USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 980 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 LYS NZ :NH3+ 155:sc= 2.08 (180deg=1.24) USER MOD Set 1.2: B 686 GLN : amide:sc= -0.152! K(o=1.9!,f=-1) USER MOD Set 2.1: A 55 THR OG1 : rot 120:sc= 0.9 USER MOD Set 2.2: A 57 SER OG : rot -85:sc= 1.2 USER MOD Set 3.1: A 7 THR OG1 : rot 117:sc= 1.35 USER MOD Set 3.2: A 9 THR OG1 : rot 150:sc= 0.0514 USER MOD Single : A 1 MET CE :methyl -172:sc= -0.361 (180deg=-0.524) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0.904 (180deg=0.872) USER MOD Single : A 2 GLN : amide:sc= -0.0325 X(o=-0.032,f=0.0034) USER MOD Single : A 11 LYS NZ :NH3+ -152:sc= 1.65 (180deg=0.79) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0836 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.018 USER MOD Single : A 25 ASN : amide:sc= -0.946! X(o=-0.95!,f=-0.86) USER MOD Single : A 27 LYS NZ :NH3+ -120:sc= 0.987 (180deg=0.185) USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0.957 (180deg=0.953) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 33 LYS NZ :NH3+ -165:sc= 0.908 (180deg=0.777) USER MOD Single : A 40 GLN : amide:sc= 0.435 K(o=0.43,f=-4.9!) USER MOD Single : A 41 GLN : amide:sc= 1.12 K(o=1.1,f=-5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 2.18 K(o=2.2,f=-7.8!) USER MOD Single : A 59 TYR OH : rot 60:sc= -0.741 USER MOD Single : A 60 ASN : amide:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.479 X(o=0.48,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 163:sc= 1.28 (180deg=0.999) USER MOD Single : A 65 SER OG : rot 57:sc= 1.17 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.187 K(o=-0.19,f=-1) USER MOD Single : B -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -2 HIS : no HD1:sc= -0.194 X(o=-0.19,f=-0.49) USER MOD Single : B -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0.00461 USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.105 X(o=-0.11,f=-0.19) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -86:sc= 0.782 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD Single : B 711 HIS : no HD1:sc= -0.0713 X(o=-0.071,f=-0.071) USER MOD Single : B 714 HIS : no HD1:sc= 0 K(o=0,f=-1.8) USER MOD Single : B 715 LYS NZ :NH3+ -166:sc= 1.24 (180deg=1.15) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.186 1.996 0.421 1.00 0.00 N ATOM 2 CA MET A 1 2.033 1.906 -0.816 1.00 0.00 C ATOM 3 C MET A 1 1.773 3.080 -1.756 1.00 0.00 C ATOM 4 O MET A 1 0.775 3.757 -1.578 1.00 0.00 O ATOM 5 CB MET A 1 1.848 0.574 -1.589 1.00 0.00 C ATOM 6 CG MET A 1 0.512 0.337 -2.315 1.00 0.00 C ATOM 7 SD MET A 1 0.365 -1.323 -3.030 1.00 0.00 S ATOM 8 CE MET A 1 -0.787 -1.065 -4.411 1.00 0.00 C ATOM 0 H1 MET A 1 1.297 1.127 0.982 1.00 0.00 H new ATOM 0 H2 MET A 1 1.485 2.815 0.988 1.00 0.00 H new ATOM 0 H3 MET A 1 0.188 2.108 0.151 1.00 0.00 H new ATOM 0 HA MET A 1 3.064 1.942 -0.465 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.646 0.504 -2.328 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.994 -0.244 -0.884 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.307 0.496 -1.614 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.402 1.077 -3.108 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.066 -2.029 -4.837 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.680 -0.555 -4.049 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.307 -0.456 -5.177 1.00 0.00 H new ATOM 20 N GLN A 2 2.556 3.259 -2.829 1.00 0.00 N ATOM 21 CA GLN A 2 2.266 4.280 -3.851 1.00 0.00 C ATOM 22 C GLN A 2 2.218 3.672 -5.236 1.00 0.00 C ATOM 23 O GLN A 2 2.881 2.658 -5.465 1.00 0.00 O ATOM 24 CB GLN A 2 3.252 5.473 -3.751 1.00 0.00 C ATOM 25 CG GLN A 2 4.549 5.422 -4.583 1.00 0.00 C ATOM 26 CD GLN A 2 5.576 4.512 -3.932 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.476 4.932 -3.213 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.400 3.227 -4.163 1.00 0.00 N ATOM 0 H GLN A 2 3.396 2.711 -3.014 1.00 0.00 H new ATOM 0 HA GLN A 2 1.272 4.684 -3.656 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.711 6.376 -4.034 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.533 5.585 -2.704 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.327 5.065 -5.589 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.960 6.426 -4.685 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.639 2.917 -4.767 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.025 2.542 -3.737 1.00 0.00 H new ATOM 37 N ILE A 3 1.539 4.331 -6.167 1.00 0.00 N ATOM 38 CA ILE A 3 1.501 3.941 -7.579 1.00 0.00 C ATOM 39 C ILE A 3 1.615 5.190 -8.429 1.00 0.00 C ATOM 40 O ILE A 3 1.320 6.286 -7.964 1.00 0.00 O ATOM 41 CB ILE A 3 0.217 3.144 -7.879 1.00 0.00 C ATOM 42 CG1 ILE A 3 -1.032 3.917 -7.407 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.327 1.746 -7.237 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.287 3.571 -8.201 1.00 0.00 C ATOM 0 H ILE A 3 0.989 5.165 -5.963 1.00 0.00 H new ATOM 0 HA ILE A 3 2.339 3.285 -7.817 1.00 0.00 H new ATOM 0 HB ILE A 3 0.105 3.013 -8.955 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.207 3.704 -6.352 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.842 4.987 -7.489 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.579 1.177 -7.446 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.188 1.222 -7.652 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.450 1.849 -6.159 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.129 4.148 -7.820 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.130 3.810 -9.253 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.500 2.507 -8.099 1.00 0.00 H new ATOM 56 N PHE A 4 2.043 5.003 -9.664 1.00 0.00 N ATOM 57 CA PHE A 4 2.428 6.051 -10.592 1.00 0.00 C ATOM 58 C PHE A 4 1.413 6.101 -11.718 1.00 0.00 C ATOM 59 O PHE A 4 1.450 5.310 -12.649 1.00 0.00 O ATOM 60 CB PHE A 4 3.841 5.756 -11.112 1.00 0.00 C ATOM 61 CG PHE A 4 4.840 5.222 -10.110 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.092 5.948 -8.939 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.549 4.033 -10.356 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.015 5.477 -7.990 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.521 3.608 -9.439 1.00 0.00 C ATOM 66 CZ PHE A 4 6.754 4.318 -8.253 1.00 0.00 C ATOM 0 H PHE A 4 2.136 4.071 -10.067 1.00 0.00 H new ATOM 0 HA PHE A 4 2.443 7.025 -10.103 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.760 5.036 -11.927 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.245 6.675 -11.537 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.572 6.878 -8.764 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.347 3.452 -11.244 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.154 6.008 -7.060 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.099 2.720 -9.650 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.497 3.974 -7.549 1.00 0.00 H new ATOM 76 N VAL A 5 0.452 7.001 -11.649 1.00 0.00 N ATOM 77 CA VAL A 5 -0.562 7.097 -12.699 1.00 0.00 C ATOM 78 C VAL A 5 0.034 8.012 -13.756 1.00 0.00 C ATOM 79 O VAL A 5 0.097 9.224 -13.576 1.00 0.00 O ATOM 80 CB VAL A 5 -1.906 7.556 -12.130 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.984 7.588 -13.225 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.345 6.616 -11.002 1.00 0.00 C ATOM 0 H VAL A 5 0.346 7.673 -10.889 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.800 6.135 -13.152 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.782 8.565 -11.736 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.930 7.917 -12.795 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.683 8.279 -14.012 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.105 6.590 -13.646 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.303 6.950 -10.602 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.447 5.603 -11.392 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.598 6.626 -10.209 1.00 0.00 H new ATOM 92 N LYS A 6 0.546 7.440 -14.840 1.00 0.00 N ATOM 93 CA LYS A 6 1.054 8.219 -15.952 1.00 0.00 C ATOM 94 C LYS A 6 -0.163 8.812 -16.639 1.00 0.00 C ATOM 95 O LYS A 6 -1.054 8.062 -17.050 1.00 0.00 O ATOM 96 CB LYS A 6 1.904 7.301 -16.852 1.00 0.00 C ATOM 97 CG LYS A 6 2.674 8.145 -17.877 1.00 0.00 C ATOM 98 CD LYS A 6 3.660 7.371 -18.767 1.00 0.00 C ATOM 99 CE LYS A 6 4.588 8.336 -19.536 1.00 0.00 C ATOM 100 NZ LYS A 6 5.566 7.618 -20.402 1.00 0.00 N ATOM 0 H LYS A 6 0.618 6.431 -14.968 1.00 0.00 H new ATOM 0 HA LYS A 6 1.714 9.035 -15.656 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.602 6.725 -16.244 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.263 6.585 -17.366 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.953 8.652 -18.519 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.225 8.919 -17.343 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.258 6.698 -18.153 1.00 0.00 H new ATOM 0 HD3 LYS A 6 3.108 6.751 -19.474 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.984 9.003 -20.151 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.128 8.960 -18.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 5.860 8.239 -21.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.399 7.352 -19.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.123 6.761 -20.790 1.00 0.00 H new ATOM 114 N THR A 7 -0.244 10.133 -16.761 1.00 0.00 N ATOM 115 CA THR A 7 -1.280 10.696 -17.600 1.00 0.00 C ATOM 116 C THR A 7 -0.975 10.358 -19.037 1.00 0.00 C ATOM 117 O THR A 7 0.139 9.987 -19.384 1.00 0.00 O ATOM 118 CB THR A 7 -1.484 12.192 -17.389 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.270 12.855 -17.620 1.00 0.00 O ATOM 120 CG2 THR A 7 -1.983 12.422 -15.977 1.00 0.00 C ATOM 0 H THR A 7 0.372 10.807 -16.306 1.00 0.00 H new ATOM 0 HA THR A 7 -2.232 10.249 -17.315 1.00 0.00 H new ATOM 0 HB THR A 7 -2.225 12.586 -18.084 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.369 13.462 -18.383 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.133 13.489 -15.813 1.00 0.00 H new ATOM 0 HG22 THR A 7 -2.928 11.897 -15.835 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.248 12.046 -15.266 1.00 0.00 H new ATOM 128 N LEU A 8 -1.967 10.517 -19.888 1.00 0.00 N ATOM 129 CA LEU A 8 -1.792 10.382 -21.317 1.00 0.00 C ATOM 130 C LEU A 8 -0.785 11.430 -21.878 1.00 0.00 C ATOM 131 O LEU A 8 -0.378 11.254 -23.016 1.00 0.00 O ATOM 132 CB LEU A 8 -3.200 10.400 -21.933 1.00 0.00 C ATOM 133 CG LEU A 8 -3.829 9.115 -22.458 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.285 9.341 -22.881 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.133 8.625 -23.714 1.00 0.00 C ATOM 0 H LEU A 8 -2.920 10.744 -19.606 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.319 9.440 -21.592 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.876 10.805 -21.180 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.181 11.110 -22.759 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.745 8.397 -21.642 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.706 8.406 -23.251 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.864 9.685 -22.024 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.322 10.093 -23.669 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.609 7.707 -24.059 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.206 9.386 -24.491 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.083 8.429 -23.495 1.00 0.00 H new ATOM 147 N THR A 9 -0.380 12.522 -21.192 1.00 0.00 N ATOM 148 CA THR A 9 0.766 13.363 -21.632 1.00 0.00 C ATOM 149 C THR A 9 2.048 12.732 -21.131 1.00 0.00 C ATOM 150 O THR A 9 3.121 12.855 -21.718 1.00 0.00 O ATOM 151 CB THR A 9 0.807 14.763 -20.988 1.00 0.00 C ATOM 152 OG1 THR A 9 0.151 14.702 -19.739 1.00 0.00 O ATOM 153 CG2 THR A 9 0.287 15.897 -21.863 1.00 0.00 C ATOM 0 H THR A 9 -0.826 12.845 -20.333 1.00 0.00 H new ATOM 0 HA THR A 9 0.659 13.439 -22.714 1.00 0.00 H new ATOM 0 HB THR A 9 1.857 15.024 -20.852 1.00 0.00 H new ATOM 0 HG1 THR A 9 0.547 15.359 -19.129 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.359 16.839 -21.319 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.884 15.958 -22.773 1.00 0.00 H new ATOM 0 HG23 THR A 9 -0.754 15.707 -22.124 1.00 0.00 H new ATOM 161 N GLY A 10 1.931 12.118 -19.963 1.00 0.00 N ATOM 162 CA GLY A 10 3.010 11.484 -19.282 1.00 0.00 C ATOM 163 C GLY A 10 3.453 12.271 -18.063 1.00 0.00 C ATOM 164 O GLY A 10 4.614 12.191 -17.671 1.00 0.00 O ATOM 0 H GLY A 10 1.046 12.055 -19.461 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.708 10.482 -18.977 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.852 11.369 -19.965 1.00 0.00 H new ATOM 168 N LYS A 11 2.533 13.043 -17.477 1.00 0.00 N ATOM 169 CA LYS A 11 2.767 13.650 -16.184 1.00 0.00 C ATOM 170 C LYS A 11 2.415 12.543 -15.228 1.00 0.00 C ATOM 171 O LYS A 11 1.240 12.243 -15.028 1.00 0.00 O ATOM 172 CB LYS A 11 1.904 14.896 -15.983 1.00 0.00 C ATOM 173 CG LYS A 11 2.047 15.459 -14.551 1.00 0.00 C ATOM 174 CD LYS A 11 1.084 14.957 -13.463 1.00 0.00 C ATOM 175 CE LYS A 11 -0.359 14.678 -13.900 1.00 0.00 C ATOM 176 NZ LYS A 11 -1.121 15.860 -14.346 1.00 0.00 N ATOM 0 H LYS A 11 1.623 13.256 -17.885 1.00 0.00 H new ATOM 0 HA LYS A 11 3.787 14.011 -16.050 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.192 15.660 -16.706 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.860 14.652 -16.176 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.063 15.253 -14.214 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.944 16.543 -14.610 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.495 14.040 -13.040 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.061 15.695 -12.661 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.342 13.950 -14.711 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.891 14.216 -13.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.134 15.707 -14.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.800 16.698 -13.