 0 HA HIS A 43 -11.221 7.207 -3.066 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -11.387 5.451 -5.182 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -11.730 4.391 -3.829 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -13.062 8.053 -3.595 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -16.355 5.503 -4.405 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.655 7.871 -3.789 1.00 0.00 H new ATOM 675 N ARG A 44 -11.185 5.963 -0.895 1.00 0.00 N ATOM 676 CA ARG A 44 -11.022 5.343 0.414 1.00 0.00 C ATOM 677 C ARG A 44 -12.171 5.728 1.342 1.00 0.00 C ATOM 678 O ARG A 44 -13.200 6.234 0.894 1.00 0.00 O ATOM 679 CB ARG A 44 -9.683 5.757 1.031 1.00 0.00 C ATOM 680 CG ARG A 44 -8.756 4.585 1.310 1.00 0.00 C ATOM 681 CD ARG A 44 -8.684 4.270 2.796 1.00 0.00 C ATOM 682 NE ARG A 44 -9.675 3.272 3.191 1.00 0.00 N ATOM 683 CZ ARG A 44 -9.836 2.842 4.441 1.00 0.00 C ATOM 684 NH1 ARG A 44 -9.075 3.320 5.418 1.00 0.00 N ATOM 685 NH2 ARG A 44 -10.760 1.931 4.715 1.00 0.00 N ATOM 0 H ARG A 44 -11.828 6.754 -0.913 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.033 4.261 0.285 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.182 6.454 0.359 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.871 6.291 1.962 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -9.106 3.707 0.768 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -7.758 4.813 0.937 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.686 3.907 3.042 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.841 5.184 3.369 1.00 0.00 H new ATOM 0 HE ARG A 44 -10.279 2.882 2.467 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -8.362 4.020 5.213 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -9.203 2.987 6.374 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -11.347 1.560 3.968 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -10.883 1.602 5.672 1.00 0.00 H new ATOM 699 N GLU A 45 -11.990 5.485 2.636 1.00 0.00 N ATOM 700 CA GLU A 45 -13.012 5.806 3.624 1.00 0.00 C ATOM 701 C GLU A 45 -13.251 7.312 3.693 1.00 0.00 C ATOM 702 O GLU A 45 -12.307 8.104 3.687 1.00 0.00 O ATOM 703 CB GLU A 45 -12.605 5.275 5.001 1.00 0.00 C ATOM 704 CG GLU A 45 -13.714 4.520 5.714 1.00 0.00 C ATOM 705 CD GLU A 45 -13.676 4.710 7.218 1.00 0.00 C ATOM 706 OE1 GLU A 45 -12.564 4.851 7.770 1.00 0.00 O ATOM 707 OE2 GLU A 45 -14.757 4.718 7.843 1.00 0.00 O ATOM 0 H GLU A 45 -11.145 5.067 3.024 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.941 5.325 3.318 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.744 4.617 4.887 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.287 6.111 5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -14.679 4.855 5.334 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.632 3.458 5.484 1.00 0.00 H new ATOM 714 N GLU A 46 -14.520 7.702 3.759 1.00 0.00 N ATOM 715 CA GLU A 46 -14.881 9.113 3.829 1.00 0.00 C ATOM 716 C GLU A 46 -14.180 9.798 4.998 1.00 0.00 C ATOM 717 O GLU A 46 -13.397 10.726 4.804 1.00 0.00 O ATOM 718 CB GLU A 46 -16.397 9.266 3.969 1.00 0.00 C ATOM 719 CG GLU A 46 -16.888 10.688 3.754 1.00 0.00 C ATOM 720 CD GLU A 46 -17.648 10.853 2.452 1.00 0.00 C ATOM 721 OE1 GLU A 46 -18.868 10.585 2.439 1.00 0.00 O ATOM 722 OE2 GLU A 46 -17.024 11.252 1.446 1.00 0.00 O ATOM 0 H GLU A 46 -15.314 7.062 3.765 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.557 9.591 2.904 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.888 8.609 3.251 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.697 8.933 4.963 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -17.532 10.975 4.585 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.036 11.368 3.761 1.00 0.00 H new ATOM 729 N ILE A 47 -14.462 9.329 6.210 1.00 0.00 N ATOM 730 CA ILE A 47 -13.857 9.895 7.411 1.00 0.00 C ATOM 731 C ILE A 47 -12.333 9.866 7.331 1.00 0.00 C ATOM 732 O ILE A 47 -11.661 10.806 7.758 1.00 0.00 O ATOM 733 CB ILE A 47 -14.313 9.140 8.677 1.00 0.00 C ATOM 734 CG1 ILE A 47 -13.755 9.814 9.933 1.00 0.00 C ATOM 735 CG2 ILE A 47 -13.880 7.682 8.613 1.00 0.00 C ATOM 736 CD1 ILE A 47 -14.567 9.535 11.179 1.00 0.00 C ATOM 0 H ILE A 47 -15.106 8.558 6.386 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.190 10.931 7.475 1.00 0.00 H new ATOM 0 HB ILE A 47 -15.401 9.172 8.725 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.731 9.476 10.093 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -13.713 10.891 9.770 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -14.210 7.165 9.514 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -14.326 7.208 7.738 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -12.794 7.628 8.541 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -14.114 10.044 12.030 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -15.585 9.899 11.039 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.588 8.462 11.367 1.00 0.00 H new ATOM 748 N TYR A 48 -11.792 8.781 6.779 1.00 0.00 N ATOM 749 CA TYR A 48 -10.346 8.628 6.641 1.00 0.00 C ATOM 750 C TYR A 48 -9.714 9.899 6.076 1.00 0.00 C ATOM 751 O TYR A 48 -8.886 10.535 6.729 1.00 0.00 O ATOM 752 CB TYR A 48 -10.023 7.428 5.743 1.00 0.00 C ATOM 753 CG TYR A 48 -8.574 7.351 5.309 1.00 0.00 C ATOM 754 CD1 TYR A 48 -7.566 7.098 6.229 1.00 0.00 C ATOM 755 CD2 TYR A 48 -8.219 7.532 3.978 1.00 0.00 C ATOM 756 CE1 TYR A 48 -6.242 7.026 5.836 1.00 0.00 C ATOM 757 CE2 TYR A 48 -6.898 7.462 3.577 1.00 0.00 C ATOM 758 CZ TYR A 48 -5.915 7.209 4.509 1.00 0.00 C ATOM 759 OH TYR A 48 -4.599 7.139 4.113 1.00 0.00 O ATOM 0 H TYR A 48 -12.334 7.995 6.420 1.00 0.00 H new ATOM 0 HA TYR A 48 -9.926 8.451 7.631 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -10.281 6.511 6.273 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -10.655 7.472 4.856 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -7.820 6.955 7.269 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.987 7.730 3.245 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -5.469 6.828 6.564 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -6.638 7.605 2.539 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.113 6.524 4.701 1.00 0.00 H new ATOM 769 N GLN A 49 -10.107 10.264 4.860 1.00 0.00 N ATOM 770 CA GLN A 49 -9.571 11.457 4.216 1.00 0.00 C ATOM 771 C GLN A 49 -10.190 12.730 4.794 1.00 0.00 C ATOM 772 O GLN A 49 -9.616 13.812 4.676 1.00 0.00 O ATOM 773 CB GLN A 49 -9.814 11.399 2.707 1.00 0.00 C ATOM 774 CG GLN A 49 -11.272 11.186 2.334 1.00 0.00 C ATOM 775 CD GLN A 49 -11.806 12.271 1.420 1.00 0.00 C ATOM 776 OE1 GLN A 49 -12.048 12.038 0.235 1.00 0.00 O ATOM 777 NE2 GLN A 49 -11.991 13.467 1.966 1.00 0.00 N ATOM 0 H GLN A 49 -10.792 9.753 4.303 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.498 11.484 4.408 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.464 12.327 2.255 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.217 10.592 2.282 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -11.380 10.218 1.844 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -11.874 11.153 3.242 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.777 13.616 2.952 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.347 14.237 1.399 1.00 0.00 H new ATOM 786 N ARG A 50 -11.360 12.599 5.415 1.00 0.00 N ATOM 787 CA ARG A 50 -12.043 13.747 6.002 1.00 0.00 C ATOM 788 C ARG A 50 -11.359 14.212 7.287 1.00 0.00 C ATOM 789 O ARG A 50 -11.671 15.282 7.810 1.00 0.00 O ATOM 790 CB ARG A 50 -13.508 13.413 6.288 1.00 0.00 C ATOM 791 CG ARG A 50 -14.443 14.601 6.132 1.00 0.00 C ATOM 792 CD ARG A 50 -14.727 14.895 4.668 1.00 0.00 C ATOM 793 NE ARG A 50 -15.483 16.133 4.493 1.00 0.00 N ATOM 794 CZ ARG A 50 -16.010 16.523 3.334 1.00 0.00 C ATOM 795 NH1 ARG A 50 -15.867 15.775 2.247 1.00 0.00 N ATOM 796 NH2 ARG A 50 -16.681 17.664 3.263 1.00 0.00 N ATOM 0 H ARG A 50 -11.853 11.713 5.524 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.994 14.559 5.277 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.829 12.618 5.615 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.592 13.025 7.303 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.379 14.400 6.652 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.000 15.479 6.602 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -13.785 14.966 4.124 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.285 14.065 4.234 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.615 16.734 5.307 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -15.351 14.896 2.297 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -16.273 16.079 1.362 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.793 18.242 4.096 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -17.085 17.964 2.376 1.00 0.00 H new ATOM 810 N ILE A 51 -10.428 13.409 7.794 1.00 0.00 N ATOM 811 CA ILE A 51 -9.709 13.753 9.016 1.00 0.00 C ATOM 812 C ILE A 51 -8.228 13.990 8.735 1.00 0.00 C ATOM 813 O ILE A 51 -7.571 14.762 9.433 1.00 0.00 O ATOM 814 CB ILE A 51 -9.855 12.656 10.090 1.00 0.00 C ATOM 815 CG1 ILE A 51 -9.281 11.328 9.590 1.00 0.00 C ATOM 816 CG2 ILE A 51 -11.316 12.493 10.483 1.00 0.00 C ATOM 817 CD1 ILE A 51 -8.403 10.629 10.606 1.00 0.00 C ATOM 0 H ILE A 51 -10.155 12.518 7.379 1.00 0.00 H new ATOM 0 HA ILE A 51 -10.154 14.673 9.394 1.00 0.00 H new ATOM 0 HB ILE A 51 -9.290 12.959 10.971 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -10.103 10.667 9.315 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -8.702 11.510 8.685 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -11.404 11.715 11.242 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.692 13.435 10.883 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -11.899 12.212 9.606 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.031 9.695 10.184 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -7.561 11.272 10.863 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.984 10.416 11.503 1.00 0.00 H new ATOM 829 N GLN A 52 -7.708 13.323 7.709 1.00 0.00 N ATOM 830 CA GLN A 52 -6.305 13.465 7.337 1.00 0.00 C ATOM 831 C GLN A 52 -6.163 14.321 6.083 1.00 0.00 C ATOM 832 O GLN A 52 -5.437 15.316 6.076 1.00 0.00 O ATOM 833 CB GLN A 52 -5.676 12.090 7.106 1.00 0.00 C ATOM 834 CG GLN A 52 -5.141 11.446 8.374 1.00 0.00 C ATOM 835 CD GLN A 52 -4.148 12.331 9.102 1.00 0.00 C ATOM 836 OE1 GLN A 52 -2.949 12.293 8.829 1.00 0.00 O ATOM 837 NE2 GLN A 52 -4.646 13.135 10.034 1.00 0.00 N ATOM 0 H GLN A 52 -8.237 12.679 7.121 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.783 13.961 8.156 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.419 11.430 6.659 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -4.863 12.188 6.387 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.973 11.216 9.039 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.663 10.499 8.123 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.648 13.133 10.227 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.027 13.755 10.557 1.00 0.00 H new ATOM 846 N ALA A 53 -6.866 13.931 5.024 1.00 0.00 N ATOM 847 CA ALA A 53 -6.823 14.664 3.767 1.00 0.00 C ATOM 848 C ALA A 53 -7.350 16.082 3.952 1.00 0.00 C ATOM 849 O ALA A 53 -6.606 17.055 3.825 1.00 0.00 O ATOM 850 CB ALA A 53 -7.625 13.934 2.700 1.00 0.00 C ATOM 0 H ALA A 53 -7.472 13.111 5.013 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.785 14.725 3.441 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.583 14.495 1.766 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.205 12.940 2.546 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.662 13.844 3.023 1.00 0.00 H new ATOM 856 N GLU A 54 -8.638 16.190 4.258 1.00 0.00 N ATOM 857 CA GLU A 54 -9.269 17.486 4.469 1.00 0.00 C ATOM 858 C GLU A 54 -9.629 17.676 5.939 1.00 0.00 C ATOM 859 O GLU A 54 -10.434 16.928 6.493 1.00 0.00 O ATOM 860 CB GLU A 54 -10.523 17.616 3.603 1.00 0.00 C ATOM 861 CG GLU A 54 -10.224 17.777 2.121 1.00 0.00 C ATOM 862 CD GLU A 54 -10.454 19.194 1.631 1.00 0.00 C ATOM 863 OE1 GLU A 54 -9.796 20.117 2.155 1.00 0.00 O ATOM 864 OE2 GLU A 54 -11.293 19.379 0.725 1.00 0.00 O ATOM 0 H GLU A 54 -9.266 15.394 4.365 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.559 18.261 4.181 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.146 16.733 3.746 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.103 18.474 3.944 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -9.189 17.494 1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.852 17.093 1.551 1.00 0.00 H new ATOM 871 N LYS A 55 -9.024 18.681 6.565 1.00 0.00 N ATOM 872 CA LYS A 55 -9.267 18.977 7.968 1.00 0.00 C ATOM 873 C LYS A 55 -10.761 18.992 8.286 1.00 0.00 C ATOM 874 O LYS A 55 -11.480 19.912 7.893 1.00 0.00 O ATOM 875 CB LYS A 55 -8.639 20.322 8.341 1.00 0.00 C ATOM 876 CG LYS A 55 -7.866 20.290 9.649 1.00 0.00 C ATOM 877 CD LYS A 55 -6.617 21.153 9.580 1.00 0.00 C ATOM 878 CE LYS A 55 -5.504 20.597 10.454 1.00 0.00 C ATOM 879 NZ LYS A 55 -4.481 19.867 9.655 1.00 0.00 N ATOM 0 H LYS A 55 -8.356 19.308 6.115 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.805 18.187 8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -7.969 20.635 7.540 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -9.425 21.074 8.411 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -8.506 20.639 10.459 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -7.587 19.263 9.883 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -6.273 21.215 8.547 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -6.857 22.168 9.897 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -5.026 21.413 10.996 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -5.929 19.925 11.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.740 19.504 10.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.931 19.072 9.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -4.056 20.514 8.961 1.00 0.00 H new ATOM 893 N SER A 56 -11.221 17.970 8.999 1.00 0.00 N ATOM 894 CA SER A 56 -12.628 17.867 9.369 1.00 0.00 C ATOM 895 C SER A 56 -13.047 19.042 10.247 1.00 0.00 C ATOM 896 O SER A 56 -12.207 19.709 10.851 1.00 0.00 O ATOM 897 CB SER A 56 -12.890 16.548 10.101 1.00 0.00 C ATOM 898 OG SER A 56 -14.078 15.933 9.635 1.00 0.00 O ATOM 0 H SER A 56 -10.640 17.201 9.332 1.00 0.00 H new ATOM 0 HA SER A 56 -13.221 17.891 8.455 1.00 0.00 H new ATOM 0 HB2 SER A 56 -12.046 15.874 9.955 1.00 0.00 H new ATOM 0 HB3 SER A 56 -12.969 16.733 11.172 1.00 0.00 H new ATOM 0 HG SER A 56 -14.222 15.092 10.117 1.00 0.00 H new ATOM 904 N GLN A 57 -14.352 19.289 10.314 1.00 0.00 N ATOM 905 CA GLN A 57 -14.882 20.384 11.119 1.00 0.00 C ATOM 906 C GLN A 57 -14.578 20.168 12.598 1.00 0.00 C ATOM 907 O GLN A 57 -13.812 20.920 13.200 1.00 0.00 O ATOM 908 CB GLN A 57 -16.392 20.515 10.909 1.00 0.00 C ATOM 909 CG GLN A 57 -16.918 21.922 11.140 1.00 0.00 C ATOM 910 CD GLN A 57 -16.396 22.914 10.119 1.00 0.00 C ATOM 911 OE1 GLN A 57 -16.837 22.931 8.970 1.00 0.00 O ATOM 912 NE2 GLN A 57 -15.451 23.749 10.535 1.00 0.00 N ATOM 0 H GLN A 57 -15.061 18.746 9.821 1.00 0.00 H new ATOM 0 HA GLN A 57 -14.397 21.306 10.798 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -16.637 20.207 9.893 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -16.905 19.829 11.583 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -18.007 21.909 11.105 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -16.635 22.252 12.140 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -15.114 23.700 11.497 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -15.062 24.439 9.893 1.00 0.00 H new ATOM 921 N GLN A 58 -15.183 19.136 13.177 1.00 0.00 N ATOM 922 CA GLN A 58 -14.975 18.820 14.585 1.00 0.00 C ATOM 923 C GLN A 58 -13.695 18.014 14.776 1.00 0.00 C ATOM 924 O GLN A 58 -13.313 17.224 13.913 1.00 0.00 O ATOM 925 CB GLN A 58 -16.170 18.040 15.136 1.00 0.00 C ATOM 926 CG GLN A 58 -17.421 18.886 15.310 1.00 0.00 C ATOM 927 CD GLN A 58 -17.373 19.746 16.557 1.00 0.00 C ATOM 928 OE1 GLN A 58 -17.820 19.334 17.627 1.00 0.00 O ATOM 929 NE2 GLN A 58 -16.830 20.951 16.424 1.00 0.00 N ATOM 0 H GLN A 58 -15.821 18.505 12.693 1.00 0.00 H new ATOM 0 HA GLN A 58 -14.879 19.757 15.133 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -16.393 17.211 14.465 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -15.898 17.607 16.098 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -17.547 19.526 14.436 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -18.293 18.234 15.356 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -16.472 21.252 15.518 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -16.771 21.576 17.228 1.00 0.00 H new ATOM 938 N SER A 59 -13.034 18.220 15.910 1.00 0.00 N ATOM 939 CA SER A 59 -11.795 17.511 16.210 1.00 0.00 C ATOM 940 C SER A 59 -11.687 17.202 17.700 1.00 0.00 C ATOM 941 O SER A 59 -10.588 17.123 18.249 1.00 0.00 O ATOM 942 CB SER A 59 -10.589 18.337 15.761 1.00 0.00 C ATOM 943 OG SER A 59 -10.839 19.725 15.904 1.00 0.00 O ATOM 0 H SER A 59 -13.335 18.871 16.636 1.00 0.00 H new ATOM 0 HA SER A 59 -11.807 16.568 15.663 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.715 18.059 16.350 1.00 0.00 H new ATOM 0 HB3 SER A 59 -10.357 18.111 14.720 1.00 0.00 H new ATOM 0 HG SER A 59 -10.052 20.231 15.612 1.00 0.00 H new ATOM 949 N SER A 60 -12.834 17.027 18.350 1.00 0.00 N ATOM 950 CA SER A 60 -12.864 16.725 19.777 1.00 0.00 C ATOM 951 C SER A 60 -12.910 15.219 20.011 1.00 0.00 C ATOM 952 O SER A 60 -13.525 14.480 19.242 1.00 0.00 O ATOM 953 CB SER A 60 -14.072 17.393 20.436 1.00 0.00 C ATOM 954 OG SER A 60 -13.843 18.776 20.639 1.00 0.00 O ATOM 0 H SER A 60 -13.753 17.089 17.912 1.00 0.00 H new ATOM 0 HA SER A 60 -11.952 17.118 20.226 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.954 17.255 19.810 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.281 16.912 21.391 1.00 0.00 H new ATOM 0 HG SER A 60 -14.631 19.180 21.060 1.00 0.00 H new ATOM 960 N TYR A 61 -12.255 14.769 21.077 1.00 0.00 N ATOM 961 CA TYR A 61 -12.222 13.350 21.411 1.00 0.00 C ATOM 962 C TYR A 61 -12.089 13.148 22.917 1.00 0.00 C ATOM 963 O TYR A 61 -12.398 12.036 23.393 1.00 0.00 O ATOM 964 CB TYR A 61 -11.063 12.662 20.688 1.00 0.00 C ATOM 965 CG TYR A 61 -11.300 11.191 20.426 1.00 0.00 C ATOM 966 CD1 TYR A 61 -11.043 10.242 21.407 1.00 0.00 C ATOM 967 CD2 TYR A 61 -11.781 10.753 19.199 1.00 0.00 C ATOM 968 CE1 TYR A 61 -11.258 8.897 21.172 1.00 0.00 C ATOM 969 CE2 TYR A 61 -12.000 9.410 18.957 1.00 0.00 C ATOM 970 CZ TYR A 61 -11.737 8.487 19.946 1.00 0.00 C ATOM 971 OH TYR A 61 -11.953 7.149 19.708 1.00 0.00 O ATOM 972 OXT TYR A 61 -11.677 14.104 23.607 1.00 0.00 O ATOM 0 H TYR A 61 -11.740 15.367 21.724 1.00 0.00 H new ATOM 0 HA TYR A 61 -13.161 12.903 21.085 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -10.887 13.168 19.739 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -10.157 12.775 21.283 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -10.669 10.560 22.369 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -11.987 11.473 18.421 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -11.052 8.171 21.945 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -12.375 9.086 17.998 1.00 0.00 H new ATOM 0 HH TYR A 61 -12.292 7.029 18.796 1.00 0.00 H new TER 982 TYR A 61 ATOM 983 N MET B 1 -0.268 13.038 3.403 1.00 0.00 N ATOM 984 CA MET B 1 0.106 12.204 4.575 1.00 0.00 C ATOM 985 C MET B 1 -1.096 11.954 5.479 1.00 0.00 C ATOM 986 O MET B 1 -1.521 12.839 6.223 1.00 0.00 O ATOM 987 CB MET B 1 1.211 12.922 5.351 1.00 0.00 C