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.966 16.009 -15.364 1.00 0.00 H new ATOM 190 N THR A 12 3.410 11.859 -14.715 1.00 0.00 N ATOM 191 CA THR A 12 3.167 10.766 -13.808 1.00 0.00 C ATOM 192 C THR A 12 2.782 11.368 -12.464 1.00 0.00 C ATOM 193 O THR A 12 3.589 12.037 -11.817 1.00 0.00 O ATOM 194 CB THR A 12 4.407 9.876 -13.808 1.00 0.00 C ATOM 195 OG1 THR A 12 4.882 9.704 -15.135 1.00 0.00 O ATOM 196 CG2 THR A 12 4.037 8.501 -13.282 1.00 0.00 C ATOM 0 H THR A 12 4.394 12.041 -14.911 1.00 0.00 H new ATOM 0 HA THR A 12 2.340 10.117 -14.096 1.00 0.00 H new ATOM 0 HB THR A 12 5.170 10.345 -13.186 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.679 9.133 -15.126 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.920 7.862 -13.280 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.653 8.591 -12.266 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.272 8.061 -13.921 1.00 0.00 H new ATOM 204 N ILE A 13 1.517 11.169 -12.089 1.00 0.00 N ATOM 205 CA ILE A 13 1.006 11.575 -10.796 1.00 0.00 C ATOM 206 C ILE A 13 1.147 10.349 -9.922 1.00 0.00 C ATOM 207 O ILE A 13 0.499 9.335 -10.161 1.00 0.00 O ATOM 208 CB ILE A 13 -0.432 12.147 -10.867 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.240 12.001 -9.552 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.315 11.736 -12.045 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.440 11.030 -9.530 1.00 0.00 C ATOM 0 H ILE A 13 0.821 10.718 -12.683 1.00 0.00 H new ATOM 0 HA ILE A 13 1.565 12.412 -10.378 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.188 13.195 -11.043 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.547 11.690 -8.770 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.608 12.990 -9.277 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.289 12.217 -11.955 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.843 12.044 -12.978 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.443 10.654 -12.044 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.899 11.041 -8.541 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.173 11.341 -10.274 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.096 10.021 -9.759 1.00 0.00 H new ATOM 223 N THR A 14 2.003 10.437 -8.922 1.00 0.00 N ATOM 224 CA THR A 14 2.173 9.366 -7.962 1.00 0.00 C ATOM 225 C THR A 14 1.133 9.589 -6.866 1.00 0.00 C ATOM 226 O THR A 14 0.853 10.735 -6.501 1.00 0.00 O ATOM 227 CB THR A 14 3.623 9.385 -7.461 1.00 0.00 C ATOM 228 OG1 THR A 14 4.486 9.338 -8.585 1.00 0.00 O ATOM 229 CG2 THR A 14 3.929 8.192 -6.537 1.00 0.00 C ATOM 0 H THR A 14 2.597 11.249 -8.754 1.00 0.00 H new ATOM 0 HA THR A 14 2.011 8.374 -8.383 1.00 0.00 H new ATOM 0 HB THR A 14 3.776 10.297 -6.884 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.418 9.351 -8.283 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.966 8.245 -6.206 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.269 8.225 -5.670 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.769 7.261 -7.080 1.00 0.00 H new ATOM 237 N LEU A 15 0.550 8.508 -6.349 1.00 0.00 N ATOM 238 CA LEU A 15 -0.442 8.580 -5.286 1.00 0.00 C ATOM 239 C LEU A 15 -0.264 7.415 -4.359 1.00 0.00 C ATOM 240 O LEU A 15 0.235 6.384 -4.795 1.00 0.00 O ATOM 241 CB LEU A 15 -1.873 8.622 -5.850 1.00 0.00 C ATOM 242 CG LEU A 15 -2.429 7.352 -6.506 1.00 0.00 C ATOM 243 CD1 LEU A 15 -3.914 7.196 -6.188 1.00 0.00 C ATOM 244 CD2 LEU A 15 -2.288 7.435 -8.004 1.00 0.00 C ATOM 0 H LEU A 15 0.755 7.558 -6.658 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.291 9.506 -4.731 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.544 8.898 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.918 9.424 -6.586 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.867 6.503 -6.117 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.294 6.290 -6.661 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.050 7.127 -5.109 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.460 8.060 -6.567 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.686 6.528 -8.458 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.841 8.299 -8.374 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.235 7.539 -8.265 1.00 0.00 H new ATOM 256 N GLU A 16 -0.724 7.541 -3.119 1.00 0.00 N ATOM 257 CA GLU A 16 -0.593 6.492 -2.128 1.00 0.00 C ATOM 258 C GLU A 16 -1.953 5.840 -1.904 1.00 0.00 C ATOM 259 O GLU A 16 -2.993 6.492 -1.774 1.00 0.00 O ATOM 260 CB GLU A 16 0.124 6.980 -0.866 1.00 0.00 C ATOM 261 CG GLU A 16 1.652 6.952 -1.070 1.00 0.00 C ATOM 262 CD GLU A 16 2.399 7.451 0.178 1.00 0.00 C ATOM 263 OE1 GLU A 16 2.644 8.677 0.291 1.00 0.00 O ATOM 264 OE2 GLU A 16 2.751 6.617 1.046 1.00 0.00 O ATOM 0 H GLU A 16 -1.198 8.377 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 16 0.065 5.705 -2.496 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -0.199 7.993 -0.626 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -0.148 6.350 -0.019 1.00 0.00 H new ATOM 0 HG2 GLU A 16 1.970 5.936 -1.303 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.917 7.573 -1.926 1.00 0.00 H new ATOM 271 N VAL A 17 -1.901 4.516 -1.944 1.00 0.00 N ATOM 272 CA VAL A 17 -2.992 3.557 -1.992 1.00 0.00 C ATOM 273 C VAL A 17 -2.596 2.312 -1.178 1.00 0.00 C ATOM 274 O VAL A 17 -1.555 2.277 -0.522 1.00 0.00 O ATOM 275 CB VAL A 17 -3.257 3.197 -3.477 1.00 0.00 C ATOM 276 CG1 VAL A 17 -3.664 4.400 -4.338 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.017 2.551 -4.119 1.00 0.00 C ATOM 0 H VAL A 17 -0.999 4.040 -1.944 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.903 3.972 -1.561 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.092 2.497 -3.452 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.833 4.073 -5.364 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.580 4.838 -3.941 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.869 5.145 -4.321 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.231 2.309 -5.160 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.179 3.247 -4.073 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.761 1.639 -3.579 1.00 0.00 H new ATOM 287 N GLU A 18 -3.369 1.244 -1.317 1.00 0.00 N ATOM 288 CA GLU A 18 -3.102 -0.112 -0.831 1.00 0.00 C ATOM 289 C GLU A 18 -3.425 -1.041 -2.002 1.00 0.00 C ATOM 290 O GLU A 18 -4.118 -0.604 -2.923 1.00 0.00 O ATOM 291 CB GLU A 18 -4.009 -0.464 0.362 1.00 0.00 C ATOM 292 CG GLU A 18 -3.955 0.520 1.538 1.00 0.00 C ATOM 293 CD GLU A 18 -2.550 0.739 2.144 1.00 0.00 C ATOM 294 OE1 GLU A 18 -1.647 -0.124 1.995 1.00 0.00 O ATOM 295 OE2 GLU A 18 -2.345 1.778 2.819 1.00 0.00 O ATOM 0 H GLU A 18 -4.263 1.301 -1.806 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.070 -0.206 -0.492 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.038 -0.527 0.009 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.736 -1.455 0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.344 1.482 1.205 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.621 0.161 2.323 1.00 0.00 H new ATOM 302 N PRO A 19 -2.992 -2.312 -2.035 1.00 0.00 N ATOM 303 CA PRO A 19 -3.436 -3.227 -3.082 1.00 0.00 C ATOM 304 C PRO A 19 -4.970 -3.334 -3.131 1.00 0.00 C ATOM 305 O PRO A 19 -5.562 -3.469 -4.194 1.00 0.00 O ATOM 306 CB PRO A 19 -2.769 -4.576 -2.777 1.00 0.00 C ATOM 307 CG PRO A 19 -1.610 -4.224 -1.846 1.00 0.00 C ATOM 308 CD PRO A 19 -2.102 -2.983 -1.102 1.00 0.00 C ATOM 0 HA PRO A 19 -3.147 -2.868 -4.070 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.466 -5.265 -2.301 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.415 -5.059 -3.688 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.387 -5.040 -1.159 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.697 -4.019 -2.404 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.624 -3.254 -0.184 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.271 -2.338 -0.817 1.00 0.00 H new ATOM 316 N SER A 20 -5.630 -3.198 -1.985 1.00 0.00 N ATOM 317 CA SER A 20 -7.058 -3.369 -1.797 1.00 0.00 C ATOM 318 C SER A 20 -7.799 -2.070 -2.064 1.00 0.00 C ATOM 319 O SER A 20 -9.015 -2.011 -1.868 1.00 0.00 O ATOM 320 CB SER A 20 -7.283 -3.896 -0.371 1.00 0.00 C ATOM 321 OG SER A 20 -6.452 -3.206 0.562 1.00 0.00 O ATOM 0 H SER A 20 -5.152 -2.952 -1.118 1.00 0.00 H new ATOM 0 HA SER A 20 -7.459 -4.090 -2.509 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.330 -3.772 -0.094 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.068 -4.964 -0.335 1.00 0.00 H new ATOM 0 HG SER A 20 -6.612 -3.555 1.463 1.00 0.00 H new ATOM 327 N ASP A 21 -7.101 -1.026 -2.520 1.00 0.00 N ATOM 328 CA ASP A 21 -7.748 0.192 -2.917 1.00 0.00 C ATOM 329 C ASP A 21 -8.599 -0.123 -4.130 1.00 0.00 C ATOM 330 O ASP A 21 -8.079 -0.651 -5.121 1.00 0.00 O ATOM 331 CB ASP A 21 -6.733 1.288 -3.260 1.00 0.00 C ATOM 332 CG ASP A 21 -6.468 2.259 -2.105 1.00 0.00 C ATOM 333 OD1 ASP A 21 -6.419 1.840 -0.928 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.347 3.468 -2.407 1.00 0.00 O ATOM 0 H ASP A 21 -6.086 -1.017 -2.617 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.355 0.568 -2.093 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.793 0.822 -3.555 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.094 1.850 -4.121 1.00 0.00 H new ATOM 339 N THR A 22 -9.892 0.198 -4.070 1.00 0.00 N ATOM 340 CA THR A 22 -10.746 0.071 -5.232 1.00 0.00 C ATOM 341 C THR A 22 -10.421 1.156 -6.228 1.00 0.00 C ATOM 342 O THR A 22 -10.043 2.272 -5.855 1.00 0.00 O ATOM 343 CB THR A 22 -12.241 0.133 -4.903 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.462 1.114 -3.905 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.744 -1.224 -4.455 1.00 0.00 C ATOM 0 H THR A 22 -10.360 0.544 -3.232 1.00 0.00 H new ATOM 0 HA THR A 22 -10.547 -0.917 -5.648 1.00 0.00 H new ATOM 0 HB THR A 22 -12.797 0.411 -5.798 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.418 1.157 -3.694 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.808 -1.160 -4.226 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.587 -1.951 -5.252 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.199 -1.538 -3.565 1.00 0.00 H new ATOM 353 N ILE A 23 -10.660 0.838 -7.496 1.00 0.00 N ATOM 354 CA ILE A 23 -10.620 1.800 -8.579 1.00 0.00 C ATOM 355 C ILE A 23 -11.556 2.973 -8.301 1.00 0.00 C ATOM 356 O ILE A 23 -11.157 4.088 -8.597 1.00 0.00 O ATOM 357 CB ILE A 23 -10.936 1.091 -9.905 1.00 0.00 C ATOM 358 CG1 ILE A 23 -10.037 -0.121 -10.203 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.884 2.061 -11.099 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.589 -0.081 -9.718 1.00 0.00 C ATOM 0 H ILE A 23 -10.889 -0.109 -7.799 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.618 2.222 -8.658 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.951 0.717 -9.774 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.510 -1.001 -9.768 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -10.023 -0.268 -11.283 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.113 1.520 -12.017 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.615 2.856 -10.954 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.887 2.494 -11.173 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.084 -1.004 -10.003 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.077 0.768 -10.172 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.571 0.022 -8.633 1.00 0.00 H new ATOM 372 N GLU A 24 -12.733 2.777 -7.700 1.00 0.00 N ATOM 373 CA GLU A 24 -13.619 3.878 -7.290 1.00 0.00 C ATOM 374 C GLU A 24 -12.829 4.922 -6.489 1.00 0.00 C ATOM 375 O GLU A 24 -12.791 6.105 -6.826 1.00 0.00 O ATOM 376 CB GLU A 24 -14.776 3.295 -6.446 1.00 0.00 C ATOM 377 CG GLU A 24 -15.719 4.375 -5.886 1.00 0.00 C ATOM 378 CD GLU A 24 -16.919 3.773 -5.127 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.711 3.053 -4.120 1.00 0.00 O ATOM 380 OE2 GLU A 24 -18.085 4.059 -5.494 1.00 0.00 O ATOM 0 H GLU A 24 -13.102 1.851 -7.482 1.00 0.00 H new ATOM 0 HA GLU A 24 -14.030 4.374 -8.169 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.351 2.601 -7.059 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.360 2.720 -5.619 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -15.161 5.029 -5.216 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -16.085 4.994 -6.705 1.00 0.00 H new ATOM 387 N ASN A 25 -12.137 4.451 -5.451 1.00 0.00 N ATOM 388 CA ASN A 25 -11.414 5.302 -4.518 1.00 0.00 C ATOM 389 C ASN A 25 -10.135 5.857 -5.153 1.00 0.00 C ATOM 390 O ASN A 25 -9.794 7.017 -4.942 1.00 0.00 O ATOM 391 CB ASN A 25 -11.177 4.508 -3.217 1.00 0.00 C ATOM 392 CG ASN A 25 -9.723 4.498 -2.785 1.00 0.00 C ATOM 393 OD1 ASN A 25 -9.266 5.351 -2.031 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.981 3.533 -3.290 1.00 0.00 N ATOM 0 H ASN A 25 -12.065 3.457 -5.236 1.00 0.00 H new ATOM 0 HA ASN A 25 -12.002 6.184 -4.264 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.784 4.938 -2.420 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -11.516 3.481 -3.358 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.990 3.477 -3.057 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -9.398 2.842 -3.914 1.00 0.00 H new ATOM 401 N VAL A 26 -9.457 5.079 -5.999 1.00 0.00 N ATOM 402 CA VAL A 26 -8.283 5.531 -6.745 1.00 0.00 C ATOM 403 C VAL A 26 -8.703 6.668 -7.658 1.00 0.00 C ATOM 404 O VAL A 26 -8.119 7.740 -7.588 1.00 0.00 O ATOM 405 CB VAL A 26 -7.717 4.333 -7.516 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.715 4.721 -8.602 1.00 0.00 C ATOM 407 CG2 VAL A 26 -7.057 3.337 -6.562 1.00 0.00 C ATOM 0 H VAL A 26 -9.710 4.109 -6.187 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.499 5.908 -6.088 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.573 3.875 -8.012 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.357 3.822 -9.105 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.200 5.374 -9.328 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.872 5.243 -8.150 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.662 2.495 -7.131 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.243 3.828 -6.029 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.795 2.977 -5.845 1.00 0.00 H new ATOM 417 N LYS A 27 -9.741 6.496 -8.479 1.00 0.00 N ATOM 418 CA LYS A 27 -10.232 7.572 -9.331 1.00 0.00 C ATOM 419 C LYS A 27 -10.581 8.814 -8.528 1.00 0.00 C ATOM 420 O LYS A 27 -10.299 9.913 -8.993 1.00 0.00 O ATOM 421 CB LYS A 27 -11.481 7.114 -10.095 1.00 0.00 C ATOM 422 CG LYS A 27 -11.289 6.041 -11.173 1.00 0.00 C ATOM 423 CD LYS A 27 -12.694 5.649 -11.672 1.00 0.00 C ATOM 424 CE LYS A 27 -12.644 4.993 -13.056 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.955 5.112 -13.779 1.00 0.00 N ATOM 0 H LYS A 27 -10.256 5.620 -8.569 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.431 7.821 -10.027 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -12.202 6.738 -9.369 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.929 7.989 -10.566 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.681 6.422 -11.993 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.768 5.174 -10.766 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.154 4.963 -10.961 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.326 6.536 -11.713 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.858 5.459 -13.650 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.382 3.940 -12.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.323 4.162 -13.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.636 5.623 -13.