ATOM 988 CG MET B 1 2.170 11.978 6.058 1.00 0.00 C ATOM 989 SD MET B 1 3.868 12.584 6.058 1.00 0.00 S ATOM 990 CE MET B 1 4.683 11.309 7.016 1.00 0.00 C ATOM 0 H1 MET B 1 0.569 13.192 2.805 1.00 0.00 H new ATOM 0 H2 MET B 1 -1.003 12.551 2.851 1.00 0.00 H new ATOM 0 H3 MET B 1 -0.632 13.955 3.732 1.00 0.00 H new ATOM 0 HA MET B 1 0.461 11.234 4.226 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.775 13.552 4.664 1.00 0.00 H new ATOM 0 HB3 MET B 1 0.755 13.583 6.088 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.840 11.834 7.087 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.137 11.002 5.573 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.744 11.543 7.105 1.00 0.00 H new ATOM 0 HE2 MET B 1 4.238 11.260 8.010 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.564 10.347 6.517 1.00 0.00 H new ATOM 1002 N LEU B 2 -1.638 10.742 5.413 1.00 0.00 N ATOM 1003 CA LEU B 2 -2.790 10.373 6.228 1.00 0.00 C ATOM 1004 C LEU B 2 -2.474 9.161 7.099 1.00 0.00 C ATOM 1005 O LEU B 2 -2.214 8.072 6.588 1.00 0.00 O ATOM 1006 CB LEU B 2 -3.994 10.069 5.334 1.00 0.00 C ATOM 1007 CG LEU B 2 -4.266 11.103 4.240 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -3.412 10.819 3.014 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -5.742 11.112 3.871 1.00 0.00 C ATOM 0 H LEU B 2 -1.298 9.998 4.803 1.00 0.00 H new ATOM 0 HA LEU B 2 -3.029 11.214 6.878 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -3.842 9.097 4.864 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -4.881 9.985 5.962 1.00 0.00 H new ATOM 0 HG LEU B 2 -4.001 12.088 4.623 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.619 11.564 2.246 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -2.358 10.862 3.287 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -3.647 9.827 2.629 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -5.918 11.853 3.091 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -6.032 10.126 3.507 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -6.335 11.363 4.750 1.00 0.00 H new ATOM 1021 N ILE B 3 -2.503 9.351 8.416 1.00 0.00 N ATOM 1022 CA ILE B 3 -2.224 8.261 9.343 1.00 0.00 C ATOM 1023 C ILE B 3 -3.517 7.726 9.955 1.00 0.00 C ATOM 1024 O ILE B 3 -4.115 8.352 10.830 1.00 0.00 O ATOM 1025 CB ILE B 3 -1.249 8.699 10.459 1.00 0.00 C ATOM 1026 CG1 ILE B 3 -0.778 7.488 11.267 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -1.892 9.735 11.370 1.00 0.00 C ATOM 1028 CD1 ILE B 3 0.658 7.600 11.742 1.00 0.00 C ATOM 0 H ILE B 3 -2.715 10.244 8.861 1.00 0.00 H new ATOM 0 HA ILE B 3 -1.747 7.464 8.773 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.380 9.158 9.988 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -1.430 7.362 12.132 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -0.882 6.591 10.656 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -1.184 10.026 12.146 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -2.170 10.612 10.785 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -2.783 9.310 11.832 1.00 0.00 H new ATOM 0 HD11 ILE B 3 0.925 6.707 12.308 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.320 7.695 10.881 1.00 0.00 H new ATOM 0 HD13 ILE B 3 0.763 8.478 12.379 1.00 0.00 H new ATOM 1040 N LEU B 4 -3.933 6.553 9.488 1.00 0.00 N ATOM 1041 CA LEU B 4 -5.144 5.912 9.985 1.00 0.00 C ATOM 1042 C LEU B 4 -4.854 4.497 10.474 1.00 0.00 C ATOM 1043 O LEU B 4 -4.331 3.672 9.724 1.00 0.00 O ATOM 1044 CB LEU B 4 -6.217 5.879 8.895 1.00 0.00 C ATOM 1045 CG LEU B 4 -7.637 5.604 9.394 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -8.355 6.909 9.706 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -8.416 4.795 8.368 1.00 0.00 C ATOM 0 H LEU B 4 -3.446 6.026 8.763 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.511 6.498 10.827 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -6.211 6.835 8.371 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -5.950 5.114 8.166 1.00 0.00 H new ATOM 0 HG LEU B 4 -7.573 5.021 10.312 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -9.363 6.694 10.060 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -7.808 7.450 10.478 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -8.409 7.519 8.804 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -9.423 4.609 8.740 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -8.472 5.351 7.432 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -7.912 3.844 8.195 1.00 0.00 H new ATOM 1059 N THR B 5 -5.197 4.210 11.725 1.00 0.00 N ATOM 1060 CA THR B 5 -4.969 2.880 12.279 1.00 0.00 C ATOM 1061 C THR B 5 -5.636 1.821 11.408 1.00 0.00 C ATOM 1062 O THR B 5 -6.738 2.028 10.900 1.00 0.00 O ATOM 1063 CB THR B 5 -5.497 2.793 13.713 1.00 0.00 C ATOM 1064 OG1 THR B 5 -5.762 4.085 14.231 1.00 0.00 O ATOM 1065 CG2 THR B 5 -4.533 2.109 14.657 1.00 0.00 C ATOM 0 H THR B 5 -5.629 4.872 12.369 1.00 0.00 H new ATOM 0 HA THR B 5 -3.895 2.696 12.295 1.00 0.00 H new ATOM 0 HB THR B 5 -6.410 2.200 13.652 1.00 0.00 H new ATOM 0 HG1 THR B 5 -6.100 4.007 15.148 1.00 0.00 H new ATOM 0 HG21 THR B 5 -4.964 2.078 15.658 1.00 0.00 H new ATOM 0 HG22 THR B 5 -4.345 1.092 14.311 1.00 0.00 H new ATOM 0 HG23 THR B 5 -3.595 2.663 14.683 1.00 0.00 H new ATOM 1073 N ARG B 6 -4.961 0.691 11.230 1.00 0.00 N ATOM 1074 CA ARG B 6 -5.495 -0.388 10.408 1.00 0.00 C ATOM 1075 C ARG B 6 -4.978 -1.747 10.868 1.00 0.00 C ATOM 1076 O ARG B 6 -3.820 -1.883 11.264 1.00 0.00 O ATOM 1077 CB ARG B 6 -5.127 -0.165 8.940 1.00 0.00 C ATOM 1078 CG ARG B 6 -6.155 0.647 8.167 1.00 0.00 C ATOM 1079 CD ARG B 6 -5.491 1.691 7.283 1.00 0.00 C ATOM 1080 NE ARG B 6 -4.560 1.090 6.331 1.00 0.00 N ATOM 1081 CZ ARG B 6 -4.934 0.508 5.194 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -6.218 0.444 4.864 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -4.022 -0.013 4.385 1.00 0.00 N ATOM 0 H ARG B 6 -4.048 0.499 11.642 1.00 0.00 H new ATOM 0 HA ARG B 6 -6.580 -0.382 10.516 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -4.164 0.343 8.889 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -5.003 -1.133 8.455 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -6.760 -0.020 7.553 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -6.832 1.138 8.866 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -6.256 2.246 6.740 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -4.958 2.409 7.907 1.00 0.00 H new ATOM 0 HE ARG B 6 -3.564 1.118 6.551 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -6.924 0.842 5.483 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -6.499 -0.003 3.991 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -3.034 0.032 4.634 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -4.308 -0.459 3.514 1.00 0.00 H new ATOM 1097 N ARG B 7 -5.852 -2.749 10.796 1.00 0.00 N ATOM 1098 CA ARG B 7 -5.510 -4.119 11.188 1.00 0.00 C ATOM 1099 C ARG B 7 -6.737 -5.038 11.177 1.00 0.00 C ATOM 1100 O ARG B 7 -6.624 -6.228 11.471 1.00 0.00 O ATOM 1101 CB ARG B 7 -4.871 -4.147 12.579 1.00 0.00 C ATOM 1102 CG ARG B 7 -4.295 -5.506 12.950 1.00 0.00 C ATOM 1103 CD ARG B 7 -4.924 -6.059 14.220 1.00 0.00 C ATOM 1104 NE ARG B 7 -5.836 -7.166 13.941 1.00 0.00 N ATOM 1105 CZ ARG B 7 -6.206 -8.069 14.847 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -5.749 -7.998 16.091 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -7.037 -9.045 14.508 1.00 0.00 N ATOM 0 H ARG B 7 -6.811 -2.638 10.467 1.00 0.00 H new ATOM 0 HA ARG B 7 -4.795 -4.487 10.452 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -4.078 -3.400 12.622 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -5.618 -3.862 13.320 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -4.457 -6.205 12.130 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -3.217 -5.419 13.086 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -4.139 -6.398 14.896 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -5.465 -5.264 14.733 1.00 0.00 H new ATOM 0 HE ARG B 7 -6.211 -7.252 12.997 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -5.111 -7.249 16.358 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -6.036 -8.693 16.780 1.00 0.00 H new ATOM 0 HH21 ARG B 7 -7.392 -9.104 13.554 1.00 0.00 H new ATOM 0 HH22 ARG B 7 -7.321 -9.737 15.201 1.00 0.00 H new ATOM 1121 N VAL B 8 -7.904 -4.490 10.838 1.00 0.00 N ATOM 1122 CA VAL B 8 -9.132 -5.273 10.795 1.00 0.00 C ATOM 1123 C VAL B 8 -10.081 -4.740 9.727 1.00 0.00 C ATOM 1124 O VAL B 8 -10.549 -3.604 9.810 1.00 0.00 O ATOM 1125 CB VAL B 8 -9.854 -5.264 12.156 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -10.996 -6.269 12.163 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -8.874 -5.551 13.284 1.00 0.00 C ATOM 0 H VAL B 8 -8.021 -3.508 10.590 1.00 0.00 H new ATOM 0 HA VAL B 8 -8.847 -6.297 10.551 1.00 0.00 H new ATOM 0 HB VAL B 8 -10.274 -4.271 12.316 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -11.493 -6.248 13.133 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -11.712 -6.012 11.382 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -10.602 -7.269 11.979 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -9.403 -5.540 14.237 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -8.421 -6.530 13.132 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -8.096 -4.788 13.293 1.00 0.00 H new ATOM 1137 N GLY B 9 -10.363 -5.566 8.725 1.00 0.00 N ATOM 1138 CA GLY B 9 -11.257 -5.160 7.655 1.00 0.00 C ATOM 1139 C GLY B 9 -10.825 -3.866 6.990 1.00 0.00 C ATOM 1140 O GLY B 9 -11.540 -2.865 7.043 1.00 0.00 O ATOM 0 H GLY B 9 -9.988 -6.510 8.634 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -11.303 -5.951 6.906 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -12.264 -5.040 8.054 1.00 0.00 H new ATOM 1144 N GLU B 10 -9.654 -3.887 6.360 1.00 0.00 N ATOM 1145 CA GLU B 10 -9.130 -2.708 5.679 1.00 0.00 C ATOM 1146 C GLU B 10 -9.231 -2.868 4.166 1.00 0.00 C ATOM 1147 O GLU B 10 -9.583 -3.940 3.673 1.00 0.00 O ATOM 1148 CB GLU B 10 -7.674 -2.463 6.082 1.00 0.00 C ATOM 1149 CG GLU B 10 -7.415 -2.639 7.570 1.00 0.00 C ATOM 1150 CD GLU B 10 -8.294 -1.747 8.425 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -8.830 -0.754 7.890 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -8.445 -2.042 9.629 1.00 0.00 O ATOM 0 H GLU B 10 -9.050 -4.707 6.307 1.00 0.00 H new ATOM 0 HA GLU B 10 -9.730 -1.849 5.978 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -7.032 -3.147 5.527 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -7.390 -1.452 5.790 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -7.585 -3.680 7.844 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -6.368 -2.421 7.781 1.00 0.00 H new ATOM 1159 N THR B 11 -8.911 -1.800 3.435 1.00 0.00 N ATOM 1160 CA THR B 11 -8.957 -1.821 1.971 1.00 0.00 C ATOM 1161 C THR B 11 -8.923 -0.411 1.393 1.00 0.00 C ATOM 1162 O THR B 11 -9.940 0.283 1.360 1.00 0.00 O ATOM 1163 CB THR B 11 -10.213 -2.547 1.471 1.00 0.00 C ATOM 1164 OG1 THR B 11 -10.464 -2.240 0.111 1.00 0.00 O ATOM 1165 CG2 THR B 11 -11.459 -2.200 2.257 1.00 0.00 C ATOM 0 H THR B 11 -8.617 -0.908 3.832 1.00 0.00 H new ATOM 0 HA THR B 11 -8.073 -2.360 1.631 1.00 0.00 H new ATOM 0 HB THR B 11 -10.003 -3.608 1.604 1.00 0.00 H new ATOM 0 HG1 THR B 11 -11.268 -2.714 -0.188 1.00 0.00 H new ATOM 0 HG21 THR B 11 -12.310 -2.748 1.851 1.00 0.00 H new ATOM 0 HG22 THR B 11 -11.317 -2.473 3.303 1.00 0.00 H new ATOM 0 HG23 THR B 11 -11.649 -1.129 2.184 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.751 -0.002 0.922 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.587 1.317 0.324 1.00 0.00 C ATOM 1175 C LEU B 12 -7.387 1.180 -1.182 1.00 0.00 C ATOM 1176 O LEU B 12 -6.919 0.145 -1.657 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.409 2.062 0.980 1.00 0.00 C ATOM 1178 CG LEU B 12 -5.117 2.156 0.153 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.581 3.580 0.159 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.068 1.191 0.681 1.00 0.00 C ATOM 0 H LEU B 12 -6.901 -0.565 0.943 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.488 1.905 0.498 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -6.736 3.074 1.221 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.176 1.569 1.924 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.350 1.879 -0.875 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.666 3.627 -0.432 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.325 4.251 -0.271 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.367 3.884 1.184 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.162 1.274 0.081 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.840 1.434 1.719 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -4.449 0.172 0.623 1.00 0.00 H new ATOM 1192 N MET B 13 -7.740 2.216 -1.936 1.00 0.00 N ATOM 1193 CA MET B 13 -7.586 2.172 -3.382 1.00 0.00 C ATOM 1194 C MET B 13 -6.904 3.430 -3.905 1.00 0.00 C ATOM 1195 O MET B 13 -7.538 4.473 -4.065 1.00 0.00 O ATOM 1196 CB MET B 13 -8.950 2.001 -4.055 1.00 0.00 C ATOM 1197 CG MET B 13 -8.869 1.857 -5.566 1.00 0.00 C ATOM 1198 SD MET B 13 -10.091 2.863 -6.429 1.00 0.00 S ATOM 1199 CE MET B 13 -10.390 1.861 -7.883 1.00 0.00 C ATOM 0 H MET B 13 -8.130 3.086 -1.573 1.00 0.00 H new ATOM 0 HA MET B 13 -6.955 1.317 -3.624 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.443 1.122 -3.640 1.00 0.00 H new ATOM 0 HB3 MET B 13 -9.575 2.860 -3.813 1.00 0.00 H new ATOM 0 HG2 MET B 13 -7.871 2.139 -5.900 1.00 0.00 H new ATOM 0 HG3 MET B 13 -9.011 0.810 -5.835 1.00 0.00 H new ATOM 0 HE1 MET B 13 -11.433 1.958 -8.184 1.00 0.00 H new ATOM 0 HE2 MET B 13 -9.745 2.197 -8.695 1.00 0.00 H new ATOM 0 HE3 MET B 13 -10.174 0.817 -7.656 1.00 0.00 H new ATOM 1209 N ILE B 14 -5.609 3.320 -4.175 1.00 0.00 N ATOM 1210 CA ILE B 14 -4.837 4.442 -4.686 1.00 0.00 C ATOM 1211 C ILE B 14 -4.255 4.116 -6.060 1.00 0.00 C ATOM 1212 O ILE B 14 -3.422 3.221 -6.192 1.00 0.00 O ATOM 1213 CB ILE B 14 -3.694 4.826 -3.723 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -2.941 6.051 -4.246 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -2.743 3.654 -3.528 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -3.830 7.255 -4.460 1.00 0.00 C ATOM 0 H ILE B 14 -5.072 2.462 -4.048 1.00 0.00 H new ATOM 0 HA ILE B 14 -5.517 5.289 -4.773 1.00 0.00 H new ATOM 0 HB ILE B 14 -4.129 5.078 -2.756 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -2.152 6.312 -3.541 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -2.455 5.795 -5.188 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -1.944 3.944 -2.846 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.289 2.808 -3.109 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -2.315 3.369 -4.489 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.232 8.087 -4.831 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -4.604 7.011 -5.188 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -4.296 7.536 -3.515 1.00 0.00 H new ATOM 1228 N GLY B 15 -4.697 4.848 -7.078 1.00 0.00 N ATOM 1229 CA GLY B 15 -4.212 4.620 -8.428 1.00 0.00 C ATOM 1230 C GLY B 15 -5.323 4.731 -9.456 1.00 0.00 C ATOM 1231 O GLY B 15 -5.796 5.828 -9.753 1.00 0.00 O ATOM 0 H GLY B 15 -5.384 5.597 -6.992 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -3.430 5.343 -8.660 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -3.759 3.630 -8.489 1.00 0.00 H new ATOM 1235 N ASP B 16 -5.745 3.591 -9.994 1.00 0.00 N ATOM 1236 CA ASP B 16 -6.814 3.567 -10.989 1.00 0.00 C ATOM 1237 C ASP B 16 -7.603 2.256 -10.938 1.00 0.00 C ATOM 1238 O ASP B 16 -8.438 2.001 -11.805 1.00 0.00 O ATOM 1239 CB ASP B 16 -6.235 3.768 -12.390 1.00 0.00 C ATOM 1240 CG ASP B 16 -7.300 4.124 -13.410 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -7.870 3.195 -14.021 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -7.564 5.330 -13.596 1.00 0.00 O ATOM 0 H ASP B 16 -5.365 2.674 -9.759 1.00 0.00 H new ATOM 0 HA ASP B 16 -7.499 4.382 -10.757 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -5.485 4.559 -12.360 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -5.725 2.857 -12.704 1.00 0.00 H new ATOM 1247 N GLU B 17 -7.336 1.435 -9.915 1.00 0.00 N ATOM 1248 CA GLU B 17 -8.012 0.146 -9.733 1.00 0.00 C ATOM 1249 C GLU B 17 -7.133 -0.789 -8.905 1.00 0.00 C ATOM 1250 O GLU B 17 -6.665 -1.816 -9.397 1.00 0.00 O ATOM 1251 CB GLU B 17 -8.340 -0.512 -11.081 1.00 0.00 C ATOM 1252 CG GLU B 17 -9.791 -0.345 -11.502 1.00 0.00 C ATOM 1253 CD GLU B 17 -9.993 -0.550 -12.991 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -9.387 0.203 -13.782 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -10.759 -1.463 -13.366 1.00 0.00 O ATOM 0 H GLU B 17 -6.647 1.645 -9.193 1.00 0.00 H new ATOM 0 HA GLU B 17 -8.950 0.331 -9.209 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -7.696 -0.086 -11.850 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -8.107 -1.575 -11.023 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -10.409 -1.056 -10.954 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -10.133 0.653 -11.227 1.00 0.00 H new ATOM 1262 N VAL B 18 -6.897 -0.419 -7.650 1.00 0.00 N ATOM 1263 CA VAL B 18 -6.064 -1.211 -6.772 1.00 0.00 C ATOM 1264 C VAL B 18 -6.680 -1.357 -5.386 1.00 0.00 C ATOM 1265 O VAL B 18 -7.092 -0.375 -4.773 1.00 0.00 O ATOM 1266 CB VAL B 18 -4.684 -0.563 -6.618 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -3.896 -0.654 -7.916 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -4.820 0.883 -6.163 1.00 0.00 C ATOM 0 H VAL B 18 -7.275 0.427 -7.224 1.00 0.00 H new ATOM 0 HA VAL B 18 -5.974 -2.198 -7.227 1.00 0.00 H new ATOM 0 HB VAL B 18 -4.132 -1.109 -5.853 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -2.920 -0.187 -7.783 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -3.764 -1.701 -8.189 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -4.439 -0.139 -8.708 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -3.830 1.326 -6.059 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -5.393 1.444 -6.901 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.335 0.915 -5.203 1.00 0.00 H new ATOM 1278 N THR B 19 -6.725 -2.585 -4.889 1.00 0.00 N ATOM 1279 CA THR B 19 -7.270 -2.854 -3.565 1.00 0.00 C ATOM 1280 C THR B 19 -6.173 -3.398 -2.655 1.00 0.00 C ATOM 1281 O THR B 19 -5.611 -4.461 -2.917 1.00 0.00 O ATOM 1282 CB THR B 19 -8.426 -3.851 -3.652 1.00 0.00 C ATOM 1283 OG1 THR B 19 -9.370 -3.441 -4.625 1.00 0.00 O ATOM 1284 CG2 THR B 19 -9.163 -4.027 -2.342 1.00 0.00 C ATOM 0 H THR B 19 -6.390 -3.412 -5.383 1.00 0.00 H new ATOM 0 HA THR B 19 -7.651 -1.922 -3.147 1.00 0.00 H new ATOM 0 HB THR B 19 -7.968 -4.802 -3.923 1.00 0.00 H new ATOM 0 HG1 THR B 19 -10.101 -4.093 -4.667 1.00 0.00 H new ATOM 0 HG21 THR B 19 -9.971 -4.747 -2.473 1.00 0.00 H new ATOM 0 HG22 THR B 19 -8.472 -4.391 -1.582 1.00 0.00 H new ATOM 0 HG23 THR B 19 -9.578 -3.070 -2.027 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.859 -2.661 -1.595 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.814 -3.076 -0.666 1.00 0.00 C ATOM 1294 C VAL B 20 -5.389 -3.521 0.673 1.00 0.00 C ATOM 1295 O VAL B 20 -5.894 -2.705 1.446 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.801 -1.944 -0.409 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -2.544 -2.489 0.250 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -3.459 -1.218 -1.701 1.00 0.00 C ATOM 0 H VAL B 20 -6.311 -1.778 -1.358 1.00 0.00 H new ATOM 0 HA VAL B 20 -4.309 -3.918 -1.139 1.00 0.00 H new ATOM 0 HB VAL B 20 -4.260 -1.226 0.270 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.841 -1.674 