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.815 5.633 -14.668 1.00 0.00 H new ATOM 439 N ALA A 28 -11.140 8.669 -7.327 1.00 0.00 N ATOM 440 CA ALA A 28 -11.410 9.815 -6.460 1.00 0.00 C ATOM 441 C ALA A 28 -10.104 10.526 -6.076 1.00 0.00 C ATOM 442 O ALA A 28 -10.038 11.751 -6.121 1.00 0.00 O ATOM 443 CB ALA A 28 -12.213 9.382 -5.228 1.00 0.00 C ATOM 0 H ALA A 28 -11.415 7.769 -6.933 1.00 0.00 H new ATOM 0 HA ALA A 28 -12.019 10.534 -7.009 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -12.404 10.249 -4.595 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -13.161 8.949 -5.546 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.645 8.640 -4.666 1.00 0.00 H new ATOM 449 N LYS A 29 -9.024 9.780 -5.794 1.00 0.00 N ATOM 450 CA LYS A 29 -7.709 10.390 -5.555 1.00 0.00 C ATOM 451 C LYS A 29 -7.203 11.049 -6.835 1.00 0.00 C ATOM 452 O LYS A 29 -6.607 12.112 -6.791 1.00 0.00 O ATOM 453 CB LYS A 29 -6.698 9.347 -5.061 1.00 0.00 C ATOM 454 CG LYS A 29 -7.056 8.819 -3.667 1.00 0.00 C ATOM 455 CD LYS A 29 -6.137 7.661 -3.267 1.00 0.00 C ATOM 456 CE LYS A 29 -6.505 7.174 -1.857 1.00 0.00 C ATOM 457 NZ LYS A 29 -5.505 7.577 -0.826 1.00 0.00 N ATOM 0 H LYS A 29 -9.036 8.762 -5.727 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.818 11.147 -4.779 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.660 8.516 -5.765 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.702 9.790 -5.037 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.972 9.624 -2.937 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.094 8.485 -3.656 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.233 6.844 -3.982 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.096 7.984 -3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.482 7.572 -1.584 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.594 6.088 -1.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.786 7.193 0.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.569 7.204 -1.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.461 8.615 -0.772 1.00 0.00 H new ATOM 471 N ILE A 30 -7.471 10.471 -8.002 1.00 0.00 N ATOM 472 CA ILE A 30 -7.006 11.055 -9.261 1.00 0.00 C ATOM 473 C ILE A 30 -7.725 12.370 -9.469 1.00 0.00 C ATOM 474 O ILE A 30 -7.098 13.333 -9.850 1.00 0.00 O ATOM 475 CB ILE A 30 -7.232 10.125 -10.469 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.615 8.717 -10.367 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.726 10.809 -11.757 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.493 8.548 -9.343 1.00 0.00 C ATOM 0 H ILE A 30 -8.003 9.607 -8.105 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.929 11.208 -9.191 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.310 9.962 -10.488 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.409 8.011 -10.125 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.229 8.439 -11.348 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.888 10.147 -12.608 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.271 11.740 -11.912 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.661 11.023 -11.661 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -5.137 7.518 -9.360 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.671 9.220 -9.589 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.870 8.785 -8.348 1.00 0.00 H new ATOM 490 N GLN A 31 -9.012 12.450 -9.185 1.00 0.00 N ATOM 491 CA GLN A 31 -9.783 13.675 -9.252 1.00 0.00 C ATOM 492 C GLN A 31 -9.203 14.711 -8.303 1.00 0.00 C ATOM 493 O GLN A 31 -9.161 15.882 -8.669 1.00 0.00 O ATOM 494 CB GLN A 31 -11.256 13.398 -8.937 1.00 0.00 C ATOM 495 CG GLN A 31 -12.144 14.618 -9.252 1.00 0.00 C ATOM 496 CD GLN A 31 -12.817 15.156 -7.998 1.00 0.00 C ATOM 497 OE1 GLN A 31 -12.197 15.780 -7.144 1.00 0.00 O ATOM 498 NE2 GLN A 31 -14.103 14.895 -7.865 1.00 0.00 N ATOM 0 H GLN A 31 -9.563 11.643 -8.894 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.727 14.073 -10.265 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.597 12.540 -9.516 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.360 13.134 -7.885 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.539 15.402 -9.706 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.903 14.338 -9.982 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.595 14.374 -8.591 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.605 15.214 -7.037 1.00 0.00 H new ATOM 507 N ASP A 32 -8.691 14.297 -7.146 1.00 0.00 N ATOM 508 CA ASP A 32 -8.006 15.234 -6.272 1.00 0.00 C ATOM 509 C ASP A 32 -6.748 15.783 -6.966 1.00 0.00 C ATOM 510 O ASP A 32 -6.443 16.969 -6.811 1.00 0.00 O ATOM 511 CB ASP A 32 -7.652 14.598 -4.922 1.00 0.00 C ATOM 512 CG ASP A 32 -6.635 15.457 -4.151 1.00 0.00 C ATOM 513 OD1 ASP A 32 -7.065 16.387 -3.427 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.411 15.196 -4.255 1.00 0.00 O ATOM 0 H ASP A 32 -8.737 13.338 -6.801 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.686 16.061 -6.069 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.556 14.478 -4.326 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.242 13.601 -5.083 1.00 0.00 H new ATOM 519 N LYS A 33 -6.032 14.957 -7.755 1.00 0.00 N ATOM 520 CA LYS A 33 -4.725 15.346 -8.276 1.00 0.00 C ATOM 521 C LYS A 33 -4.820 16.028 -9.647 1.00 0.00 C ATOM 522 O LYS A 33 -4.010 16.896 -9.973 1.00 0.00 O ATOM 523 CB LYS A 33 -3.824 14.108 -8.312 1.00 0.00 C ATOM 524 CG LYS A 33 -3.805 13.269 -7.002 1.00 0.00 C ATOM 525 CD LYS A 33 -2.456 13.190 -6.271 1.00 0.00 C ATOM 526 CE LYS A 33 -1.901 14.563 -5.874 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.600 15.149 -4.689 1.00 0.00 N ATOM 0 H LYS A 33 -6.341 14.027 -8.038 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.288 16.092 -7.613 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.147 13.466 -9.132 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.806 14.425 -8.537 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.543 13.686 -6.317 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.127 12.255 -7.239 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.571 12.579 -5.375 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.733 12.684 -6.911 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.838 14.470 -5.654 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.993 15.245 -6.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.372 16.161 -4.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.628 15.032 -4.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.287 14.662 -3.825 1.00 0.00 H new ATOM 541 N GLU A 34 -5.840 15.662 -10.418 1.00 0.00 N ATOM 542 CA GLU A 34 -6.024 15.994 -11.824 1.00 0.00 C ATOM 543 C GLU A 34 -7.219 16.909 -12.055 1.00 0.00 C ATOM 544 O GLU A 34 -7.177 17.776 -12.931 1.00 0.00 O ATOM 545 CB GLU A 34 -6.253 14.676 -12.588 1.00 0.00 C ATOM 546 CG GLU A 34 -5.030 13.755 -12.581 1.00 0.00 C ATOM 547 CD GLU A 34 -3.781 14.515 -13.032 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.713 14.911 -14.215 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.882 14.761 -12.200 1.00 0.00 O ATOM 0 H GLU A 34 -6.604 15.092 -10.055 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.138 16.524 -12.173 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -7.099 14.150 -12.146 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.523 14.903 -13.619 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.876 13.354 -11.579 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.204 12.906 -13.242 1.00 0.00 H new ATOM 556 N GLY A 35 -8.280 16.721 -11.276 1.00 0.00 N ATOM 557 CA GLY A 35 -9.505 17.498 -11.382 1.00 0.00 C ATOM 558 C GLY A 35 -10.456 16.891 -12.403 1.00 0.00 C ATOM 559 O GLY A 35 -11.257 17.616 -12.994 1.00 0.00 O ATOM 0 H GLY A 35 -8.311 16.013 -10.543 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.994 17.545 -10.409 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.265 18.522 -11.668 1.00 0.00 H new ATOM 563 N ILE A 36 -10.369 15.571 -12.625 1.00 0.00 N ATOM 564 CA ILE A 36 -11.200 14.885 -13.597 1.00 0.00 C ATOM 565 C ILE A 36 -12.163 14.079 -12.755 1.00 0.00 C ATOM 566 O ILE A 36 -11.680 13.303 -11.932 1.00 0.00 O ATOM 567 CB ILE A 36 -10.360 13.948 -14.474 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.255 14.699 -15.229 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.269 13.230 -15.484 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.186 13.705 -15.636 1.00 0.00 C ATOM 0 H ILE A 36 -9.719 14.960 -12.131 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.699 15.578 -14.274 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.881 13.225 -13.814 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.667 15.193 -16.109 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.827 15.477 -14.597 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.669 12.565 -16.105 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.019 12.648 -14.949 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.765 13.967 -16.115 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.393 14.224 -16.174 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.771 13.232 -14.746 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.624 12.943 -16.281 1.00 0.00 H new ATOM 582 N PRO A 37 -13.480 14.199 -12.941 1.00 0.00 N ATOM 583 CA PRO A 37 -14.440 13.401 -12.198 1.00 0.00 C ATOM 584 C PRO A 37 -14.171 11.907 -12.370 1.00 0.00 C ATOM 585 O PRO A 37 -13.768 11.486 -13.454 1.00 0.00 O ATOM 586 CB PRO A 37 -15.825 13.840 -12.670 1.00 0.00 C ATOM 587 CG PRO A 37 -15.593 15.042 -13.597 1.00 0.00 C ATOM 588 CD PRO A 37 -14.113 14.992 -13.973 1.00 0.00 C ATOM 0 HA PRO A 37 -14.360 13.564 -11.123 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.332 13.032 -13.198 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.457 14.115 -11.825 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.225 14.981 -14.483 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.838 15.978 -13.094 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -13.972 14.542 -14.956 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.685 15.993 -14.017 1.00 0.00 H new ATOM 596 N PRO A 38 -14.391 11.070 -11.344 1.00 0.00 N ATOM 597 CA PRO A 38 -14.082 9.647 -11.441 1.00 0.00 C ATOM 598 C PRO A 38 -14.912 8.971 -12.515 1.00 0.00 C ATOM 599 O PRO A 38 -14.400 8.124 -13.239 1.00 0.00 O ATOM 600 CB PRO A 38 -14.384 9.078 -10.055 1.00 0.00 C ATOM 601 CG PRO A 38 -15.343 10.070 -9.399 1.00 0.00 C ATOM 602 CD PRO A 38 -14.919 11.400 -10.020 1.00 0.00 C ATOM 0 HA PRO A 38 -13.044 9.477 -11.728 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.835 8.088 -10.128 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.471 8.970 -9.469 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -16.384 9.833 -9.618 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -15.240 10.077 -8.314 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.764 12.084 -10.095 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -14.163 11.894 -9.409 1.00 0.00 H new ATOM 610 N ASP A 39 -16.153 9.409 -12.699 1.00 0.00 N ATOM 611 CA ASP A 39 -17.031 8.789 -13.695 1.00 0.00 C ATOM 612 C ASP A 39 -16.689 9.250 -15.122 1.00 0.00 C ATOM 613 O ASP A 39 -17.238 8.735 -16.090 1.00 0.00 O ATOM 614 CB ASP A 39 -18.494 9.057 -13.320 1.00 0.00 C ATOM 615 CG ASP A 39 -19.485 8.256 -14.185 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.226 7.072 -14.506 1.00 0.00 O ATOM 617 OD2 ASP A 39 -20.545 8.817 -14.546 1.00 0.00 O ATOM 0 H ASP A 39 -16.573 10.181 -12.181 1.00 0.00 H new ATOM 0 HA ASP A 39 -16.872 7.711 -13.691 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.648 8.805 -12.271 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.703 10.121 -13.426 1.00 0.00 H new ATOM 622 N GLN A 40 -15.738 10.182 -15.270 1.00 0.00 N ATOM 623 CA GLN A 40 -15.155 10.573 -16.559 1.00 0.00 C ATOM 624 C GLN A 40 -13.798 9.894 -16.779 1.00 0.00 C ATOM 625 O GLN A 40 -13.321 9.863 -17.913 1.00 0.00 O ATOM 626 CB GLN A 40 -15.058 12.112 -16.610 1.00 0.00 C ATOM 627 CG GLN A 40 -14.468 12.730 -17.903 1.00 0.00 C ATOM 628 CD GLN A 40 -15.316 12.525 -19.161 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.224 11.509 -19.848 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.152 13.489 -19.504 1.00 0.00 N ATOM 0 H GLN A 40 -15.345 10.695 -14.481 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.795 10.238 -17.375 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.058 12.521 -16.463 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.451 12.443 -15.767 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.329 13.800 -17.746 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.480 12.302 -18.075 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -16.224 14.329 -18.931 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -16.725 13.393 -20.342 1.00 0.00 H new ATOM 639 N GLN A 41 -13.162 9.310 -15.756 1.00 0.00 N ATOM 640 CA GLN A 41 -11.894 8.619 -15.947 1.00 0.00 C ATOM 641 C GLN A 41 -12.169 7.233 -16.511 1.00 0.00 C ATOM 642 O GLN A 41 -13.109 6.558 -16.104 1.00 0.00 O ATOM 643 CB GLN A 41 -11.168 8.489 -14.596 1.00 0.00 C ATOM 644 CG GLN A 41 -10.587 9.819 -14.093 1.00 0.00 C ATOM 645 CD GLN A 41 -10.223 9.726 -12.622 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.608 8.757 -12.212 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.633 10.665 -11.783 1.00 0.00 N ATOM 0 H GLN A 41 -13.507 9.305 -14.796 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.267 9.183 -16.638 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.863 8.099 -13.853 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.363 7.761 -14.692 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.703 10.078 -14.675 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.313 10.618 -14.243 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.147 11.473 -12.134 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.435 10.580 -10.786 1.00 0.00 H new ATOM 656 N ARG A 42 -11.271 6.768 -17.367 1.00 0.00 N ATOM 657 CA ARG A 42 -11.215 5.415 -17.906 1.00 0.00 C ATOM 658 C ARG A 42 -9.821 4.979 -17.513 1.00 0.00 C ATOM 659 O ARG A 42 -8.854 5.437 -18.102 1.00 0.00 O ATOM 660 CB ARG A 42 -11.478 5.508 -19.418 1.00 0.00 C ATOM 661 CG ARG A 42 -11.577 4.183 -20.177 1.00 0.00 C ATOM 662 CD ARG A 42 -12.062 4.491 -21.604 1.00 0.00 C ATOM 663 NE ARG A 42 -12.358 3.288 -22.402 1.00 0.00 N ATOM 664 CZ ARG A 42 -13.024 3.250 -23.570 1.00 0.00 C ATOM 665 NH1 ARG A 42 -13.479 4.360 -24.143 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.229 2.085 -24.161 1.00 0.00 N ATOM 0 H ARG A 42 -10.519 7.357 -17.725 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.947 4.694 -17.542 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.407 6.058 -19.569 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.680 6.100 -19.867 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.608 3.685 -20.203 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.270 3.507 -19.676 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.958 5.109 -21.548 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.301 5.079 -22.118 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.025 2.397 -22.033 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.326 5.264 -23.697 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.982 4.307 -25.029 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.883 1.227 -23.731 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.733 2.044 -25.047 1.00 0.00 H new ATOM 680 N LEU A 43 -9.695 4.273 -16.402 1.00 0.00 N ATOM 681 CA LEU A 43 -8.381 3.977 -15.837 1.00 0.00 C ATOM 682 C LEU A 43 -7.909 2.747 -16.571 1.00 0.00 C ATOM 683 O LEU A 43 -8.685 1.819 -16.748 1.00 0.00 O ATOM 684 CB LEU A 43 -8.501 3.727 -14.318 1.00 0.00 C ATOM 685 CG LEU A 43 -7.390 4.376 -13.477 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.388 5.913 -13.572 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.658 4.000 -12.017 1.00 0.00 C ATOM 0 H LEU A 43 -10.480 3.894 -15.872 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.676 4.800 -15.954 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.465 4.103 -13.976 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.495 2.652 -14.138 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.428 4.021 -13.847 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.582 6.314 -12.958 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.238 6.213 -14.609 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.343 6.301 -13.217 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.891 4.441 -11.381 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.637 4.376 -11.718 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.638 2.915 -11.911 1.00 0.00 H new ATOM 699 N ILE A 44 -6.664 2.736 -17.008 1.00 0.00 N ATOM 700 CA ILE A 44 -6.099 1.642 -17.786 1.00 0.00 C ATOM 701 C ILE A 44 -4.886 1.141 -17.030 1.00 0.00 C ATOM 702 O ILE A 44 -4.218 1.911 -16.341 1.00 0.00 O ATOM 703 CB ILE A 44 -5.848 2.126 -19.241 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.241 2.399 -19.870 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.019 1.181 -20.128 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.309 2.585 -21.390 1.00 0.00 C ATOM 0 H ILE A 44 -6.006 3.495 -16.832 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.768 0.789 -17.899 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.228 3.021 -19.187 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.898 1.571 -19.603 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.651 3.295 -19.403 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.906 1.618 -21.120 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.035 1.034 -19.683 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.527 0.220 -20.211 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.341 2.768 -21.688 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.691 3.435 -21.681 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.943 1.685 -21.883 1.00 0.00 H new ATOM 718 N PHE A 45 -4.609 -0.149 -17.164 1.00 0.00 N ATOM 719 CA PHE A 45 -3.396 -0.741 -16.636 1.00 0.00 C ATOM 720 C PHE A 45 -2.933 -1.784 -17.633 1.00 0.00 C ATOM 721 O PHE A 45 -3.651 -2.752 -17.853 1.00 0.00 O ATOM 722 CB PHE A 45 -3.687 -1.385 -15.277 1.00 0.00 C ATOM 723 CG PHE A 45 -2.518 -2.189 -14.769 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.303 -1.533 -14.533 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.616 -3.583 -14.597 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.183 -2.263 -14.106 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.504 -4.307 -14.138 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.290 -3.648 -13.884 1.00 0.00 C ATOM 0 H PHE A 45 -5.221 -0.811 -17.642 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.621 0.011 -16.491 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.934 -0.608 -14.553 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.561 -2.031 -15.362 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.228 -0.466 -14.680 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.542 -4.093 -14.817 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.760 -1.762 -13.948 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.582 -5.373 -13.980 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.561 -4.204 -13.519 1.00 0.00 H new ATOM 738 N ALA A 46 -1.767 -1.588 -18.252 1.00 0.00 N ATOM 739 CA ALA A 46 -1.132 -2.565 -19.153 1.00 0.00 C ATOM 740 C ALA A 46 -2.057 -3.076 -20.281 1.00 0.00 C ATOM 741 O ALA A 46 -1.932 -4.208 -20.751 1.00 0.00 O ATOM 742 CB ALA A 46 -0.559 -3.699 -18.302 1.00 0.00 C ATOM 0 H ALA A 46 -1.224 -0.732 -18.142 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.328 -2.063 -19.691 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.083 -4.435 -18.950 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.178 -3.296 -17.608 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.363 -4.175 -17.741 1.00 0.00 H new ATOM 748 N GLY A 47 -3.008 -2.234 -20.688 1.00 0.00 N ATOM 749 CA GLY A 47 -3.985 -2.519 -21.738 1.00 0.00 C ATOM 750 C GLY A 47 -5.345 -2.986 -21.218 1.00 0.00 C ATOM 751 O GLY A 47 -6.290 -3.081 -22.001 1.00 0.00 O ATOM 0 H GLY A 47 -3.122 -1.305 -20.282 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.127 -1.621 -22.340 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.579 -3.285 -22.399 1.00 0.00 H new ATOM 755 N LYS A 48 -5.480 -3.243 -19.910 1.00 0.00 N ATOM 756 CA LYS A 48 -6.777 -3.484 -19.286 1.00 0.00 C ATOM 757 C LYS A 48 -7.374 -2.122 -19.029 1.00 0.00 C ATOM 758 O LYS A 48 -6.643 -1.169 -18.823 1.00 0.00 O ATOM 759 CB LYS A 48 -6.643 -4.244 -17.951 1.00 0.00 C ATOM 760 CG LYS A 48 -6.353 -5.742 -18.096 1.00 0.00 C ATOM 761 CD LYS A 48 -4.936 -6.070 -18.597 1.00 0.00 C ATOM 762 CE LYS A 48 -4.642 -7.570 -18.475 1.00 0.00 C ATOM 763 NZ LYS A 48 -5.366 -8.400 -19.477 1.00 0.00 N ATOM 0 H LYS A 48 -4.694 -3.288 -19.262 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.398 -4.099 -19.937 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.844 -3.788 -17.367 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.565 -4.119 -17.383 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.504 -6.224 -17.130 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.078 -6.175 -18.785 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.833 -5.759 -19.637 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.203 -5.504 -18.021 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -3.570 -7.732 -18.587 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.912 -7.905 -17.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.123 -9.402 -19.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.391 -8.273 -19.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.090 -8.106 -20.436 1.00 0.00 H new ATOM 777 N GLN A 49 -8.683 -2.043 -18.946 1.00 0.00 N ATOM 778 CA GLN A 49 -9.470 -0.897 -18.505 1.00 0.00 C ATOM 779 C GLN A 49 -10.125 -1.383 -17.220 1.00 0.00 C ATOM 780 O GLN A 49 -10.669 -2.492 -17.188 1.00 0.00 O ATOM 781 CB GLN A 49 -10.532 -0.570 -19.571 1.00 0.00 C ATOM 782 CG GLN A 49 -9.897 0.116 -20.789 1.00 0.00 C ATOM 783 CD GLN A 49 -10.688 -0.071 -22.089 1.00 0.00 C ATOM 784 OE1 GLN A 49 -11.723 0.554 -22.281 1.00 0.00 O ATOM 785 NE2 GLN A 49 -10.206 -0.876 -23.021 1.00 0.00 N ATOM 0 H GLN A 49 -9.276 -2.833 -19.202 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.882 0.008 -18.353 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.031 -1.487 -19.885 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.296 0.078 -19.141 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.800 1.182 -20.584 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.889 -0.274 -20.929 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.343 -1.393 -22.852 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -10.697 -0.980 -23.909 1.00 0.00 H new ATOM 794 N LEU A 50 -10.028 -0.588 -16.157 1.00 0.00 N ATOM 795 CA LEU A 50 -10.404 -1.030 -14.815 1.00 0.00 C ATOM 796 C LEU A 50 -11.760 -0.433 -14.461 1.00 0.00 C ATOM 797 O LEU A 50 -12.006 0.730 -14.781 1.00 0.00 O ATOM 798 CB LEU A 50 -9.318 -0.673 -13.773 1.00 0.00 C ATOM 799 CG LEU A 50 -7.853 -0.666 -14.241 1.00 0.00 C ATOM 800 CD1 LEU A 50 -6.928 -0.347 -13.059 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.394 -1.961 -14.919 1.00 0.00 C ATOM 0 H LEU A 50 -9.689 0.373 -16.200 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.485 -2.117 -14.801 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.547 0.315 -13.375 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.402 -1.378 -12.946 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.792 0.109 -15.005 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.892 -0.344 -13.398 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.180 0.633 -12.654 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.054 -1.103 -12.284 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.350 -1.866 -15.216 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.499 -2.793 -14.223 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.006 -2.147 -15.801 1.00 0.00 H new ATOM 813 N GLU A 51 -12.615 -1.201 -13.780 1.00 0.00 N ATOM 814 CA GLU A 51 -13.936 -0.736 -13.371 1.00 0.00 C ATOM 815 C GLU A 51 -13.922 -0.411 -11.882 1.00 0.00 C ATOM 816 O GLU A 51 -13.109 -0.945 -11.130 1.00 0.00 O ATOM 817 CB GLU A 51 -15.056 -1.698 -13.821 1.00 0.00 C ATOM 818 CG GLU A 51 -15.251 -2.917 -12.915 1.00 0.00 C ATOM 819 CD GLU A 51 -16.268 -3.917 -13.491 1.00 0.00 C ATOM 820 OE1 GLU A 51 -17.485 -3.609 -13.514 1.00 0.00 O ATOM 821 OE2 GLU A 51 -15.856 -5.029 -13.899 1.00 0.00 O ATOM 0 H GLU A 51 -12.408 -2.160 -13.499 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.177 0.193 -13.887 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.994 -1.145 -13.871 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.836 -2.044 -14.831 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.293 -3.418 -12.773 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.587 -2.586 -11.932 1.00 0.00 H new ATOM 828 N ASP A 52 -14.829 0.467 -11.457 1.00 0.00 N ATOM 829 CA ASP A 52 -14.851 1.076 -10.127 1.00 0.00 C ATOM 830 C ASP A 52 -14.910 0.050 -8.999 1.00 0.00 C ATOM 831 O ASP A 52 -14.288 0.259 -7.955 1.00 0.00 O ATOM 832 CB ASP A 52 -16.006 2.077 -10.004 1.00 0.00 C ATOM 833 CG ASP A 52 -17.357 1.413 -9.680 1.00 0.00 C ATOM 834 OD1 ASP A 52 -17.966 0.818 -10.603 1.00 0.00 O ATOM 835 OD2 ASP A 52 -17.813 1.488 -8.517 1.00 0.00 O ATOM 0 H ASP A 52 -15.596 0.785 -12.050 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.905 1.607 -10.018 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.769 2.801 -9.224 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.097 2.633 -10.937 1.00 0.00 H new ATOM 840 N GLY A 53 -15.581 -1.076 -9.237 1.00 0.00 N ATOM 841 CA GLY A 53 -15.817 -2.106 -8.237 1.00 0.00 C ATOM 842 C GLY A 53 -14.639 -3.055 -8.032 1.00 0.00 C ATOM 843 O GLY A 53 -14.781 -4.039 -7.302 1.00 0.00 O ATOM 0 H GLY A 53 -15.982 -1.298 -10.148 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -16.054 -1.628 -7.287 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.692 -2.687 -8.529 1.00 0.00 H new ATOM 847 N ARG A 54 -13.491 -2.810 -8.672 1.00 0.00 N ATOM 848 CA ARG A 54 -12.331 -3.694 -8.633 1.00 0.00 C ATOM 849 C ARG A 54 -11.212 -3.010 -7.891 1.00 0.00 C ATOM 850 O ARG A 54 -11.331 -1.833 -7.582 1.00 0.00 O ATOM 851 CB ARG A 54 -11.962 -4.062 -10.071 1.00 0.00 C ATOM 852 CG ARG A 54 -13.010 -5.031 -10.647 1.00 0.00 C ATOM 853 CD ARG A 54 -12.666 -5.493 -12.062 1.00 0.00 C ATOM 854 NE ARG A 54 -13.729 -6.334 -12.630 1.00 0.00 N ATOM 855 CZ ARG A 54 -13.830 -7.664 -12.566 1.00 0.00 C ATOM 856 NH1 ARG A 54 -12.924 -8.401 -11.925 1.00 0.00 N ATOM 857 NH2 ARG A 54 -14.862 -8.258 -13.161 1.00 0.00 N ATOM 0 H ARG A 54 -13.344 -1.976 -9.240 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.544 -4.619 -8.097 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.909 -3.162 -10.684 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -10.975 -4.523 -10.096 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.093 -5.900 -9.995 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -13.985 -4.544 -10.655 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -12.508 -4.624 -12.701 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -11.730 -6.051 -12.046 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.473 -5.847 -13.129 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -12.131 -7.951 -11.469 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.024 -9.416 -11.890 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -15.558 -7.698 -13.654 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.957 -9.273 -13.124 1.00 0.00 H new ATOM 871 N THR A 55 -10.129 -3.706 -7.598 1.00 0.00 N ATOM 872 CA THR A 55 -9.043 -3.195 -6.779 1.00 0.00 C ATOM 873 C THR A 55 -7.740 -3.347 -7.525 1.00 0.00 C ATOM 874 O THR A 55 -7.663 -4.052 -8.529 1.00 0.00 O ATOM 875 CB THR A 55 -8.991 -3.951 -5.443 1.00 0.00 C ATOM 876 OG1 THR A 55 -9.037 -5.341 -5.680 1.00 0.00 O ATOM 877 CG2 THR A 55 -10.145 -3.595 -4.515 1.00 0.00 C ATOM 0 H THR A 55 -9.976 -4.659 -7.928 1.00 0.00 H new ATOM 0 HA THR A 55 -9.211 -2.139 -6.569 1.00 0.00 H new ATOM 0 HB THR A 55 -8.060 -3.658 -4.959 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.227 -5.761 -5.322 1.00 0.00 H new ATOM 0 HG21 THR A 55 -10.054 -4.161 -3.588 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.118 -2.528 -4.294 1.00 0.00 H new ATOM 0 HG23 THR A 55 -11.090 -3.841 -4.999 1.00 0.00 H new ATOM 885 N LEU A 56 -6.694 -2.702 -7.023 1.00 0.00 N ATOM 886 CA LEU A 56 -5.373 -2.796 -7.636 1.00 0.00 C ATOM 887 C LEU A 56 -4.923 -4.260 -7.635 1.00 0.00 C ATOM 888 O LEU A 56 -4.471 -4.794 -8.647 1.00 0.00 O ATOM 889 CB LEU A 56 -4.400 -1.849 -6.907 1.00 0.00 C ATOM 890 CG LEU A 56 -4.890 -0.396 -6.864 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.810 0.505 -6.281 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.263 0.117 -8.260 1.00 0.00 C ATOM 0 H LEU A 56 -6.734 -2.109 -6.194 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.396 -2.473 -8.677 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.251 -2.206 -5.888 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.430 -1.884 -7.402 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.780 -0.372 -6.235 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.169 1.534 -6.255 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.571 0.179 -5.269 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.915 0.448 -6.901 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.605 1.149 -8.189 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.390 0.068 -8.911 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.059 -0.502 -8.674 1.00 0.00 H new ATOM 904 N SER A 57 -5.174 -4.937 -6.525 1.00 0.00 N ATOM 905 CA SER A 57 -4.940 -6.352 -6.335 1.00 0.00 C ATOM 906 C SER A 57 -5.732 -7.222 -7.312 1.00 0.00 C ATOM 