0.423 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.804 -2.952 1.202 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -2.084 -3.232 -0.402 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.742 -0.424 -1.493 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -3.024 -1.922 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -4.365 -0.787 -2.127 1.00 0.00 H new ATOM 1308 N THR B 21 -5.294 -4.818 0.946 1.00 0.00 N ATOM 1309 CA THR B 21 -5.788 -5.375 2.200 1.00 0.00 C ATOM 1310 C THR B 21 -4.627 -5.637 3.154 1.00 0.00 C ATOM 1311 O THR B 21 -3.871 -6.594 2.981 1.00 0.00 O ATOM 1312 CB THR B 21 -6.557 -6.671 1.942 1.00 0.00 C ATOM 1313 OG1 THR B 21 -6.778 -7.373 3.153 1.00 0.00 O ATOM 1314 CG2 THR B 21 -5.846 -7.610 0.990 1.00 0.00 C ATOM 0 H THR B 21 -4.879 -5.504 0.315 1.00 0.00 H new ATOM 0 HA THR B 21 -6.464 -4.653 2.657 1.00 0.00 H new ATOM 0 HB THR B 21 -7.498 -6.362 1.487 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.273 -8.198 2.967 1.00 0.00 H new ATOM 0 HG21 THR B 21 -6.446 -8.510 0.851 1.00 0.00 H new ATOM 0 HG22 THR B 21 -5.705 -7.116 0.029 1.00 0.00 H new ATOM 0 HG23 THR B 21 -4.875 -7.882 1.404 1.00 0.00 H new ATOM 1322 N VAL B 22 -4.485 -4.777 4.156 1.00 0.00 N ATOM 1323 CA VAL B 22 -3.411 -4.908 5.133 1.00 0.00 C ATOM 1324 C VAL B 22 -3.757 -5.942 6.202 1.00 0.00 C ATOM 1325 O VAL B 22 -4.017 -5.599 7.356 1.00 0.00 O ATOM 1326 CB VAL B 22 -3.102 -3.550 5.800 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -4.364 -2.954 6.401 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -2.009 -3.689 6.853 1.00 0.00 C ATOM 0 H VAL B 22 -5.102 -3.980 4.313 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.525 -5.247 4.597 1.00 0.00 H new ATOM 0 HB VAL B 22 -2.734 -2.871 5.031 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.128 -1.997 6.867 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -5.105 -2.803 5.616 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.766 -3.634 7.152 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -1.813 -2.717 7.305 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.333 -4.389 7.623 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.098 -4.061 6.385 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.756 -7.211 5.806 1.00 0.00 N ATOM 1339 CA LEU B 23 -4.066 -8.303 6.722 1.00 0.00 C ATOM 1340 C LEU B 23 -2.781 -8.847 7.364 1.00 0.00 C ATOM 1341 O LEU B 23 -1.865 -8.081 7.660 1.00 0.00 O ATOM 1342 CB LEU B 23 -4.821 -9.410 5.969 1.00 0.00 C ATOM 1343 CG LEU B 23 -5.698 -10.344 6.824 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -5.752 -9.892 8.280 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -7.102 -10.433 6.244 1.00 0.00 C ATOM 0 H LEU B 23 -3.543 -7.509 4.854 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.704 -7.930 7.523 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -5.455 -8.940 5.217 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -4.091 -10.020 5.436 1.00 0.00 H new ATOM 0 HG LEU B 23 -5.242 -11.334 6.803 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -6.380 -10.576 8.850 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -4.745 -9.890 8.698 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -6.169 -8.886 8.334 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -7.709 -11.097 6.860 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -7.552 -9.441 6.228 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.052 -10.825 5.228 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.714 -10.164 7.579 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.534 -10.761 8.181 1.00 0.00 C ATOM 1359 C GLY B 24 -1.130 -10.089 9.479 1.00 0.00 C ATOM 1360 O GLY B 24 -0.225 -9.256 9.497 1.00 0.00 O ATOM 0 H GLY B 24 -3.456 -10.824 7.346 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -1.723 -11.818 8.368 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.705 -10.706 7.476 1.00 0.00 H new ATOM 1364 N VAL B 25 -1.801 -10.451 10.569 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.503 -9.878 11.869 1.00 0.00 C ATOM 1366 C VAL B 25 -0.854 -10.905 12.792 1.00 0.00 C ATOM 1367 O VAL B 25 -1.509 -11.836 13.261 1.00 0.00 O ATOM 1368 CB VAL B 25 -2.772 -9.325 12.545 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -2.409 -8.498 13.769 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -3.588 -8.501 11.560 1.00 0.00 C ATOM 0 H VAL B 25 -2.554 -11.139 10.573 1.00 0.00 H new ATOM 0 HA VAL B 25 -0.805 -9.058 11.698 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.382 -10.167 12.871 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -3.318 -8.116 14.233 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -1.872 -9.122 14.483 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.776 -7.663 13.469 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -4.480 -8.119 12.056 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -2.988 -7.666 11.200 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -3.882 -9.127 10.717 1.00 0.00 H new ATOM 1380 N LYS B 26 0.439 -10.728 13.044 1.00 0.00 N ATOM 1381 CA LYS B 26 1.177 -11.643 13.908 1.00 0.00 C ATOM 1382 C LYS B 26 2.537 -11.073 14.301 1.00 0.00 C ATOM 1383 O LYS B 26 3.268 -10.545 13.464 1.00 0.00 O ATOM 1384 CB LYS B 26 1.361 -12.993 13.211 1.00 0.00 C ATOM 1385 CG LYS B 26 1.100 -14.185 14.117 1.00 0.00 C ATOM 1386 CD LYS B 26 1.287 -15.499 13.376 1.00 0.00 C ATOM 1387 CE LYS B 26 0.328 -15.620 12.203 1.00 0.00 C ATOM 1388 NZ LYS B 26 -0.178 -17.010 12.040 1.00 0.00 N ATOM 0 H LYS B 26 0.996 -9.963 12.664 1.00 0.00 H new ATOM 0 HA LYS B 26 0.594 -11.780 14.819 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.690 -13.045 12.354 1.00 0.00 H new ATOM 0 HB3 LYS B 26 2.378 -13.057 12.824 1.00 0.00 H new ATOM 0 HG2 LYS B 26 1.776 -14.149 14.972 1.00 0.00 H new ATOM 0 HG3 LYS B 26 0.085 -14.129 14.510 1.00 0.00 H new ATOM 0 HD2 LYS B 26 2.314 -15.572 13.017 1.00 0.00 H new ATOM 0 HD3 LYS B 26 1.130 -16.331 14.063 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -0.513 -14.943 12.351 1.00 0.00 H new ATOM 0 HE3 LYS B 26 0.832 -15.308 11.288 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -0.829 -17.050 11.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 0.622 -17.653 11.874 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -0.681 -17.300 12.903 1.00 0.00 H new ATOM 1402 N GLY B 27 2.867 -11.193 15.584 1.00 0.00 N ATOM 1403 CA GLY B 27 4.138 -10.695 16.078 1.00 0.00 C ATOM 1404 C GLY B 27 4.342 -9.221 15.793 1.00 0.00 C ATOM 1405 O GLY B 27 3.379 -8.466 15.664 1.00 0.00 O ATOM 0 H GLY B 27 2.275 -11.628 16.292 1.00 0.00 H new ATOM 0 HA2 GLY B 27 4.196 -10.864 17.153 1.00 0.00 H new ATOM 0 HA3 GLY B 27 4.948 -11.264 15.622 1.00 0.00 H new ATOM 1409 N ASN B 28 5.603 -8.811 15.693 1.00 0.00 N ATOM 1410 CA ASN B 28 5.934 -7.419 15.421 1.00 0.00 C ATOM 1411 C ASN B 28 5.691 -7.080 13.955 1.00 0.00 C ATOM 1412 O ASN B 28 4.996 -6.114 13.638 1.00 0.00 O ATOM 1413 CB ASN B 28 7.394 -7.140 15.787 1.00 0.00 C ATOM 1414 CG ASN B 28 7.538 -6.546 17.174 1.00 0.00 C ATOM 1415 OD1 ASN B 28 8.252 -7.082 18.021 1.00 0.00 O ATOM 1416 ND2 ASN B 28 6.857 -5.431 17.413 1.00 0.00 N ATOM 0 H ASN B 28 6.411 -9.424 15.797 1.00 0.00 H new ATOM 0 HA ASN B 28 5.287 -6.790 16.033 1.00 0.00 H new ATOM 0 HB2 ASN B 28 7.964 -8.068 15.731 1.00 0.00 H new ATOM 0 HB3 ASN B 28 7.825 -6.457 15.055 1.00 0.00 H new ATOM 0 HD21 ASN B 28 6.914 -4.985 18.328 1.00 0.00 H new ATOM 0 HD22 ASN B 28 6.277 -5.021 16.681 1.00 0.00 H new ATOM 1423 N GLN B 29 6.267 -7.880 13.064 1.00 0.00 N ATOM 1424 CA GLN B 29 6.112 -7.663 11.631 1.00 0.00 C ATOM 1425 C GLN B 29 4.830 -8.310 11.116 1.00 0.00 C ATOM 1426 O GLN B 29 4.683 -9.532 11.144 1.00 0.00 O ATOM 1427 CB GLN B 29 7.321 -8.221 10.876 1.00 0.00 C ATOM 1428 CG GLN B 29 8.620 -7.495 11.186 1.00 0.00 C ATOM 1429 CD GLN B 29 9.843 -8.263 10.722 1.00 0.00 C ATOM 1430 OE1 GLN B 29 10.257 -8.156 9.568 1.00 0.00 O ATOM 1431 NE2 GLN B 29 10.428 -9.043 11.623 1.00 0.00 N ATOM 0 H GLN B 29 6.845 -8.684 13.309 1.00 0.00 H new ATOM 0 HA GLN B 29 6.048 -6.589 11.457 1.00 0.00 H new ATOM 0 HB2 GLN B 29 7.437 -9.277 11.122 1.00 0.00 H new ATOM 0 HB3 GLN B 29 7.129 -8.163 9.805 1.00 0.00 H new ATOM 0 HG2 GLN B 29 8.608 -6.516 10.708 1.00 0.00 H new ATOM 0 HG3 GLN B 29 8.689 -7.324 12.260 1.00 0.00 H new ATOM 0 HE21 GLN B 29 10.051 -9.101 12.569 1.00 0.00 H new ATOM 0 HE22 GLN B 29 11.255 -9.584 11.369 1.00 0.00 H new ATOM 1440 N VAL B 30 3.902 -7.478 10.659 1.00 0.00 N ATOM 1441 CA VAL B 30 2.622 -7.957 10.148 1.00 0.00 C ATOM 1442 C VAL B 30 2.676 -8.162 8.639 1.00 0.00 C ATOM 1443 O VAL B 30 3.217 -7.330 7.910 1.00 0.00 O ATOM 1444 CB VAL B 30 1.477 -6.980 10.481 1.00 0.00 C ATOM 1445 CG1 VAL B 30 1.070 -7.110 11.940 1.00 0.00 C ATOM 1446 CG2 VAL B 30 1.880 -5.549 10.156 1.00 0.00 C ATOM 0 H VAL B 30 4.012 -6.464 10.632 1.00 0.00 H new ATOM 0 HA VAL B 30 2.426 -8.911 10.637 1.00 0.00 H new ATOM 0 HB VAL B 30 0.616 -7.237 9.864 1.00 0.00 H new ATOM 0 HG11 VAL B 30 0.261 -6.412 12.156 1.00 0.00 H new ATOM 0 HG12 VAL B 30 0.733 -8.128 12.134 1.00 0.00 H new ATOM 0 HG13 VAL B 30 1.924 -6.883 12.578 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.058 -4.876 10.398 1.00 0.00 H new ATOM 0 HG22 VAL B 30 2.758 -5.276 10.742 1.00 0.00 H new ATOM 0 HG23 VAL B 30 2.114 -5.469 9.094 1.00 0.00 H new ATOM 1456 N ARG B 31 2.104 -9.270 8.173 1.00 0.00 N ATOM 1457 CA ARG B 31 2.078 -9.576 6.757 1.00 0.00 C ATOM 1458 C ARG B 31 1.035 -8.722 6.050 1.00 0.00 C ATOM 1459 O ARG B 31 -0.164 -8.970 6.166 1.00 0.00 O ATOM 1460 CB ARG B 31 1.779 -11.060 6.537 1.00 0.00 C ATOM 1461 CG ARG B 31 3.025 -11.927 6.475 1.00 0.00 C ATOM 1462 CD ARG B 31 2.711 -13.377 6.809 1.00 0.00 C ATOM 1463 NE ARG B 31 3.817 -14.269 6.468 