907 O SER A 57 -5.207 -8.247 -7.750 1.00 0.00 O ATOM 908 CB SER A 57 -5.314 -6.718 -4.901 1.00 0.00 C ATOM 909 OG SER A 57 -6.587 -6.203 -4.528 1.00 0.00 O ATOM 0 H SER A 57 -5.565 -4.490 -5.696 1.00 0.00 H new ATOM 0 HA SER A 57 -3.885 -6.545 -6.528 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.318 -7.803 -4.794 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.555 -6.333 -4.220 1.00 0.00 H new ATOM 0 HG SER A 57 -6.487 -5.281 -4.211 1.00 0.00 H new ATOM 915 N ASP A 58 -6.947 -6.818 -7.715 1.00 0.00 N ATOM 916 CA ASP A 58 -7.740 -7.583 -8.670 1.00 0.00 C ATOM 917 C ASP A 58 -7.099 -7.558 -10.064 1.00 0.00 C ATOM 918 O ASP A 58 -7.429 -8.375 -10.925 1.00 0.00 O ATOM 919 CB ASP A 58 -9.166 -7.046 -8.716 1.00 0.00 C ATOM 920 CG ASP A 58 -10.085 -8.010 -9.481 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.228 -9.183 -9.056 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.721 -7.585 -10.470 1.00 0.00 O ATOM 0 H ASP A 58 -7.396 -5.962 -7.389 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.770 -8.621 -8.340 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.540 -6.907 -7.702 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.176 -6.068 -9.197 1.00 0.00 H new ATOM 927 N TYR A 59 -6.119 -6.665 -10.244 1.00 0.00 N ATOM 928 CA TYR A 59 -5.327 -6.490 -11.450 1.00 0.00 C ATOM 929 C TYR A 59 -3.847 -6.838 -11.216 1.00 0.00 C ATOM 930 O TYR A 59 -3.036 -6.692 -12.129 1.00 0.00 O ATOM 931 CB TYR A 59 -5.539 -5.056 -11.955 1.00 0.00 C ATOM 932 CG TYR A 59 -6.919 -4.849 -12.545 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.204 -5.406 -13.806 1.00 0.00 C ATOM 934 CD2 TYR A 59 -7.922 -4.160 -11.833 1.00 0.00 C ATOM 935 CE1 TYR A 59 -8.484 -5.272 -14.365 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.217 -4.060 -12.367 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.496 -4.596 -13.646 1.00 0.00 C ATOM 938 OH TYR A 59 -10.732 -4.442 -14.200 1.00 0.00 O ATOM 0 H TYR A 59 -5.849 -6.013 -9.507 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.657 -7.185 -12.222 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.391 -4.358 -11.131 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.786 -4.824 -12.708 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.435 -5.938 -14.345 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.695 -3.710 -10.878 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.695 -5.684 -15.341 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.999 -3.574 -11.802 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.119 -5.323 -14.387 1.00 0.00 H new ATOM 948 N ASN A 60 -3.486 -7.351 -10.030 1.00 0.00 N ATOM 949 CA ASN A 60 -2.132 -7.758 -9.600 1.00 0.00 C ATOM 950 C ASN A 60 -1.184 -6.565 -9.447 1.00 0.00 C ATOM 951 O ASN A 60 0.025 -6.733 -9.266 1.00 0.00 O ATOM 952 CB ASN A 60 -1.498 -8.831 -10.508 1.00 0.00 C ATOM 953 CG ASN A 60 -2.426 -9.997 -10.823 1.00 0.00 C ATOM 954 OD1 ASN A 60 -2.498 -10.976 -10.085 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.159 -9.902 -11.922 1.00 0.00 N ATOM 0 H ASN A 60 -4.175 -7.504 -9.294 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.275 -8.209 -8.618 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.186 -8.365 -11.442 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.598 -9.215 -10.027 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.802 -10.653 -12.172 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -3.080 -9.078 -12.518 1.00 0.00 H new ATOM 962 N ILE A 61 -1.724 -5.352 -9.522 1.00 0.00 N ATOM 963 CA ILE A 61 -1.014 -4.107 -9.302 1.00 0.00 C ATOM 964 C ILE A 61 -0.635 -4.081 -7.821 1.00 0.00 C ATOM 965 O ILE A 61 -1.475 -4.302 -6.948 1.00 0.00 O ATOM 966 CB ILE A 61 -1.938 -2.931 -9.665 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.407 -2.975 -11.130 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.298 -1.558 -9.373 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.686 -2.166 -11.326 1.00 0.00 C ATOM 0 H ILE A 61 -2.709 -5.210 -9.747 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.119 -4.025 -9.919 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.808 -3.050 -9.020 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.623 -2.582 -11.777 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.579 -4.009 -11.428 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.994 -0.766 -9.648 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.065 -1.484 -8.311 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.381 -1.453 -9.953 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -3.992 -2.217 -12.371 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.476 -2.576 -10.696 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.505 -1.127 -11.051 1.00 0.00 H new ATOM 981 N GLN A 62 0.631 -3.781 -7.560 1.00 0.00 N ATOM 982 CA GLN A 62 1.218 -3.688 -6.234 1.00 0.00 C ATOM 983 C GLN A 62 1.795 -2.279 -6.099 1.00 0.00 C ATOM 984 O GLN A 62 1.431 -1.367 -6.843 1.00 0.00 O ATOM 985 CB GLN A 62 2.267 -4.809 -6.102 1.00 0.00 C ATOM 986 CG GLN A 62 1.604 -6.192 -6.139 1.00 0.00 C ATOM 987 CD GLN A 62 2.588 -7.261 -6.603 1.00 0.00 C ATOM 988 OE1 GLN A 62 3.407 -7.769 -5.839 1.00 0.00 O ATOM 989 NE2 GLN A 62 2.526 -7.604 -7.880 1.00 0.00 N ATOM 0 H GLN A 62 1.304 -3.588 -8.301 1.00 0.00 H new ATOM 0 HA GLN A 62 0.501 -3.831 -5.425 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.993 -4.729 -6.911 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.816 -4.690 -5.168 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.228 -6.445 -5.148 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.745 -6.169 -6.809 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.837 -7.167 -8.492 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.167 -8.305 -8.251 1.00 0.00 H new ATOM 998 N LYS A 63 2.669 -2.066 -5.121 1.00 0.00 N ATOM 999 CA LYS A 63 3.407 -0.829 -4.958 1.00 0.00 C ATOM 1000 C LYS A 63 4.289 -0.563 -6.165 1.00 0.00 C ATOM 1001 O LYS A 63 4.592 -1.456 -6.953 1.00 0.00 O ATOM 1002 CB LYS A 63 4.253 -0.893 -3.673 1.00 0.00 C ATOM 1003 CG LYS A 63 5.443 -1.856 -3.699 1.00 0.00 C ATOM 1004 CD LYS A 63 6.333 -1.556 -2.478 1.00 0.00 C ATOM 1005 CE LYS A 63 7.384 -2.626 -2.167 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.295 -2.913 -3.305 1.00 0.00 N ATOM 0 H LYS A 63 2.885 -2.764 -4.409 1.00 0.00 H new ATOM 0 HA LYS A 63 2.697 -0.006 -4.875 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.626 0.108 -3.457 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.601 -1.175 -2.846 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.096 -2.889 -3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.010 -1.734 -4.622 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.841 -0.606 -2.642 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.695 -1.430 -1.604 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.976 -2.304 -1.311 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.878 -3.547 -1.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.138 -3.412 -2.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.803 -3.508 -4.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.582 -2.020 -3.754 1.00 0.00 H new ATOM 1020 N GLU A 64 4.739 0.686 -6.208 1.00 0.00 N ATOM 1021 CA GLU A 64 5.648 1.269 -7.186 1.00 0.00 C ATOM 1022 C GLU A 64 5.296 0.774 -8.593 1.00 0.00 C ATOM 1023 O GLU A 64 6.142 0.332 -9.371 1.00 0.00 O ATOM 1024 CB GLU A 64 7.118 1.170 -6.699 1.00 0.00 C ATOM 1025 CG GLU A 64 7.843 -0.165 -6.855 1.00 0.00 C ATOM 1026 CD GLU A 64 9.125 -0.217 -6.000 1.00 0.00 C ATOM 1027 OE1 GLU A 64 10.190 0.280 -6.447 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.079 -0.783 -4.881 1.00 0.00 O ATOM 0 H GLU A 64 4.455 1.369 -5.506 1.00 0.00 H new ATOM 0 HA GLU A 64 5.520 2.348 -7.278 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.696 1.926 -7.230 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.137 1.438 -5.643 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.177 -0.978 -6.564 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.097 -0.321 -7.903 1.00 0.00 H new ATOM 1035 N SER A 65 3.991 0.816 -8.881 1.00 0.00 N ATOM 1036 CA SER A 65 3.444 0.246 -10.114 1.00 0.00 C ATOM 1037 C SER A 65 2.739 1.353 -10.875 1.00 0.00 C ATOM 1038 O SER A 65 2.222 2.285 -10.262 1.00 0.00 O ATOM 1039 CB SER A 65 2.493 -0.922 -9.812 1.00 0.00 C ATOM 1040 OG SER A 65 3.184 -2.036 -9.270 1.00 0.00 O ATOM 0 H SER A 65 3.292 1.242 -8.273 1.00 0.00 H new ATOM 0 HA SER A 65 4.251 -0.161 -10.724 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.725 -0.594 -9.111 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.982 -1.221 -10.727 1.00 0.00 H new ATOM 0 HG SER A 65 3.659 -1.763 -8.458 1.00 0.00 H new ATOM 1046 N THR A 66 2.721 1.252 -12.195 1.00 0.00 N ATOM 1047 CA THR A 66 2.287 2.335 -13.067 1.00 0.00 C ATOM 1048 C THR A 66 0.891 2.035 -13.598 1.00 0.00 C ATOM 1049 O THR A 66 0.560 0.896 -13.904 1.00 0.00 O ATOM 1050 CB THR A 66 3.321 2.541 -14.197 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.617 2.632 -13.624 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.079 3.805 -15.039 1.00 0.00 C ATOM 0 H THR A 66 3.009 0.411 -12.696 1.00 0.00 H new ATOM 0 HA THR A 66 2.228 3.270 -12.510 1.00 0.00 H new ATOM 0 HB THR A 66 3.223 1.685 -14.865 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.280 2.761 -14.334 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.845 3.880 -15.811 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.096 3.748 -15.507 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.124 4.684 -14.396 1.00 0.00 H new ATOM 1060 N LEU A 67 0.083 3.084 -13.717 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.288 3.108 -14.208 1.00 0.00 C ATOM 1062 C LEU A 67 -1.402 4.116 -15.346 1.00 0.00 C ATOM 1063 O LEU A 67 -0.478 4.903 -15.549 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.179 3.566 -13.042 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.367 2.660 -12.783 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.898 1.321 -12.226 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.292 3.312 -11.763 1.00 0.00 C ATOM 0 H LEU A 67 0.398 4.016 -13.450 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.587 2.125 -14.572 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.575 3.624 -12.137 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.541 4.573 -13.248 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.894 2.500 -13.724 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.761 0.680 -12.045 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.234 0.841 -12.944 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.363 1.483 -11.290 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.146 2.660 -11.577 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.750 3.474 -10.831 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.643 4.269 -12.150 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.564 4.196 -15.999 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.785 5.141 -17.098 1.00 0.00 C ATOM 1081 C HIS A 68 -4.102 5.882 -16.927 1.00 0.00 C ATOM 1082 O HIS A 68 -5.135 5.251 -16.704 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.773 4.406 -18.454 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.413 4.261 -19.089 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -0.925 3.089 -19.667 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.524 5.276 -19.312 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.266 3.415 -20.196 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.540 4.710 -19.980 1.00 0.00 N ATOM 0 H HIS A 68 -3.373 3.613 -15.784 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.973 5.868 -17.078 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.200 3.413 -18.316 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.425 4.940 -19.145 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.378 2.175 -19.684 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.634 6.311 -19.023 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.913 2.729 -20.722 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.072 7.212 -17.060 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.286 8.031 -17.156 1.00 0.00 C ATOM 1098 C LEU A 69 -5.662 8.029 -18.623 1.00 0.00 C ATOM 1099 O LEU A 69 -4.891 8.499 -19.452 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.050 9.497 -16.679 1.00 0.00 C ATOM 1101 CG LEU A 69 -5.793 10.660 -17.422 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.308 10.531 -17.236 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.379 12.033 -16.915 1.00 0.00 C ATOM 0 H LEU A 69 -3.207 7.751 -17.104 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.068 7.623 -16.516 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.324 9.550 -15.625 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.980 9.696 -16.740 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.518 10.573 -18.473 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.809 11.346 -17.758 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.645 9.578 -17.643 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.549 10.577 -16.174 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.923 12.802 -17.463 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.609 12.113 -15.852 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.308 12.169 -17.066 1.00 0.00 H new ATOM 1115 N VAL A 70 -6.866 7.561 -18.914 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.524 7.668 -20.201 1.00 0.00 C ATOM 1117 C VAL A 70 -8.928 8.196 -19.873 1.00 0.00 C ATOM 1118 O VAL A 70 -9.342 8.209 -18.715 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.409 6.289 -20.882 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.210 6.205 -22.167 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -5.934 5.953 -21.177 1.00 0.00 C ATOM 0 H VAL A 70 -7.436 7.073 -18.223 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.098 8.357 -20.930 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.824 5.563 -20.183 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.093 5.213 -22.604 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.263 6.385 -21.952 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -7.850 6.956 -22.870 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.872 4.977 -21.657 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.514 6.710 -21.839 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.371 5.934 -20.244 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.668 8.684 -20.859 1.00 0.00 N ATOM 1132 CA LEU A 71 -10.956 9.340 -20.645 1.00 0.00 C ATOM 1133 C LEU A 71 -12.087 8.372 -21.006 1.00 0.00 C ATOM 1134 O LEU A 71 -11.927 7.549 -21.899 1.00 0.00 O ATOM 1135 CB LEU A 71 -10.953 10.587 -21.543 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.149 11.520 -21.314 