1.00 0.00 N ATOM 1464 CZ ARG B 31 3.712 -15.594 6.421 1.00 0.00 C ATOM 1465 NH1 ARG B 31 2.555 -16.186 6.693 1.00 0.00 N ATOM 1466 NH2 ARG B 31 4.766 -16.332 6.101 1.00 0.00 N ATOM 0 H ARG B 31 1.653 -9.969 8.763 1.00 0.00 H new ATOM 0 HA ARG B 31 3.059 -9.351 6.338 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.138 -11.417 7.343 1.00 0.00 H new ATOM 0 HB3 ARG B 31 1.219 -11.176 5.609 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.461 -11.868 5.478 1.00 0.00 H new ATOM 0 HG3 ARG B 31 3.771 -11.545 7.172 1.00 0.00 H new ATOM 0 HD2 ARG B 31 2.490 -13.464 7.873 1.00 0.00 H new ATOM 0 HD3 ARG B 31 1.816 -13.687 6.270 1.00 0.00 H new ATOM 0 HE ARG B 31 4.722 -13.851 6.253 1.00 0.00 H new ATOM 0 HH11 ARG B 31 1.740 -15.624 6.940 1.00 0.00 H new ATOM 0 HH12 ARG B 31 2.481 -17.203 6.655 1.00 0.00 H new ATOM 0 HH21 ARG B 31 5.658 -15.884 5.891 1.00 0.00 H new ATOM 0 HH22 ARG B 31 4.685 -17.348 6.065 1.00 0.00 H new ATOM 1480 N ILE B 32 1.494 -7.706 5.331 1.00 0.00 N ATOM 1481 CA ILE B 32 0.590 -6.807 4.627 1.00 0.00 C ATOM 1482 C ILE B 32 0.252 -7.335 3.238 1.00 0.00 C ATOM 1483 O ILE B 32 1.122 -7.823 2.518 1.00 0.00 O ATOM 1484 CB ILE B 32 1.197 -5.396 4.500 1.00 0.00 C ATOM 1485 CG1 ILE B 32 1.862 -4.986 5.817 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.125 -4.392 4.103 1.00 0.00 C ATOM 1487 CD1 ILE B 32 0.904 -4.944 6.987 1.00 0.00 C ATOM 0 H ILE B 32 2.483 -7.485 5.220 1.00 0.00 H new ATOM 0 HA ILE B 32 -0.325 -6.751 5.216 1.00 0.00 H new ATOM 0 HB ILE B 32 1.958 -5.410 3.719 1.00 0.00 H new ATOM 0 HG12 ILE B 32 2.667 -5.685 6.042 1.00 0.00 H new ATOM 0 HG13 ILE B 32 2.318 -4.003 5.695 1.00 0.00 H new ATOM 0 HG21 ILE B 32 0.569 -3.400 4.017 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -0.307 -4.680 3.144 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -0.657 -4.375 4.862 1.00 0.00 H new ATOM 0 HD11 ILE B 32 1.442 -4.646 7.887 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.112 -4.224 6.783 1.00 0.00 H new ATOM 0 HD13 ILE B 32 0.467 -5.932 7.135 1.00 0.00 H new ATOM 1499 N GLY B 33 -1.023 -7.233 2.870 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.463 -7.704 1.571 1.00 0.00 C ATOM 1501 C GLY B 33 -1.817 -6.568 0.636 1.00 0.00 C ATOM 1502 O GLY B 33 -2.681 -5.749 0.944 1.00 0.00 O ATOM 0 H GLY B 33 -1.759 -6.831 3.451 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.676 -8.310 1.121 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.331 -8.351 1.697 1.00 0.00 H new ATOM 1506 N VAL B 34 -1.145 -6.515 -0.508 1.00 0.00 N ATOM 1507 CA VAL B 34 -1.396 -5.466 -1.485 1.00 0.00 C ATOM 1508 C VAL B 34 -1.897 -6.042 -2.804 1.00 0.00 C ATOM 1509 O VAL B 34 -1.122 -6.586 -3.592 1.00 0.00 O ATOM 1510 CB VAL B 34 -0.130 -4.632 -1.752 1.00 0.00 C ATOM 1511 CG1 VAL B 34 -0.470 -3.393 -2.567 1.00 0.00 C ATOM 1512 CG2 VAL B 34 0.545 -4.251 -0.443 1.00 0.00 C ATOM 0 H VAL B 34 -0.425 -7.184 -0.780 1.00 0.00 H new ATOM 0 HA VAL B 34 -2.166 -4.822 -1.060 1.00 0.00 H new ATOM 0 HB VAL B 34 0.568 -5.238 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.437 -2.815 -2.746 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.904 -3.693 -3.521 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -1.187 -2.782 -2.018 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.438 -3.662 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -0.144 -3.663 0.164 1.00 0.00 H new ATOM 0 HG23 VAL B 34 0.825 -5.155 0.098 1.00 0.00 H new ATOM 1522 N ASN B 35 -3.198 -5.913 -3.038 1.00 0.00 N ATOM 1523 CA ASN B 35 -3.803 -6.413 -4.265 1.00 0.00 C ATOM 1524 C ASN B 35 -3.836 -5.315 -5.322 1.00 0.00 C ATOM 1525 O ASN B 35 -4.608 -4.364 -5.221 1.00 0.00 O ATOM 1526 CB ASN B 35 -5.219 -6.927 -3.995 1.00 0.00 C ATOM 1527 CG ASN B 35 -5.512 -8.223 -4.726 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -5.539 -9.297 -4.124 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -5.734 -8.129 -6.032 1.00 0.00 N ATOM 0 H ASN B 35 -3.852 -5.467 -2.395 1.00 0.00 H new ATOM 0 HA ASN B 35 -3.198 -7.241 -4.635 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -5.349 -7.080 -2.924 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -5.942 -6.170 -4.299 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -5.937 -8.967 -6.576 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.702 -7.218 -6.491 1.00 0.00 H new ATOM 1536 N ALA B 36 -2.982 -5.449 -6.329 1.00 0.00 N ATOM 1537 CA ALA B 36 -2.907 -4.460 -7.397 1.00 0.00 C ATOM 1538 C ALA B 36 -2.575 -5.102 -8.742 1.00 0.00 C ATOM 1539 O ALA B 36 -1.810 -6.064 -8.810 1.00 0.00 O ATOM 1540 CB ALA B 36 -1.873 -3.398 -7.053 1.00 0.00 C ATOM 0 H ALA B 36 -2.334 -6.230 -6.429 1.00 0.00 H new ATOM 0 HA ALA B 36 -3.888 -3.994 -7.487 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -1.824 -2.664 -7.857 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -2.156 -2.902 -6.125 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -0.897 -3.867 -6.930 1.00 0.00 H new ATOM 1546 N PRO B 37 -3.144 -4.566 -9.837 1.00 0.00 N ATOM 1547 CA PRO B 37 -2.906 -5.075 -11.185 1.00 0.00 C ATOM 1548 C PRO B 37 -1.619 -4.521 -11.785 1.00 0.00 C ATOM 1549 O PRO B 37 -1.145 -3.457 -11.383 1.00 0.00 O ATOM 1550 CB PRO B 37 -4.119 -4.566 -11.955 1.00 0.00 C ATOM 1551 CG PRO B 37 -4.455 -3.270 -11.299 1.00 0.00 C ATOM 1552 CD PRO B 37 -4.065 -3.410 -9.847 1.00 0.00 C ATOM 0 HA PRO B 37 -2.788 -6.158 -11.210 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.890 -4.429 -13.012 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.950 -5.268 -11.897 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.916 -2.447 -11.768 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.518 -3.051 -11.396 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.579 -2.508 -9.475 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.935 -3.587 -9.215 1.00 0.00 H new ATOM 1560 N LYS B 38 -1.055 -5.244 -12.745 1.00 0.00 N ATOM 1561 CA LYS B 38 0.179 -4.816 -13.394 1.00 0.00 C ATOM 1562 C LYS B 38 -0.112 -3.965 -14.628 1.00 0.00 C ATOM 1563 O LYS B 38 0.524 -4.131 -15.669 1.00 0.00 O ATOM 1564 CB LYS B 38 1.020 -6.034 -13.785 1.00 0.00 C ATOM 1565 CG LYS B 38 2.376 -5.673 -14.371 1.00 0.00 C ATOM 1566 CD LYS B 38 3.497 -6.468 -13.719 1.00 0.00 C ATOM 1567 CE LYS B 38 4.240 -5.637 -12.684 1.00 0.00 C ATOM 1568 NZ LYS B 38 5.438 -6.347 -12.158 1.00 0.00 N ATOM 0 H LYS B 38 -1.431 -6.127 -13.091 1.00 0.00 H new ATOM 0 HA LYS B 38 0.738 -4.206 -12.684 1.00 0.00 H new ATOM 0 HB2 LYS B 38 1.168 -6.660 -12.905 1.00 0.00 H new ATOM 0 HB3 LYS B 38 0.466 -6.630 -14.511 1.00 0.00 H new ATOM 0 HG2 LYS B 38 2.371 -5.863 -15.444 1.00 0.00 H new ATOM 0 HG3 LYS B 38 2.559 -4.607 -14.236 1.00 0.00 H new ATOM 0 HD2 LYS B 38 3.085 -7.358 -13.244 1.00 0.00 H new ATOM 0 HD3 LYS B 38 4.195 -6.809 -14.483 1.00 0.00 H new ATOM 0 HE2 LYS B 38 4.546 -4.690 -13.130 1.00 0.00 H new ATOM 0 HE3 LYS B 38 3.568 -5.399 -11.859 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 5.916 -5.747 -11.456 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 5.144 -7.238 -11.710 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 6.091 -6.552 -12.941 1.00 0.00 H new ATOM 1582 N GLU B 39 -1.075 -3.054 -14.510 1.00 0.00 N ATOM 1583 CA GLU B 39 -1.441 -2.183 -15.620 1.00 0.00 C ATOM 1584 C GLU B 39 -1.087 -0.730 -15.314 1.00 0.00 C ATOM 1585 O GLU B 39 -0.551 -0.020 -16.164 1.00 0.00 O ATOM 1586 CB GLU B 39 -2.937 -2.302 -15.917 1.00 0.00 C ATOM 1587 CG GLU B 39 -3.303 -3.547 -16.707 1.00 0.00 C ATOM 1588 CD GLU B 39 -4.780 -3.878 -16.620 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -5.554 -3.366 -17.456 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -5.163 -4.649 -15.715 1.00 0.00 O ATOM 0 H GLU B 39 -1.614 -2.901 -13.658 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.876 -2.499 -16.497 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -3.487 -2.304 -14.976 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.260 -1.421 -16.472 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.027 -3.404 -17.752 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.722 -4.392 -16.337 1.00 0.00 H new ATOM 1597 N VAL B 40 -1.389 -0.295 -14.093 1.00 0.00 N ATOM 1598 CA VAL B 40 -1.099 1.073 -13.678 1.00 0.00 C ATOM 1599 C VAL B 40 0.347 1.201 -13.209 1.00 0.00 C ATOM 1600 O VAL B 40 0.993 0.205 -12.884 1.00 0.00 O ATOM 1601 CB VAL B 40 -2.043 1.537 -12.548 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -1.972 3.047 -12.382 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -3.471 1.093 -12.825 1.00 0.00 C ATOM 0 H VAL B 40 -1.833 -0.869 -13.376 1.00 0.00 H new ATOM 0 HA VAL B 40 -1.258 1.711 -14.548 1.00 0.00 H new ATOM 0 HB VAL B 40 -1.718 1.074 -11.616 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.644 3.357 -11.581 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -0.952 3.338 -12.133 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -2.270 3.530 -13.313 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -4.120 1.430 -12.017 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -3.810 1.525 -13.767 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -3.508 0.006 -12.890 1.00 0.00 H new ATOM 1613 N SER B 41 0.852 2.430 -13.179 1.00 0.00 N ATOM 1614 CA SER B 41 2.225 2.679 -12.751 1.00 0.00 C ATOM 1615 C SER B 41 2.441 2.197 -11.321 1.00 0.00 C ATOM 1616 O SER B 41 2.076 2.882 -10.365 1.00 0.00 O ATOM 1617 CB SER B 41 2.554 4.169 -12.857 1.00 0.00 C ATOM 1618 OG SER B 41 1.650 4.832 -13.725 1.00 0.00 O ATOM 0 H SER B 41 0.333 3.267 -13.445 1.00 0.00 H new ATOM 0 HA SER B 41 2.892 2.122 -13.409 1.00 0.00 H new ATOM 0 HB2 SER B 41 2.513 4.625 -11.868 1.00 0.00 H new ATOM 0 HB3 SER B 41 3.573 4.294 -13.224 1.00 0.00 H new ATOM 0 HG SER B 41 0.879 5.152 -13.212 1.00 0.00 H new ATOM 1624 N VAL B 42 3.038 1.018 -11.179 1.00 0.00 N ATOM 1625 CA VAL B 42 3.303 0.450 -9.864 1.00 0.00 C ATOM 1626 C VAL B 42 4.794 0.170 -9.680 1.00 0.00 C ATOM 1627 O VAL B 42 5.394 -0.570 -10.460 1.00 0.00 O ATOM 1628 CB VAL B 42 2.514 -0.858 -9.651 1.00 0.00 C ATOM 1629 CG1 VAL B 42 2.893 -1.890 -10.702 1.00 0.00 C ATOM 1630 CG2 VAL B 42 2.746 -1.405 -8.249 1.00 0.00 C ATOM 0 H VAL B 42 3.347 0.438 -11.959 1.00 0.00 H new ATOM 0 HA VAL B 42 2.980 1.184 -9.126 1.00 0.00 H new ATOM 0 HB VAL B 42 1.452 -0.637 -9.758 1.00 0.00 H new ATOM 0 HG11 VAL B 42 2.326 -2.805 -10.534 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.666 -1.499 -11.694 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.959 -2.106 -10.632 1.00 0.00 H new ATOM 0 HG21 VAL B 42 2.180 -2.328 -8.120 1.00 0.00 H new ATOM 0 HG22 VAL B 42 3.808 -1.608 -8.109 1.00 0.00 H new ATOM 0 HG23 VAL B 42 2.416 -0.672 -7.513 1.00 0.00 H new ATOM 1640 N HIS B 43 5.385 0.755 -8.643 1.00 0.00 N ATOM 1641 CA HIS B 43 6.800 0.557 -8.355 1.00 0.00 C ATOM 1642 C HIS B 43 6.987 0.136 -6.902 1.00 0.00 C ATOM 1643 O HIS B 43 6.363 0.700 -6.003 1.00 0.00 O ATOM 1644 CB HIS B 43 7.587 1.839 -8.637 1.00 0.00 C ATOM 1645 CG HIS B 43 8.894 1.600 -9.327 1.00 0.00 C ATOM 1646 ND1 HIS B 43 9.965 2.462 -9.233 1.00 0.00 N ATOM 1647 CD2 HIS B 43 9.302 0.586 -10.128 1.00 0.00 C ATOM 1648 CE1 HIS B 43 10.974 1.993 -9.944 1.00 0.00 C ATOM 1649 NE2 HIS B 43 10.598 0.855 -10.497 1.00 0.00 N ATOM 0 H HIS B 43 4.904 1.371 -7.987 1.00 0.00 H new ATOM 0 HA HIS B 43 7.179 -0.234 -9.003 1.00 0.00 H new ATOM 0 HB2 HIS B 43 6.977 2.502 -9.251 1.00 0.00 H new ATOM 0 HB3 HIS B 43 7.772 2.357 -7.696 1.00 0.00 H new ATOM 0 HD2 HIS B 43 8.718 -0.273 -10.422 1.00 0.00 H new ATOM 0 HE1 HIS B 43 11.941 2.461 -10.054 1.00 0.00 H new ATOM 0 HE2 HIS B 43 11.176 0.270 -11.101 1.00 0.00 H new ATOM 1657 N ARG B 44 7.841 -0.855 -6.670 1.00 0.00 N ATOM 1658 CA ARG B 44 8.091 -1.338 -5.317 1.00 0.00 C ATOM 1659 C ARG B 44 9.393 -2.131 -5.258 1.00 0.00 C ATOM 1660 O ARG B 44 10.210 -2.071 -6.177 1.00 0.00 O ATOM 1661 CB ARG B 44 6.921 -2.204 -4.841 1.00 0.00 C ATOM 1662 CG ARG B 44 6.230 -1.662 -3.601 1.00 0.00 C ATOM 1663 CD ARG B 44 6.581 -2.473 -2.365 1.00 0.00 C ATOM 1664 NE ARG B 44 7.741 -1.930 -1.664 1.00 0.00 N ATOM 1665 CZ ARG B 44 8.265 -2.471 -0.567 1.00 0.00 C ATOM 1666 NH1 ARG B 44 7.737 -3.570 -0.043 1.00 0.00 N ATOM 1667 NH2 ARG B 44 9.321 -1.912 0.009 1.00 0.00 N ATOM 0 H ARG B 44 8.369 -1.337 -7.397 1.00 0.00 H new ATOM 0 HA ARG B 44 8.185 -0.476 -4.656 1.00 0.00 H new ATOM 0 HB2 ARG B 44 6.191 -2.289 -5.646 1.00 0.00 H new ATOM 0 HB3 ARG B 44 7.285 -3.210 -4.634 1.00 0.00 H new ATOM 0 HG2 ARG B 44 6.518 -0.622 -3.448 1.00 0.00 H new ATOM 0 HG3 ARG B 44 5.150 -1.675 -3.751 1.00 0.00 H new ATOM 0 HD2 ARG B 44 5.726 -2.492 -1.689 1.00 0.00 H new ATOM 0 HD3 ARG B 44 6.782 -3.505 -2.654 1.00 0.00 H new ATOM 0 HE ARG B 44 8.175 -1.086 -2.037 1.00 0.00 H new ATOM 0 HH11 ARG B 44 6.925 -4.005 -0.481 1.00 0.00 H new ATOM 0 HH12 ARG B 44 8.143 -3.980 0.798 1.00 0.00 H new ATOM 0 HH21 ARG B 44 9.731 -1.067 -0.389 1.00 0.00 H new ATOM 0 HH22 ARG B 44 9.723 -2.327 0.850 1.00 0.00 H new ATOM 1681 N GLU B 45 9.581 -2.874 -4.172 1.00 0.00 N ATOM 1682 CA GLU B 45 10.785 -3.678 -3.995 1.00 0.00 C ATOM 1683 C GLU B 45 10.870 -4.774 -5.053 1.00 0.00 C ATOM 1684 O GLU B 45 9.877 -5.436 -5.361 1.00 0.00 O ATOM 1685 CB GLU B 45 10.807 -4.297 -2.595 1.00 0.00 C ATOM 1686 CG GLU B 45 12.138 -4.133 -1.880 1.00 0.00 C ATOM 1687 CD GLU B 45 12.471 -5.315 -0.990 1.00 0.00 C ATOM 1688 OE1 GLU B 45 11.533 -5.918 -0.428 1.00 0.00 O ATOM 1689 OE2 GLU B 45 13.670 -5.637 -0.855 1.00 0.00 O ATOM 0 H GLU B 45 8.915 -2.936 -3.402 1.00 0.00 H new ATOM 0 HA GLU B 45 11.650 -3.024 -4.109 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.021 -3.841 -1.992 1.00 0.00 H new ATOM 0 HB3 GLU B 45 10.574 -5.359 -2.672 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.929 -4.004 -2.618 1.00 0.00 H new ATOM 0 HG3 GLU B 45 12.113 -3.225 -1.278 1.00 0.00 H new ATOM 1696 N GLU B 46 12.062 -4.961 -5.609 1.00 0.00 N ATOM 1697 CA GLU B 46 12.276 -5.977 -6.632 1.00 0.00 C ATOM 1698 C GLU B 46 11.833 -7.350 -6.138 1.00 0.00 C ATOM 1699 O GLU B 46 10.932 -7.962 -6.709 1.00 0.00 O ATOM 1700 CB GLU B 46 13.751 -6.020 -7.037 1.00 0.00 C ATOM 1701 CG GLU B 46 14.013 -6.833 -8.295 1.00 0.00 C ATOM 1702 CD GLU B 46 14.387 -5.967 -9.483 1.00 0.00 C ATOM 1703 OE1 GLU B 46 15.582 -5.636 -9.623 1.00 0.00 O ATOM 1704 OE2 GLU B 46 13.483 -5.622 -10.273 1.00 0.00 O ATOM 0 H GLU B 46 12.894 -4.422 -5.368 1.00 0.00 H new ATOM 0 HA GLU B 46 11.674 -5.713 -7.502 1.00 0.00 H new ATOM 0 HB2 GLU B 46 14.106 -5.001 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU B 46 14.333 -6.439 -6.216 1.00 0.00 H new ATOM 0 HG2 GLU B 46 14.816 -7.545 -8.102 1.00 0.00 H new ATOM 0 HG3 GLU B 46 13.124 -7.414 -8.539 1.00 0.00 H new ATOM 1711 N ILE B 47 12.468 -7.825 -5.071 1.00 0.00 N ATOM 1712 CA ILE B 47 12.138 -9.126 -4.498 1.00 0.00 C ATOM 1713 C ILE B 47 10.658 -9.213 -4.136 1.00 0.00 C ATOM 1714 O ILE B 47 10.023 -10.251 -4.327 1.00 0.00 O ATOM 1715 CB ILE B 47 12.986 -9.416 -3.242 1.00 0.00 C ATOM 1716 CG1 ILE B 47 12.704 -10.826 -2.719 1.00 0.00 C ATOM 1717 CG2 ILE B 47 12.710 -8.379 -2.163 1.00 0.00 C ATOM 1718 CD1 ILE B 47 13.837 -11.404 -1.898 1.00 0.00 C ATOM 0 H ILE B 47 13.215 -7.328 -4.585 1.00 0.00 H new ATOM 0 HA ILE B 47 12.362 -9.873 -5.259 1.00 0.00 H new ATOM 0 HB ILE B 47 14.040 -9.356 -3.515 1.00 0.00 H new ATOM 0 HG12 ILE B 47 11.799 -10.805 -2.111 1.00 0.00 H new ATOM 0 HG13 ILE B 47 12.505 -11.485 -3.564 1.00 0.00 H new ATOM 0 HG21 ILE B 47 13.316 -8.598 -1.284 1.00 0.00 H new ATOM 0 HG22 ILE B 47 12.961 -7.387 -2.539 1.00 0.00 H new ATOM 0 HG23 ILE B 47 11.655 -8.408 -1.892 1.00 0.00 H new ATOM 0 HD11 ILE B 47 13.568 -12.405 -1.560 1.00 0.00 H new ATOM 0 HD12 ILE B 47 14.738 -11.457 -2.509 1.00 0.00 H new ATOM 0 HD13 ILE B 47 14.022 -10.767 -1.033 1.00 0.00 H new ATOM 1730 N TYR B 48 10.112 -8.115 -3.616 1.00 0.00 N ATOM 1731 CA TYR B 48 8.705 -8.066 -3.227 1.00 0.00 C ATOM 1732 C TYR B 48 7.816 -8.650 -4.325 1.00 0.00 C ATOM 1733 O TYR B 48 7.122 -9.644 -4.111 1.00 0.00 O ATOM 1734 CB TYR B 48 8.290 -6.622 -2.917 1.00 0.00 C ATOM 1735 CG TYR B 48 6.796 -6.423 -2.780 1.00 0.00 C ATOM 1736 CD1 TYR B 48 6.093 -6.989 -1.723 1.00 0.00 C ATOM 1737 CD2 TYR B 48 6.090 -5.669 -3.708 1.00 0.00 C ATOM 1738 CE1 TYR B 48 4.729 -6.808 -1.596 1.00 0.00 C ATOM 1739 CE2 TYR B 48 4.726 -5.483 -3.588 1.00 0.00 C ATOM 1740 CZ TYR B 48 4.051 -6.054 -2.531 1.00 0.00 C ATOM 1741 OH TYR B 48 2.693 -5.872 -2.407 1.00 0.00 O ATOM 0 H TYR B 48 10.623 -7.247 -3.455 1.00 0.00 H new ATOM 0 HA TYR B 48 8.577 -8.670 -2.328 1.00 0.00 H new ATOM 0 HB2 TYR B 48 8.774 -6.307 -1.992 1.00 0.00 H new ATOM 0 HB3 TYR B 48 8.661 -5.971 -3.709 1.00 0.00 H new ATOM 0 HD1 TYR B 48 6.621 -7.580 -0.989 1.00 0.00 H new ATOM 0 HD2 TYR B 48 6.616 -5.220 -4.538 1.00 0.00 H new ATOM 0 HE1 TYR B 48 4.197 -7.254 -0.769 1.00 0.00 H new ATOM 0 HE2 TYR B 48 4.192 -4.893 -4.319 1.00 0.00 H new ATOM 0 HH TYR B 48 2.445 -5.893 -1.459 1.00 0.00 H new ATOM 1751 N GLN B 49 7.838 -8.025 -5.496 1.00 0.00 N ATOM 1752 CA GLN B 49 7.028 -8.488 -6.618 1.00 0.00 C ATOM 1753 C GLN B 49 7.635 -9.729 -7.271 1.00 0.00 C ATOM 1754 O GLN B 49 6.938 -10.481 -7.951 1.00 0.00 O ATOM 1755 CB GLN B 49 6.876 -7.375 -7.656 1.00 0.00 C ATOM 1756 CG GLN B 49 8.202 -6.807 -8.138 1.00 0.00 C ATOM 1757 CD GLN B 49 8.360 -6.891 -9.644 1.00 0.00 C ATOM 1758 OE1 GLN B 49 8.309 -5.878 -10.342 1.00 0.00 O ATOM 1759 NE2 GLN B 49 8.551 -8.102 -10.152 1.00 0.00 N ATOM 0 H GLN B 49 8.405 -7.200 -5.694 1.00 0.00 H new ATOM 0 HA GLN B 49 6.045 -8.756 -6.230 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.323 -7.761 -8.512 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.279 -6.569 -7.228 1.00 0.00 H new ATOM 0 HG2 GLN B 49 8.282 -5.766 -7.826 1.00 0.00 H new ATOM 0 HG3 GLN B 49 9.019 -7.347 -7.660 1.00 0.00 H new ATOM 0 HE21 GLN B 49 8.586 -8.914 -9.536 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.662 -8.221 -11.159 1.00 0.00 H new ATOM 1768 N ARG B 50 8.934 -9.941 -7.066 1.00 0.00 N ATOM 1769 CA ARG B 50 9.618 -11.092 -7.645 1.00 0.00 C ATOM 1770 C ARG B 50 9.245 -12.388 -6.925 1.00 0.00 C ATOM 1771 O ARG B 50 9.566 -13.479 -7.394 1.00 0.00 O ATOM 1772 CB ARG B 50 11.135 -10.895 -7.601 1.00 0.00 C ATOM 1773 CG ARG B 50 11.864 -11.533 -8.771 1.00 0.00 C ATOM 1774 CD ARG B 50 11.725 -10.698 -10.034 1.00 0.00 C ATOM 1775 NE ARG B 50 12.272 -11.378 -11.205 1.00 0.00 N ATOM 1776 CZ ARG B 50 12.435 -10.797 -12.392 1.00 0.00 C ATOM 1777 NH1 ARG B 50 12.097 -9.525 -12.568 1.00 0.00 N ATOM 1778 NH2 ARG B 50 12.939 -11.489 -13.404 1.00 0.00 N ATOM 0 H ARG B 50 9.530 -9.332 -6.505 1.00 0.00 H new ATOM 0 HA ARG B 50 9.296 -11.173 -8.683 1.00 0.00 H new ATOM 0 HB2 ARG B 50 11.354 -9.827 -7.585 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.521 -11.313 -6.671 1.00 0.00 H new ATOM 0 HG2 ARG B 50 12.919 -11.649 -8.524 1.00 0.00 H new ATOM 0 HG3 ARG B 50 11.466 -12.532 -8.948 1.00 0.00 H new ATOM 0 HD2 ARG B 50 10.672 -10.473 -10.205 1.00 0.00 H new ATOM 0 HD3 ARG B 50 12.237 -9.745 -9.896 1.00 0.00 H new ATOM 0 HE ARG B 50 12.545 -12.356 -11.108 1.00 0.00 H new ATOM 0 HH11 ARG B 50 11.710 -8.988 -11.792 1.00 0.00 H new ATOM 0 HH12 ARG B 50 12.224 -9.085 -13.479 1.00 0.00 H new ATOM 0 HH21 ARG B 50 13.202 -12.466 -13.273 1.00 0.00 H new ATOM 0 HH22 ARG B 50 13.064 -11.045 -14.314 1.00 0.00 H new ATOM 1792 N ILE B 51 8.569 -12.266 -5.785 1.00 0.00 N ATOM 1793 CA ILE B 51 8.160 -13.436 -5.016 1.00 0.00 C ATOM 1794 C ILE B 51 6.640 -13.570 -4.983 1.00 0.00 C ATOM 1795 O ILE B 51 6.107 -14.674 -4.876 1.00 0.00 O ATOM 1796 CB ILE B 51 8.697 -13.382 -3.571 1.00 0.00 C ATOM 1797 CG1 ILE B 51 8.158 -12.150 -2.838 1.00 0.00 C ATOM 1798 CG2 ILE B 51 10.218 -13.380 -3.573 1.00 0.00 C ATOM 1799 CD1 ILE B 51 7.655 -12.449 -1.442 1.00 0.00 C ATOM 0 H ILE B 51 8.294 -11.373 -5.376 1.00 0.00 H new ATOM 0 HA ILE B 51 8.586 -14.306 -5.516 1.00 0.00 H new ATOM 0 HB ILE B 51 8.351 -14.270 -3.042 1.00 0.00 H new ATOM 0 HG12 ILE B 51 8.946 -11.399 -2.778 1.00 0.00 H new ATOM 0 HG13 ILE B 51 7.347 -11.715 -3.422 1.00 0.00 H new ATOM 0 HG21 ILE B 51 10.583 -13.342 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE B 51 10.582 -14.288 -4.054 1.00 0.00 H new ATOM 0 HG23 ILE B 51 10.580 -12.509 -4.120 1.00 0.00 H new ATOM 0 HD11 ILE B 51 7.288 -11.531 -0.983 1.00 0.00 H new ATOM 0 HD12 ILE B 51 6.845 -13.177 -1.495 1.00 0.00 H new ATOM 0 HD13 ILE B 51 8.469 -12.855 -0.841 1.00 0.00 H new ATOM 1811 N GLN B 52 5.947 -12.439 -5.079 1.00 0.00 N ATOM 1812 CA GLN B 52 4.489 -12.432 -5.063 1.00 0.00 C ATOM 1813 C GLN B 52 3.934 -12.189 -6.463 1.00 0.00 C ATOM 1814 O GLN B 52 3.130 -12.972 -6.968 1.00 0.00 O ATOM 1815 CB GLN B 52 3.973 -11.359 -4.102 1.00 0.00 C ATOM 1816 CG GLN B 52 3.857 -11.836 -2.664 1.00 0.00 C ATOM 1817 CD GLN B 52 2.998 -13.078 -2.530 1.00 0.00 C ATOM 1818 OE1 GLN B 52 1.780 -12.991 -2.376 1.00 0.00 O ATOM 1819 NE2 GLN B 52 3.631 -14.244 -2.588 1.00 0.00 N ATOM 0 H GLN B 52 6.372 -11.516 -5.169 1.00 0.00 H new ATOM 0 HA GLN B 52 4.148 -13.409 -4.720 1.00 0.00 H new ATOM 0 HB2 GLN B 52 4.642 -10.499 -4.138 1.00 0.00 H new ATOM 0 HB3 GLN B 52 2.996 -11.017 -4.443 1.00 0.00 H new ATOM 0 HG2 GLN B 52 4.853 -12.043 -2.272 1.00 0.00 H new ATOM 0 HG3 GLN B 52 3.434 -11.038 -2.053 1.00 0.00 H new ATOM 0 HE21 GLN B 52 4.643 -14.269 -2.717 1.00 0.00 H new ATOM 0 HE22 GLN B 52 3.106 -15.114 -2.504 1.00 0.00 H new ATOM 1828 N ALA B 53 4.375 -11.101 -7.086 1.00 0.00 N ATOM 1829 CA ALA B 53 3.928 -10.758 -8.429 1.00 0.00 C ATOM 1830 C ALA B 53 4.330 -11.840 -9.424 1.00 0.00 C ATOM 1831 O ALA B 53 3.478 -12.527 -9.988 1.00 0.00 O ATOM 1832 CB ALA B 53 4.501 -9.412 -8.849 1.00 0.00 C ATOM 0 H ALA B 53 5.041 -10.443 -6.682 1.00 0.00 H new ATOM 0 HA ALA B 53 2.840 -10.688 -8.421 1.00 0.00 H new ATOM 0 HB1 ALA B 53 4.159 -9.169 -9.855 1.00 0.00 H new ATOM 0 HB2 ALA B 53 4.166 -8.641 -8.155 1.00 0.00 H new ATOM 0 HB3 ALA B 53 5.590 -9.461 -8.838 1.00 0.00 H new ATOM 1838 N GLU B 54 5.634 -11.991 -9.626 1.00 0.00 N ATOM 1839 CA GLU B 54 6.155 -12.994 -10.544 1.00 0.00 C ATOM 1840 C GLU B 54 6.865 -14.104 -9.777 1.00 0.00 C ATOM 1841 O GLU B 54 7.863 -13.862 -9.100 1.00 0.00 O ATOM 1842 CB GLU B 54 7.119 -12.352 -11.544 1.00 0.00 C ATOM 1843 CG GLU B 54 6.431 -11.473 -12.575 1.00 0.00 C ATOM 1844 CD GLU B 54 6.374 -12.118 -13.946 1.00 0.00 C ATOM 1845 OE1 GLU B 54 5.781 -13.211 -14.064 1.00 0.00 O ATOM 1846 OE2 GLU B 54 6.922 -11.531 -14.902 1.00 0.00 O ATOM 0 H GLU B 54 6.350 -11.430 -9.165 1.00 0.00 H new ATOM 0 HA GLU B 54 5.316 -13.426 -11.090 1.00 0.00 H new ATOM 0 HB2 GLU B 54 7.850 -11.754 -10.999 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.671 -13.138 -12.059 1.00 0.00 H new ATOM 0 HG2 GLU B 54 5.418 -11.251 -12.240 1.00 0.00 H new ATOM 0 HG3 GLU B 54 6.959 -10.522 -12.647 1.00 0.00 H new ATOM 1853 N LYS B 55 6.349 -15.321 -9.892 1.00 0.00 N ATOM 1854 CA LYS B 55 6.942 -16.466 -9.211 1.00 0.00 C ATOM 1855 C LYS B 55 8.339 -16.743 -9.753 1.00 0.00 C ATOM 1856 O LYS B 55 8.497 -17.425 -10.765 1.00 0.00 O ATOM 1857 CB LYS B 55 6.059 -17.704 -9.382 1.00 0.00 C ATOM 1858 CG LYS B 55 6.058 -18.621 -8.170 1.00 0.00 C ATOM 1859 CD LYS B 55 4.828 -18.400 -7.304 1.00 0.00 C ATOM 1860 CE LYS B 55 4.980 -19.056 -5.942 1.00 0.00 C ATOM 1861 NZ LYS B 55 4.835 -20.536 -6.018 1.00 0.00 N ATOM 0 H LYS B 55 5.523 -15.541 -10.449 1.00 0.00 H new ATOM 0 HA LYS B 55 7.018 -16.232 -8.149 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.037 -17.386 -9.588 1.00 0.00 H new ATOM 0 HB3 LYS B 55 6.399 -18.266 -10.252 1.00 0.00 H new ATOM 0 HG2 LYS B 55 6.091 -19.660 -8.499 1.00 0.00 H new ATOM 0 HG3 LYS B 55 6.957 -18.445 -7.579 1.00 0.00 H new ATOM 0 HD2 LYS B 55 4.659 -17.331 -7.177 1.00 0.00 H new ATOM 0 HD3 LYS B 55 3.950 -18.804 -7.808 1.00 0.00 H new ATOM 0 HE2 LYS B 55 5.957 -18.808 -5.527 1.00 0.00 H new ATOM 0 HE3 LYS B 55 4.232 -18.653 -5.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 4.945 -20.945 -5.068 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 3.893 -20.774 -6.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 5.565 -20.924 -6.649 1.00 0.00 H new ATOM 1875 N SER B 56 9.351 -16.207 -9.074 1.00 0.00 N ATOM 1876 CA SER B 56 10.739 -16.393 -9.490 1.00 0.00 C ATOM 1877 C SER B 56 11.008 -15.675 -10.810 1.00 0.00 C ATOM 1878 O SER B 56 11.733 -14.681 -10.852 1.00 0.00 O ATOM 1879 CB SER B 56 11.064 -17.884 -9.625 1.00 0.00 C ATOM 1880 OG SER B 56 11.848 -18.335 -8.534 1.00 0.00 O ATOM 0 H SER B 56 9.236 -15.641 -8.234 1.00 0.00 H new ATOM 0 HA SER B 56 11.383 -15.962 -8.724 1.00 0.00 H new ATOM 0 HB2 SER B 56 10.139 -18.458 -9.674 1.00 0.00 H new ATOM 0 HB3 SER B 56 11.598 -18.060 -10.559 1.00 0.00 H new ATOM 0 HG SER B 56 12.041 -19.290 -8.642 1.00 0.00 H new ATOM 1886 N GLN B 57 10.415 -16.185 -11.886 1.00 0.00 N ATOM 1887 CA GLN B 57 10.583 -15.596 -13.210 1.00 0.00 C ATOM 1888 C GLN B 57 12.013 -15.776 -13.714 1.00 0.00 C ATOM 1889 O GLN B 57 12.725 -14.803 -13.963 1.00 0.00 O ATOM 1890 CB GLN B 57 10.214 -14.109 -13.183 1.00 0.00 C ATOM 1891 CG GLN B 57 9.404 -13.661 -14.389 1.00 0.00 C ATOM 1892 CD GLN B 57 10.276 -13.274 -15.566 1.00 0.00 C ATOM 1893 OE1 GLN B 57 10.867 -14.130 -16.225 1.00 0.00 O ATOM 1894 NE2 GLN B 57 10.361 -11.976 -15.838 1.00 0.00 N ATOM 0 H GLN B 57 9.812 -17.008 -11.866 1.00 0.00 H new ATOM 0 HA GLN B 57 9.913 -16.114 -13.897 1.00 0.00 H new ATOM 0 HB2 GLN B 57 9.646 -13.901 -12.276 1.00 0.00 H new ATOM 0 HB3 GLN B 57 11.128 -13.517 -13.129 1.00 0.00 H new ATOM 0 HG2 GLN B 57 8.731 -14.464 -14.689 1.00 0.00 H new ATOM 0 HG3 GLN B 57 8.781 -12.812 -14.108 1.00 0.00 H new ATOM 0 HE21 GLN B 57 9.854 -11.301 -15.266 1.00 0.00 H new ATOM 0 HE22 GLN B 57 10.933 -11.655 -16.619 1.00 0.00 H new ATOM 1903 N GLN B 58 12.427 -17.032 -13.865 1.00 0.00 N ATOM 1904 CA GLN B 58 13.771 -17.347 -14.341 1.00 0.00 C ATOM 1905 C GLN B 58 14.820 -17.000 -13.289 1.00 0.00 C ATOM 1906 O GLN B 58 14.839 -15.890 -12.758 1.00 0.00 O ATOM 1907 CB GLN B 58 14.069 -16.599 -15.643 1.00 0.00 C ATOM 1908 CG GLN B 58 15.271 -17.145 -16.396 1.00 0.00 C ATOM 1909 CD GLN B 58 16.060 -16.059 -17.100 1.00 0.00 C ATOM 1910 OE1 GLN B 58 15.685 -15.604 -18.181 1.00 0.00 O ATOM 1911 NE2 GLN B 58 17.163 -15.638 -16.491 1.00 0.00 N ATOM 0 H GLN B 58 11.850 -17.849 -13.664 1.00 0.00 H new ATOM 0 HA GLN B 58 13.815 -18.419 -14.531 1.00 0.00 H new ATOM 0 HB2 GLN B 58 13.193 -16.648 -16.289 1.00 0.00 H new ATOM 0 HB3 GLN B 58 14.240 -15.546 -15.417 1.00 0.00 H new ATOM 0 HG2 GLN B 58 15.924 -17.670 -15.699 1.00 0.00 H new ATOM 0 HG3 GLN B 58 14.934 -17.877 -17.129 1.00 0.00 H new ATOM 0 HE21 GLN B 58 17.437 -16.042 -15.596 1.00 0.00 H new ATOM 0 HE22 GLN B 58 17.736 -14.910 -16.919 1.00 0.00 H new ATOM 1920 N SER B 59 15.692 -17.960 -12.995 1.00 0.00 N ATOM 1921 CA SER B 59 16.747 -17.761 -12.009 1.00 0.00 C ATOM 1922 C SER B 59 17.850 -18.801 -12.181 1.00 0.00 C ATOM 1923 O SER B 59 17.595 -20.004 -12.130 1.00 0.00 O ATOM 1924 CB SER B 59 16.173 -17.839 -10.593 1.00 0.00 C ATOM 1925 OG SER B 59 15.856 -19.175 -10.243 1.00 0.00 O ATOM 0 H SER B 59 15.688 -18.884 -13.427 1.00 0.00 H new ATOM 0 HA SER B 59 17.175 -16.771 -12.164 1.00 0.00 H new ATOM 0 HB2 SER B 59 16.894 -17.435 -9.882 1.00 0.00 H new ATOM 0 HB3 SER B 59 15.278 -17.220 -10.526 1.00 0.00 H new ATOM 0 HG SER B 59 16.310 -19.790 -10.856 1.00 0.00 H new ATOM 1931 N SER B 60 19.074 -18.330 -12.392 1.00 0.00 N ATOM 1932 CA SER B 60 20.213 -19.222 -12.578 1.00 0.00 C ATOM 1933 C SER B 60 20.906 -19.511 -11.250 1.00 0.00 C ATOM 1934 O SER B 60 21.270 -18.594 -10.514 1.00 0.00 O ATOM 1935 CB SER B 60 21.211 -18.609 -13.563 1.00 0.00 C ATOM 1936 OG SER B 60 21.810 -17.444 -13.023 1.00 0.00 O ATOM 0 H SER B 60 19.303 -17.337 -12.439 1.00 0.00 H new ATOM 0 HA SER B 60 19.841 -20.163 -12.983 1.00 0.00 H new ATOM 0 HB2 SER B 60 21.983 -19.340 -13.806 1.00 0.00 H new ATOM 0 HB3 SER B 60 20.702 -18.362 -14.495 1.00 0.00 H new ATOM 0 HG SER B 60 22.445 -17.072 -13.671 1.00 0.00 H new ATOM 1942 N TYR B 61 21.083 -20.794 -10.953 1.00 0.00 N ATOM 1943 CA TYR B 61 21.732 -21.212 -9.715 1.00 0.00 C ATOM 1944 C TYR B 61 23.008 -21.996 -10.007 1.00 0.00 C ATOM 1945 O TYR B 61 24.010 -21.781 -9.294 1.00 0.00 O ATOM 1946 CB TYR B 61 20.778 -22.063 -8.876 1.00 0.00 C ATOM 1947 CG TYR B 61 19.756 -21.252 -8.111 1.00 0.00 C ATOM 1948 CD1 TYR B 61 20.147 -20.200 -7.293 1.00 0.00 C ATOM 1949 CD2 TYR B 61 18.400 -21.538 -8.208 1.00 0.00 C ATOM 1950 CE1 TYR B 61 19.217 -19.456 -6.592 1.00 0.00 C ATOM 1951 CE2 TYR B 61 17.463 -20.799 -7.511 1.00 0.00 C ATOM 1952 CZ TYR B 61 17.876 -19.760 -6.705 1.00 0.00 C ATOM 1953 OH TYR B 61 16.946 -19.022 -6.009 1.00 0.00 O ATOM 1954 OXT TYR B 61 22.993 -22.819 -10.946 1.00 0.00 O ATOM 0 H TYR B 61 20.786 -21.563 -11.553 1.00 0.00 H new ATOM 0 HA TYR B 61 21.998 -20.316 -9.154 1.00 0.00 H new ATOM 0 HB2 TYR B 61 20.258 -22.763 -9.530 1.00 0.00 H new ATOM 0 HB3 TYR B 61 21.359 -22.657 -8.171 1.00 0.00 H new ATOM 0 HD1 TYR B 61 21.196 -19.959 -7.203 1.00 0.00 H new ATOM 0 HD2 TYR B 61 18.073 -22.351 -8.839 1.00 0.00 H new ATOM 0 HE1 TYR B 61 19.538 -18.642 -5.960 1.00 0.00 H new ATOM 0 HE2 TYR B 61 16.413 -21.034 -7.597 1.00 0.00 H new ATOM 0 HH TYR B 61 16.048 -19.364 -6.199 1.00 0.00 H new TER 1964 TYR B 61