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.765 12.693 -20.425 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -12.703 12.024 -22.640 1.00 0.00 C ATOM 0 H LEU A 71 -9.391 8.637 -21.840 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.112 9.630 -19.606 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.032 11.144 -21.372 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.945 10.272 -22.586 1.00 0.00 H new ATOM 0 HG LEU A 71 -12.925 10.946 -20.808 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.631 13.338 -20.279 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.423 12.321 -19.459 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.965 13.262 -20.899 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.550 12.684 -22.453 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -11.927 12.573 -23.174 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.029 11.177 -23.244 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.246 8.474 -20.352 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.478 7.739 -20.716 1.00 0.00 C ATOM 1152 C ARG A 72 -15.063 8.209 -22.047 1.00 0.00 C ATOM 1153 O ARG A 72 -15.768 7.436 -22.685 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.564 7.934 -19.626 1.00 0.00 C ATOM 1155 CG ARG A 72 -15.339 7.050 -18.384 1.00 0.00 C ATOM 1156 CD ARG A 72 -16.340 5.891 -18.268 1.00 0.00 C ATOM 1157 NE ARG A 72 -17.617 6.331 -17.662 1.00 0.00 N ATOM 1158 CZ ARG A 72 -18.830 5.791 -17.853 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -19.049 4.925 -18.842 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -19.828 6.119 -17.042 1.00 0.00 N ATOM 0 H ARG A 72 -13.366 9.078 -19.539 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.195 6.690 -20.804 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.581 8.980 -19.322 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.542 7.710 -20.052 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -14.328 6.645 -18.415 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.407 7.669 -17.490 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.531 5.474 -19.257 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -15.906 5.094 -17.664 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.569 7.131 -17.031 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.288 4.663 -19.468 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.978 4.524 -18.973 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.670 6.778 -16.279 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.753 5.712 -17.181 1.00 0.00 H new ATOM 1174 N LEU A 73 -14.748 9.444 -22.465 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.429 10.129 -23.576 1.00 0.00 C ATOM 1176 C LEU A 73 -16.920 10.118 -23.180 1.00 0.00 C ATOM 1177 O LEU A 73 -17.787 9.750 -23.976 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.143 9.522 -24.976 1.00 0.00 C ATOM 1179 CG LEU A 73 -13.708 9.423 -25.531 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -12.998 10.714 -25.916 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -12.759 8.551 -24.706 1.00 0.00 C ATOM 0 H LEU A 73 -14.007 10.001 -22.038 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.053 11.144 -23.705 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.553 8.512 -24.973 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.723 10.099 -25.696 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.935 8.924 -26.473 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.000 10.483 -26.289 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.567 11.224 -26.694 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.918 11.360 -25.042 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.774 8.542 -25.174 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.678 8.955 -23.697 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.148 7.534 -24.659 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.183 10.408 -21.890 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.491 10.240 -21.256 1.00 0.00 C ATOM 1195 C ARG A 74 -19.577 10.943 -22.063 1.00 0.00 C ATOM 1196 O ARG A 74 -19.400 12.089 -22.481 1.00 0.00 O ATOM 1197 CB ARG A 74 -18.414 10.777 -19.814 1.00 0.00 C ATOM 1198 CG ARG A 74 -19.619 10.439 -18.926 1.00 0.00 C ATOM 1199 CD ARG A 74 -19.382 11.057 -17.547 1.00 0.00 C ATOM 1200 NE ARG A 74 -20.433 10.687 -16.590 1.00 0.00 N ATOM 1201 CZ ARG A 74 -21.562 11.342 -16.303 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -21.931 12.439 -16.960 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -22.315 10.856 -15.325 1.00 0.00 N ATOM 0 H ARG A 74 -16.474 10.772 -21.254 1.00 0.00 H new ATOM 0 HA ARG A 74 -18.756 9.183 -21.226 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -17.514 10.381 -19.344 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -18.304 11.861 -19.852 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -20.537 10.830 -19.365 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -19.740 9.359 -18.843 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -18.414 10.732 -17.166 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -19.341 12.142 -17.638 1.00 0.00 H new ATOM 0 HE ARG A 74 -20.282 9.818 -16.078 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -21.345 12.806 -17.710 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -22.800 12.913 -16.714 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -22.023 10.015 -14.827 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -23.186 11.323 -15.071 1.00 0.00 H new ATOM 1217 N GLY A 75 -20.720 10.276 -22.216 1.00 0.00 N ATOM 1218 CA GLY A 75 -21.876 10.762 -22.965 1.00 0.00 C ATOM 1219 C GLY A 75 -22.711 11.782 -22.182 1.00 0.00 C ATOM 1220 O GLY A 75 -23.944 11.728 -22.216 1.00 0.00 O ATOM 0 H GLY A 75 -20.871 9.353 -21.809 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -21.534 11.217 -23.895 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -22.507 9.916 -23.237 1.00 0.00 H new ATOM 1224 N GLY A 76 -22.062 12.666 -21.424 1.00 0.00 N ATOM 1225 CA GLY A 76 -22.682 13.656 -20.561 1.00 0.00 C ATOM 1226 C GLY A 76 -21.567 14.413 -19.860 1.00 0.00 C ATOM 1227 O GLY A 76 -21.442 15.635 -20.092 1.00 0.00 O ATOM 1228 OXT GLY A 76 -20.808 13.764 -19.109 1.00 0.00 O ATOM 0 H GLY A 76 -21.043 12.708 -21.398 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -23.301 14.338 -21.143 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -23.335 13.175 -19.833 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -16.530 29.287 -39.720 1.00 0.00 N ATOM 1234 CA GLY B -3 -15.914 28.984 -38.407 1.00 0.00 C ATOM 1235 C GLY B -3 -16.645 27.845 -37.696 1.00 0.00 C ATOM 1236 O GLY B -3 -17.631 28.082 -36.991 1.00 0.00 O ATOM 0 H1 GLY B -3 -16.011 30.064 -40.176 1.00 0.00 H new ATOM 0 H2 GLY B -3 -16.491 28.442 -40.325 1.00 0.00 H new ATOM 0 H3 GLY B -3 -17.522 29.568 -39.582 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -14.867 28.714 -38.548 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -15.931 29.876 -37.781 1.00 0.00 H new ATOM 1242 N HIS B -2 -16.178 26.601 -37.872 1.00 0.00 N ATOM 1243 CA HIS B -2 -16.711 25.395 -37.226 1.00 0.00 C ATOM 1244 C HIS B -2 -15.587 24.360 -37.115 1.00 0.00 C ATOM 1245 O HIS B -2 -14.588 24.462 -37.839 1.00 0.00 O ATOM 1246 CB HIS B -2 -17.880 24.845 -38.061 1.00 0.00 C ATOM 1247 CG HIS B -2 -18.562 23.654 -37.429 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -19.002 23.583 -36.100 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -18.817 22.460 -38.047 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -19.513 22.348 -35.956 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -19.416 21.657 -37.103 1.00 0.00 N ATOM 0 H HIS B -2 -15.391 26.401 -38.490 1.00 0.00 H new ATOM 0 HA HIS B -2 -17.080 25.627 -36.227 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -18.614 25.637 -38.211 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -17.511 24.562 -39.047 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -18.593 22.200 -39.071 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -19.943 21.964 -35.043 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -19.733 20.699 -37.250 1.00 0.00 H new ATOM 1259 N MET B -1 -15.738 23.365 -36.235 1.00 0.00 N ATOM 1260 CA MET B -1 -14.796 22.264 -36.053 1.00 0.00 C ATOM 1261 C MET B -1 -15.609 20.998 -35.763 1.00 0.00 C ATOM 1262 O MET B -1 -16.592 21.039 -35.014 1.00 0.00 O ATOM 1263 CB MET B -1 -13.817 22.528 -34.891 1.00 0.00 C ATOM 1264 CG MET B -1 -13.004 23.819 -35.061 1.00 0.00 C ATOM 1265 SD MET B -1 -11.816 24.137 -33.731 1.00 0.00 S ATOM 1266 CE MET B -1 -11.367 25.845 -34.140 1.00 0.00 C ATOM 0 H MET B -1 -16.544 23.305 -35.613 1.00 0.00 H new ATOM 0 HA MET B -1 -14.198 22.155 -36.958 1.00 0.00 H new ATOM 0 HB2 MET B -1 -14.378 22.581 -33.958 1.00 0.00 H new ATOM 0 HB3 MET B -1 -13.132 21.685 -34.804 1.00 0.00 H new ATOM 0 HG2 MET B -1 -12.467 23.773 -36.008 1.00 0.00 H new ATOM 0 HG3 MET B -1 -13.693 24.662 -35.126 1.00 0.00 H new ATOM 0 HE1 MET B -1 -10.636 26.211 -33.419 1.00 0.00 H new ATOM 0 HE2 MET B -1 -10.938 25.879 -35.141 1.00 0.00 H new ATOM 0 HE3 MET B -1 -12.257 26.473 -34.105 1.00 0.00 H new ATOM 1276 N ASP B 674 -15.184 19.873 -36.342 1.00 0.00 N ATOM 1277 CA ASP B 674 -15.900 18.590 -36.278 1.00 0.00 C ATOM 1278 C ASP B 674 -14.936 17.398 -36.286 1.00 0.00 C ATOM 1279 O ASP B 674 -15.348 16.240 -36.382 1.00 0.00 O ATOM 1280 CB ASP B 674 -16.831 18.521 -37.495 1.00 0.00 C ATOM 1281 CG ASP B 674 -17.816 17.339 -37.436 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -18.567 17.219 -36.435 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -17.909 16.577 -38.428 1.00 0.00 O ATOM 0 H ASP B 674 -14.318 19.824 -36.879 1.00 0.00 H new ATOM 0 HA ASP B 674 -16.463 18.535 -35.346 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -17.394 19.452 -37.568 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -16.230 18.440 -38.401 1.00 0.00 H new ATOM 1288 N GLU B 675 -13.638 17.683 -36.211 1.00 0.00 N ATOM 1289 CA GLU B 675 -12.560 16.719 -36.369 1.00 0.00 C ATOM 1290 C GLU B 675 -11.385 17.181 -35.495 1.00 0.00 C ATOM 1291 O GLU B 675 -11.621 17.691 -34.398 1.00 0.00 O ATOM 1292 CB GLU B 675 -12.247 16.535 -37.871 1.00 0.00 C ATOM 1293 CG GLU B 675 -11.874 17.819 -38.634 1.00 0.00 C ATOM 1294 CD GLU B 675 -11.547 17.512 -40.107 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -10.387 17.138 -40.409 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -12.436 17.659 -40.980 1.00 0.00 O ATOM 0 H GLU B 675 -13.299 18.628 -36.032 1.00 0.00 H new ATOM 0 HA GLU B 675 -12.828 15.721 -36.021 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -11.426 15.824 -37.969 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -13.116 16.087 -38.353 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -12.699 18.530 -38.582 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -11.015 18.292 -38.158 1.00 0.00 H new ATOM 1303 N LYS B 676 -10.133 17.056 -35.971 1.00 0.00 N ATOM 1304 CA LYS B 676 -8.932 17.636 -35.356 1.00 0.00 C ATOM 1305 C LYS B 676 -8.872 17.420 -33.837 1.00 0.00 C ATOM 1306 O LYS B 676 -8.880 18.375 -33.055 1.00 0.00 O ATOM 1307 CB LYS B 676 -8.703 19.094 -35.812 1.00 0.00 C ATOM 1308 CG LYS B 676 -9.891 20.070 -35.627 1.00 0.00 C ATOM 1309 CD LYS B 676 -9.422 21.532 -35.575 1.00 0.00 C ATOM 1310 CE LYS B 676 -8.895 21.846 -34.161 1.00 0.00 C ATOM 1311 NZ LYS B 676 -8.216 23.171 -34.085 1.00 0.00 N ATOM 0 H LYS B 676 -9.926 16.532 -36.821 1.00 0.00 H new ATOM 0 HA LYS B 676 -8.073 17.080 -35.731 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -7.847 19.491 -35.267 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -8.432 19.083 -36.868 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -10.597 19.943 -36.447 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -10.423 19.826 -34.708 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -8.639 21.702 -36.314 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -10.246 22.200 -35.825 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -9.725 21.826 -33.455 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -8.198 21.066 -33.855 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -7.880 23.334 -33.114 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -7.407 23.184 -34.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -8.887 23.920 -34.350 1.00 0.00 H new ATOM 1325 N ILE B 677 -8.802 16.139 -33.450 1.00 0.00 N ATOM 1326 CA ILE B 677 -8.529 15.690 -32.083 1.00 0.00 C ATOM 1327 C ILE B 677 -7.388 16.547 -31.523 1.00 0.00 C ATOM 1328 O ILE B 677 -6.382 16.761 -32.215 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.161 14.182 -32.058 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.340 13.240 -32.395 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.611 13.761 -30.679 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.810 13.244 -33.857 1.00 0.00 C ATOM 0 H ILE B 677 -8.938 15.366 -34.101 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.419 15.808 -31.465 1.00 0.00 H new ATOM 0 HB ILE B 677 -7.404 14.077 -32.835 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -9.053 12.223 -32.129 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.186 13.508 -31.762 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.363 12.700 -30.695 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.716 14.340 -30.452 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.366 13.946 -29.914 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -10.640 12.547 -33.974 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -10.137 14.247 -34.131 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -8.987 12.941 -34.505 1.00 0.00 H new ATOM 1344 N THR B 678 -7.519 16.999 -30.275 1.00 0.00 N ATOM 1345 CA THR B 678 -6.496 17.780 -29.606 1.00 0.00 C ATOM 1346 C THR B 678 -5.743 16.899 -28.608 1.00 0.00 C ATOM 1347 O THR B 678 -6.261 15.906 -28.085 1.00 0.00 O ATOM 1348 CB THR B 678 -7.116 19.067 -29.022 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.083 20.008 -28.782 1.00 0.00 O ATOM 1350 CG2 THR B 678 -7.918 18.872 -27.731 1.00 0.00 C ATOM 0 H THR B 678 -8.346 16.829 -29.703 1.00 0.00 H new ATOM 0 HA THR B 678 -5.738 18.126 -30.309 1.00 0.00 H new ATOM 0 HB THR B 678 -7.830 19.417 -29.767 1.00 0.00 H new ATOM 0 HG1 THR B 678 -6.468 20.830 -28.412 1.00 0.00 H new ATOM 0 HG21 THR B 678 -8.313 19.832 -27.399 1.00 0.00 H new ATOM 0 HG22 THR B 678 -8.743 18.184 -27.916 1.00 0.00 H new ATOM 0 HG23 THR B 678 -7.269 18.460 -26.958 1.00 0.00 H new ATOM 1358 N PHE B 679 -4.499 17.298 -28.339 1.00 0.00 N ATOM 1359 CA PHE B 679 -3.592 16.694 -27.380 1.00 0.00 C ATOM 1360 C PHE B 679 -3.249 17.788 -26.346 1.00 0.00 C ATOM 1361 O PHE B 679 -2.318 18.567 -26.564 1.00 0.00 O ATOM 1362 CB PHE B 679 -2.388 16.088 -28.101 1.00 0.00 C ATOM 1363 CG PHE B 679 -2.669 14.716 -28.692 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -2.736 13.573 -27.865 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -2.857 14.568 -30.079 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -2.946 12.298 -28.416 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.070 13.293 -30.637 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.100 12.154 -29.808 1.00 0.00 C ATOM 0 H PHE B 679 -4.080 18.097 -28.815 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.036 15.854 -26.846 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.074 16.762 -28.898 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -1.555 16.011 -27.402 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -2.624 13.681 -26.796 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -2.838 15.438 -30.719 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -2.989 11.431 -27.774 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -3.211 13.188 -31.703 1.00 0.00 H new ATOM 0 HZ PHE B 679 -3.241 11.174 -30.239 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.074 17.931 -25.286 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.001 19.000 -24.289 1.00 0.00 C ATOM 1380 C PRO B 680 -2.833 18.822 -23.301 1.00 0.00 C ATOM 1381 O PRO B 680 -2.092 17.842 -23.340 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.350 18.908 -23.550 1.00 0.00 C ATOM 1383 CG PRO B 680 -5.568 17.397 -23.543 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.188 17.051 -24.975 1.00 0.00 C ATOM 0 HA PRO B 680 -3.823 19.967 -24.759 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.299 19.323 -22.543 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.145 19.438 -24.074 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -4.936 16.891 -22.813 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -6.599 17.129 -23.312 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -4.902 16.003 -25.066 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.023 17.214 -25.656 1.00 0.00 H new ATOM 1392 N SER B 681 -2.765 19.721 -22.318 1.00 0.00 N ATOM 1393 CA SER B 681 -1.780 19.757 -21.244 1.00 0.00 C ATOM 1394 C SER B 681 -1.769 18.521 -20.324 1.00 0.00 C ATOM 1395 O SER B 681 -0.907 18.461 -19.445 1.00 0.00 O ATOM 1396 CB SER B 681 -2.009 21.037 -20.427 1.00 0.00 C ATOM 1397 OG SER B 681 -2.225 22.153 -21.286 1.00 0.00 O ATOM 0 H SER B 681 -3.436 20.486 -22.249 1.00 0.00 H new ATOM 0 HA SER B 681 -0.797 19.749 -21.716 1.00 0.00 H new ATOM 0 HB2 SER B 681 -2.869 20.906 -19.770 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.146 21.226 -19.788 1.00 0.00 H new ATOM 0 HG SER B 681 -2.371 22.958 -20.746 1.00 0.00 H new ATOM 1403 N ASP B 682 -2.666 17.532 -20.503 1.00 0.00 N ATOM 1404 CA ASP B 682 -2.575 16.246 -19.796 1.00 0.00 C ATOM 1405 C ASP B 682 -2.673 15.007 -20.691 1.00 0.00 C ATOM 1406 O ASP B 682 -2.648 13.886 -20.177 1.00 0.00 O ATOM 1407 CB ASP B 682 -3.561 16.174 -18.622 1.00 0.00 C ATOM 1408 CG ASP B 682 -2.851 16.583 -17.317 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -1.822 15.962 -16.957 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -3.315 17.542 -16.651 1.00 0.00 O ATOM 0 H ASP B 682 -3.464 17.603 -21.135 1.00 0.00 H new ATOM 0 HA ASP B 682 -1.560 16.221 -19.399 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -4.409 16.833 -18.807 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -3.957 15.163 -18.530 1.00 0.00 H new ATOM 1415 N ILE B 683 -2.794 15.160 -22.015 1.00 0.00 N ATOM 1416 CA ILE B 683 -2.840 14.040 -22.948 1.00 0.00 C ATOM 1417 C ILE B 683 -1.992 14.384 -24.182 1.00 0.00 C ATOM 1418 O ILE B 683 -2.307 15.350 -24.870 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.298 13.696 -23.302 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.049 13.052 -22.118 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.327 12.777 -24.545 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -5.771 13.983 -21.157 1.00 0.00 C ATOM 0 H ILE B 683 -2.863 16.072 -22.467 1.00 0.00 H new ATOM 0 HA ILE B 683 -2.417 13.146 -22.490 1.00 0.00 H new ATOM 0 HB ILE B 683 -4.819 14.626 -23.530 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -5.781 12.353 -22.523 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -4.332 12.465 -21.544 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.360 12.534 -24.794 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -3.861 13.289 -25.387 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -3.780 11.859 -24.331 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.254 13.396 -20.376 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.053 14.668 -20.705 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.524 14.554 -21.700 1.00 0.00 H new ATOM 1434 N ASP B 684 -0.944 13.610 -24.498 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.064 13.829 -25.654 1.00 0.00 C ATOM 1436 C ASP B 684 0.083 12.548 -26.503 1.00 0.00 C ATOM 1437 O ASP B 684 -0.246 11.454 -26.029 1.00 0.00 O ATOM 1438 CB ASP B 684 1.309 14.398 -25.253 1.00 0.00 C ATOM 1439 CG ASP B 684 2.447 13.366 -25.394 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.476 12.370 -24.640 1.00 0.00 O ATOM 1441 OD2 ASP B 684 3.293 13.531 -26.301 1.00 0.00 O ATOM 0 H ASP B 684 -0.679 12.796 -23.944 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.546 14.586 -26.272 1.00 0.00 H new ATOM 0 HB2 ASP B 684 1.533 15.266 -25.873 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.266 14.746 -24.221 1.00 0.00 H new ATOM 1446 N PRO B 685 0.538 12.658 -27.767 1.00 0.00 N ATOM 1447 CA PRO B 685 0.759 11.506 -28.624 1.00 0.00 C ATOM 1448 C PRO B 685 1.650 10.424 -28.012 1.00 0.00 C ATOM 1449 O PRO B 685 1.388 9.251 -28.254 1.00 0.00 O ATOM 1450 CB PRO B 685 1.379 12.046 -29.915 1.00 0.00 C ATOM 1451 CG PRO B 685 0.869 13.480 -29.979 1.00 0.00 C ATOM 1452 CD PRO B 685 0.806 13.885 -28.509 1.00 0.00 C ATOM 0 HA PRO B 685 -0.195 11.006 -28.791 1.00 0.00 H new ATOM 0 HB2 PRO B 685 2.468 12.008 -29.884 1.00 0.00 H new ATOM 0 HB3 PRO B 685 1.064 11.468 -30.784 1.00 0.00 H new ATOM 0 HG2 PRO B 685 1.541 14.123 -30.547 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -0.109 13.540 -30.457 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.744 14.338 -28.188 1.00 0.00 H new ATOM 0 HD3 PRO B 685 0.021 14.623 -28.340 1.00 0.00 H new ATOM 1460 N GLN B 686 2.691 10.756 -27.234 1.00 0.00 N ATOM 1461 CA GLN B 686 3.645 9.755 -26.772 1.00 0.00 C ATOM 1462 C GLN B 686 2.974 8.679 -25.915 1.00 0.00 C ATOM 1463 O GLN B 686 3.051 7.515 -26.313 1.00 0.00 O ATOM 1464 CB GLN B 686 4.905 10.404 -26.165 1.00 0.00 C ATOM 1465 CG GLN B 686 5.638 9.595 -25.069 1.00 0.00 C ATOM 1466 CD GLN B 686 5.332 9.996 -23.615 1.00 0.00 C ATOM 1467 OE1 GLN B 686 5.836 9.383 -22.676 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.525 11.010 -23.362 1.00 0.00 N ATOM 0 H GLN B 686 2.887 11.705 -26.917 1.00 0.00 H new ATOM 0 HA GLN B 686 4.019 9.206 -27.636 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.610 10.601 -26.973 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.623 11.370 -25.745 1.00 0.00 H new ATOM 0 HG2 GLN B 686 5.388 8.542 -25.195 1.00 0.00 H new ATOM 0 HG3 GLN B 686 6.712 9.689 -25.233 1.00 0.00 H new ATOM 0 HE21 GLN B 686 4.100 11.528 -24.131 1.00 0.00 H new ATOM 0 HE22 GLN B 686 4.327 11.276 -22.397 1.00 0.00 H new ATOM 1477 N VAL B 687 2.291 8.979 -24.798 1.00 0.00 N ATOM 1478 CA VAL B 687 1.681 7.901 -24.040 1.00 0.00 C ATOM 1479 C VAL B 687 0.639 7.200 -24.901 1.00 0.00 C ATOM 1480 O VAL B 687 0.489 5.991 -24.767 1.00 0.00 O ATOM 1481 CB VAL B 687 1.082 8.430 -22.740 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.732 7.292 -21.779 1.00 0.00 C ATOM 1483 CG2 VAL B 687 2.063 9.381 -22.042 1.00 0.00 C ATOM 0 H VAL B 687 2.156 9.917 -24.421 1.00 0.00 H new ATOM 0 HA VAL B 687 2.443 7.171 -23.767 1.00 0.00 H new ATOM 0 HB VAL B 687 0.169 8.965 -23.003 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.308 7.706 -20.864 1.00 0.00 H new ATOM 0 HG12 VAL B 687 0.005 6.630 -22.249 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.634 6.729 -21.539 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.618 9.748 -21.117 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.986 8.848 -21.814 1.00 0.00 H new ATOM 0 HG23 VAL B 687 2.282 10.223 -22.698 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.032 7.904 -25.821 1.00 0.00 N ATOM 1494 CA PHE B 688 -0.997 7.282 -26.709 1.00 0.00 C ATOM 1495 C PHE B 688 -0.345 6.241 -27.630 1.00 0.00 C ATOM 1496 O PHE B 688 -0.922 5.184 -27.891 1.00 0.00 O ATOM 1497 CB PHE B 688 -1.723 8.370 -27.513 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.042 7.913 -28.092 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.056 7.498 -27.211 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.275 7.927 -29.478 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.311 7.112 -27.701 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -4.528 7.516 -29.976 1.00 0.00 C ATOM 1503 CZ PHE B 688 -5.533 7.090 -29.088 1.00 0.00 C ATOM 0 H PHE B 688 0.083 8.908 -25.963 1.00 0.00 H new ATOM 0 HA PHE B 688 -1.725 6.740 -26.105 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -1.897 9.232 -26.868 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.076 8.704 -28.324 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -3.866 7.476 -26.148 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -2.500 8.250 -30.157 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.100 6.834 -27.018 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -4.717 7.528 -31.039 1.00 0.00 H new ATOM 0 HZ PHE B 688 -6.480 6.744 -29.475 1.00 0.00 H new ATOM 1513 N TYR B 689 0.866 6.517 -28.107 1.00 0.00 N ATOM 1514 CA TYR B 689 1.652 5.632 -28.956 1.00 0.00 C ATOM 1515 C TYR B 689 2.295 4.500 -28.156 1.00 0.00 C ATOM 1516 O TYR B 689 2.720 3.498 -28.740 1.00 0.00 O ATOM 1517 CB TYR B 689 2.731 6.449 -29.685 1.00 0.00 C ATOM 1518 CG TYR B 689 2.248 7.481 -30.698 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.905 7.533 -31.133 1.00 0.00 C ATOM 1520 CD2 TYR B 689 3.179 8.396 -31.226 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.502 8.471 -32.099 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.784 9.344 -32.189 1.00 0.00 C ATOM 1523 CZ TYR B 689 1.443 9.379 -32.639 1.00 0.00 C ATOM 1524 OH TYR B 689 1.040 10.286 -33.578 1.00 0.00 O ATOM 0 H TYR B 689 1.342 7.396 -27.904 1.00 0.00 H new ATOM 0 HA TYR B 689 0.981 5.174 -29.683 1.00 0.00 H new ATOM 0 HB2 TYR B 689 3.331 6.965 -28.935 1.00 0.00 H new ATOM 0 HB3 TYR B 689 3.394 5.753 -30.199 1.00 0.00 H new ATOM 0 HD1 TYR B 689 0.182 6.846 -30.720 1.00 0.00 H new ATOM 0 HD2 TYR B 689 4.205 8.370 -30.889 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.526 8.499 -32.429 1.00 0.00 H new ATOM 0 HE2 TYR B 689 3.505 10.045 -32.584 1.00 0.00 H new ATOM 0 HH TYR B 689 1.803 10.838 -33.848 1.00 0.00 H new ATOM 1534 N GLU B 690 2.363 4.645 -26.835 1.00 0.00 N ATOM 1535 CA GLU B 690 3.122 3.765 -25.961 1.00 0.00 C ATOM 1536 C GLU B 690 2.205 2.797 -25.211 1.00 0.00 C ATOM 1537 O GLU B 690 2.600 1.653 -24.957 1.00 0.00 O ATOM 1538 CB GLU B 690 3.923 4.674 -25.009 1.00 0.00 C ATOM 1539 CG GLU B 690 4.202 4.102 -23.621 1.00 0.00 C ATOM 1540 CD GLU B 690 4.892 5.136 -22.722 1.00 0.00 C ATOM 1541 OE1 GLU B 690 4.178 5.921 -22.049 1.00 0.00 O ATOM 1542 OE2 GLU B 690 6.143 5.167 -22.655 1.00 0.00 O ATOM 0 H GLU B 690 1.882 5.393 -26.336 1.00 0.00 H new ATOM 0 HA GLU B 690 3.800 3.131 -26.532 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.876 4.912 -25.481 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.381 5.613 -24.892 1.00 0.00 H new ATOM 0 HG2 GLU B 690 3.266 3.784 -23.161 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.831 3.216 -23.710 1.00 0.00 H new ATOM 1549 N LEU B 691 0.993 3.238 -24.855 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.024 2.382 -24.275 1.00 0.00 C ATOM 1551 C LEU B 691 -0.399 1.273 -25.264 1.00 0.00 C ATOM 1552 O LEU B 691 -0.053 1.327 -26.450 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.216 3.211 -23.750 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.068 4.025 -24.742 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -2.844 3.189 -25.745 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -3.066 4.874 -23.941 1.00 0.00 C ATOM 0 H LEU B 691 0.697 4.208 -24.966 1.00 0.00 H new ATOM 0 HA LEU B 691 0.371 1.877 -23.393 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.886 2.527 -23.229 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -0.828 3.906 -23.005 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.370 4.629 -25.322 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.414 3.846 -26.402 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.149 2.596 -26.339 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.526 2.525 -25.215 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.679 5.458 -24.627 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -3.706 4.220 -23.349 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.522 5.547 -23.278 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.115 0.269 -24.755 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.545 -0.895 -25.518 1.00 0.00 C ATOM 1570 C ALA B 692 -2.180 -0.459 -26.835 1.00 0.00 C ATOM 1571 O ALA B 692 -3.135 0.316 -26.826 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.545 -1.689 -24.674 1.00 0.00 C ATOM 0 H ALA B 692 -1.416 0.246 -23.781 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.686 -1.523 -25.753 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -2.877 -2.565 -25.232 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.067 -2.008 -23.748 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.404 -1.060 -24.441 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.693 -0.972 -27.963 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.178 -0.561 -29.280 1.00 0.00 C ATOM 1580 C GLU B 693 -3.675 -0.759 -29.387 1.00 0.00 C ATOM 1581 O GLU B 693 -4.368 0.096 -29.922 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.507 -1.381 -30.377 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.129 -0.787 -30.715 1.00 0.00 C ATOM 1584 CD GLU B 693 0.623 -1.650 -31.743 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.474 -1.422 -32.969 1.00 0.00 O ATOM 1586 OE2 GLU B 693 1.381 -2.560 -31.330 1.00 0.00 O ATOM 0 H GLU B 693 -0.958 -1.678 -27.991 1.00 0.00 H new ATOM 0 HA GLU B 693 -1.936 0.495 -29.403 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.396 -2.415 -30.052 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.135 -1.393 -31.268 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.254 0.222 -31.108 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.465 -0.704 -29.805 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.193 -1.852 -28.825 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.608 -2.126 -28.922 1.00 0.00 C ATOM 1595 C ALA B 694 -6.426 -1.019 -28.232 1.00 0.00 C ATOM 1596 O ALA B 694 -7.443 -0.579 -28.764 1.00 0.00 O ATOM 1597 CB ALA B 694 -5.884 -3.496 -28.307 1.00 0.00 C ATOM 0 H ALA B 694 -3.655 -2.547 -28.307 1.00 0.00 H new ATOM 0 HA ALA B 694 -5.913 -2.139 -29.968 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -6.949 -3.717 -28.373 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.322 -4.257 -28.847 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.578 -3.493 -27.261 1.00 0.00 H new ATOM 1603 N VAL B 695 -5.935 -0.509 -27.093 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.528 0.636 -26.402 1.00 0.00 C ATOM 1605 C VAL B 695 -6.393 1.885 -27.268 1.00 0.00 C ATOM 1606 O VAL B 695 -7.353 2.646 -27.354 1.00 0.00 O ATOM 1607 CB VAL B 695 -5.877 0.809 -25.012 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.015 2.209 -24.401 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.481 -0.190 -24.022 1.00 0.00 C ATOM 0 H VAL B 695 -5.110 -0.885 -26.626 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.592 0.464 -26.239 1.00 0.00 H new ATOM 0 HB VAL B 695 -4.814 0.635 -25.182 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.527 2.231 -23.427 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.546 2.941 -25.058 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.071 2.452 -24.283 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.016 -0.060 -23.045 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.554 -0.017 -23.939 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.304 -1.206 -24.376 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.248 2.116 -27.922 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.073 3.262 -28.808 1.00 0.00 C ATOM 1621 C GLN B 696 -6.114 3.217 -29.926 1.00 0.00 C ATOM 1622 O GLN B 696 -6.750 4.229 -30.187 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.646 3.261 -29.370 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.316 4.463 -30.252 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.086 4.161 -31.103 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.148 4.078 -32.327 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -0.956 3.930 -30.459 1.00 0.00 N ATOM 0 H GLN B 696 -4.426 1.516 -27.850 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.220 4.187 -28.251 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -2.941 3.231 -28.539 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.497 2.349 -29.948 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.165 4.697 -30.894 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.133 5.341 -29.632 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -0.924 4.004 -29.442 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.115 3.678 -30.979 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.327 2.069 -30.570 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.317 1.934 -31.646 1.00 0.00 C ATOM 1638 C LYS B 697 -8.729 2.182 -31.117 1.00 0.00 C ATOM 1639 O LYS B 697 -9.466 2.971 -31.707 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.228 0.534 -32.282 1.00 0.00 C ATOM 1641 CG LYS B 697 -5.885 0.229 -32.966 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.505 1.174 -34.123 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.522 1.262 -35.277 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.660 -0.012 -36.037 1.00 0.00 N ATOM 0 H LYS B 697 -5.821 1.208 -30.363 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.097 2.682 -32.407 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.406 -0.214 -31.510 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.027 0.431 -33.016 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.097 0.267 -32.214 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -5.914 -0.792 -33.347 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.357 2.175 -33.717 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.547 0.851 -34.531 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.495 1.544 -34.874 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -6.218 2.054 -35.961 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.357 0.112 -36.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.741 -0.272 -36.448 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -6.978 -0.766 -35.395 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.082 1.541 -30.002 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.376 1.729 -29.335 1.00 0.00 C ATOM 1660 C GLU B 698 -10.610 3.219 -29.066 1.00 0.00 C ATOM 1661 O GLU B 698 -11.666 3.761 -29.394 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.423 0.962 -27.996 1.00 0.00 C ATOM 1663 CG GLU B 698 -10.724 -0.536 -28.124 1.00 0.00 C ATOM 1664 CD GLU B 698 -10.547 -1.278 -26.780 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -11.099 -0.829 -25.745 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -9.884 -2.345 -26.755 1.00 0.00 O ATOM 0 H GLU B 698 -8.475 0.871 -29.531 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.155 1.341 -29.991 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -9.466 1.084 -27.490 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -11.181 1.418 -27.359 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -11.745 -0.672 -28.481 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -10.064 -0.976 -28.871 1.00 0.00 H new ATOM 1673 N LEU B 699 -9.608 3.885 -28.488 1.00 0.00 N ATOM 1674 CA LEU B 699 -9.686 5.289 -28.109 1.00 0.00 C ATOM 1675 C LEU B 699 -9.761 6.163 -29.328 1.00 0.00 C ATOM 1676 O LEU B 699 -10.587 7.050 -29.354 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.447 5.709 -27.319 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.558 5.345 -25.839 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.156 5.336 -25.214 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.464 6.348 -25.095 1.00 0.00 C ATOM 0 H LEU B 699 -8.710 3.454 -28.269 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.581 5.407 -27.499 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.566 5.229 -27.745 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.302 6.785 -27.417 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.005 4.355 -25.750 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.230 5.077 -24.158 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.534 4.601 -25.725 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -6.707 6.324 -25.314 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.529 6.069 -24.043 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.044 7.350 -25.180 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.461 6.334 -25.536 1.00 0.00 H new ATOM 1692 N LEU B 700 -8.926 5.938 -30.335 1.00 0.00 N ATOM 1693 CA LEU B 700 -8.862 6.772 -31.520 1.00 0.00 C ATOM 1694 C LEU B 700 -10.208 6.801 -32.230 1.00 0.00 C ATOM 1695 O LEU B 700 -10.660 7.863 -32.652 1.00 0.00 O ATOM 1696 CB LEU B 700 -7.747 6.218 -32.413 1.00 0.00 C ATOM 1697 CG LEU B 700 -7.547 6.993 -33.727 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.236 8.474 -33.472 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.389 6.344 -34.487 1.00 0.00 C ATOM 0 H LEU B 700 -8.267 5.160 -30.348 1.00 0.00 H new ATOM 0 HA LEU B 700 -8.636 7.806 -31.258 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -6.811 6.226 -31.854 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -7.969 5.177 -32.648 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.468 6.952 -34.308 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.102 8.987 -34.424 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.062 8.931 -32.927 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.323 8.558 -32.883 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.226 6.875 -35.425 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.484 6.391 -33.881 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.631 5.302 -34.698 1.00 0.00 H new ATOM 1711 N ALA B 701 -10.881 5.650 -32.302 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.240 5.582 -32.807 1.00 0.00 C ATOM 1713 C ALA B 701 -13.179 6.401 -31.918 1.00 0.00 C ATOM 1714 O ALA B 701 -13.993 7.154 -32.435 1.00 0.00 O ATOM 1715 CB ALA B 701 -12.674 4.118 -32.908 1.00 0.00 C ATOM 0 H ALA B 701 -10.497 4.750 -32.013 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.285 6.016 -33.806 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -13.695 4.066 -33.287 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.007 3.587 -33.587 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.630 3.656 -31.922 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.045 6.321 -30.596 1.00 0.00 N ATOM 1722 CA GLU B 702 -13.787 7.156 -29.654 1.00 0.00 C ATOM 1723 C GLU B 702 -13.546 8.646 -29.942 1.00 0.00 C ATOM 1724 O GLU B 702 -14.488 9.423 -30.082 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.370 6.797 -28.211 1.00 0.00 C ATOM 1726 CG GLU B 702 -14.529 6.657 -27.224 1.00 0.00 C ATOM 1727 CD GLU B 702 -15.247 5.303 -27.344 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.088 5.129 -28.258 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -14.971 4.417 -26.497 1.00 0.00 O ATOM 0 H GLU B 702 -12.409 5.665 -30.143 1.00 0.00 H new ATOM 0 HA GLU B 702 -14.854 6.967 -29.771 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -12.813 5.860 -28.231 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -12.689 7.564 -27.843 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -14.153 6.776 -26.208 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.246 7.460 -27.394 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.292 9.062 -30.080 1.00 0.00 N ATOM 1737 CA TRP B 703 -11.885 10.446 -30.197 1.00 0.00 C ATOM 1738 C TRP B 703 -12.359 11.040 -31.533 1.00 0.00 C ATOM 1739 O TRP B 703 -12.719 12.216 -31.594 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.357 10.474 -30.027 1.00 0.00 C ATOM 1741 CG TRP B 703 -9.775 9.895 -28.755 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.444 9.426 -27.672 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.381 9.858 -28.348 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.579 9.151 -26.635 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.300 9.472 -26.982 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.187 10.231 -28.973 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.147 9.602 -26.215 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.001 10.371 -28.219 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -5.995 10.112 -26.828 1.00 0.00 C ATOM 0 H TRP B 703 -11.505 8.414 -30.114 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.342 11.070 -29.430 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -9.917 9.940 -30.869 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.031 11.511 -30.102 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.514 9.286 -27.628 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -9.857 8.762 -25.734 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.172 10.413 -30.037 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.140 9.317 -25.173 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.089 10.679 -28.709 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.108 10.306 -26.243 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.429 10.218 -32.589 1.00 0.00 N ATOM 1761 CA LYS B 704 -12.871 10.662 -33.913 1.00 0.00 C ATOM 1762 C LYS B 704 -14.373 10.487 -34.141 1.00 0.00 C ATOM 1763 O LYS B 704 -14.912 11.132 -35.039 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.016 9.992 -35.006 1.00 0.00 C ATOM 1765 CG LYS B 704 -12.520 8.622 -35.481 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.470 7.944 -36.376 1.00 0.00 C ATOM 1767 CE LYS B 704 -11.952 6.614 -36.985 1.00 0.00 C ATOM 1768 NZ LYS B 704 -12.940 6.795 -38.088 1.00 0.00 N ATOM 0 H LYS B 704 -12.181 9.230 -32.547 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.712 11.739 -33.971 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -11.965 10.660 -35.865 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -10.999 9.877 -34.630 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -12.737 7.989 -34.620 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -13.453 8.742 -36.031 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.195 8.625 -37.181 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -10.568 7.762 -35.791 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -11.091 6.063 -37.364 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -12.401 6.005 -36.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -13.225 5.865 -38.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -13.777 7.295 -37.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -12.508 7.352 -38.853 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.070 9.639 -33.366 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.518 9.434 -33.560 1.00 0.00 C ATOM 1784 C ARG B 705 -17.282 10.541 -32.852 1.00 0.00 C ATOM 1785 O ARG B 705 -18.294 11.022 -33.359 1.00 0.00 O ATOM 1786 CB ARG B 705 -16.981 8.018 -33.146 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.138 7.811 -31.630 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.081 6.358 -31.165 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.235 5.549 -31.601 1.00 0.00 N ATOM 1790 CZ ARG B 705 -18.687 4.453 -30.970 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -18.120 4.019 -29.843 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -19.717 3.785 -31.483 1.00 0.00 N ATOM 0 H ARG B 705 -14.662 9.090 -32.609 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.739 9.494 -34.626 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -17.935 7.807 -33.629 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.264 7.290 -33.526 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.354 8.370 -31.120 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -18.090 8.239 -31.317 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.166 5.901 -31.541 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -17.024 6.336 -30.077 1.00 0.00 H new ATOM 0 HE ARG B 705 -18.726 5.844 -32.445 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -17.327 4.522 -29.444 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -18.479 3.184 -29.380 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -20.154 4.107 -32.346 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -20.069 2.951 -31.013 1.00 0.00 H new ATOM 1806 N THR B 706 -16.777 10.959 -31.692 1.00 0.00 N ATOM 1807 CA THR B 706 -17.243 12.143 -30.985 1.00 0.00 C ATOM 1808 C THR B 706 -16.968 13.362 -31.873 1.00 0.00 C ATOM 1809 O THR B 706 -17.797 14.272 -31.974 1.00 0.00 O ATOM 1810 CB THR B 706 -16.541 12.205 -29.626 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.140 12.121 -29.785 1.00 0.00 O ATOM 1812 CG2 THR B 706 -16.960 11.014 -28.767 1.00 0.00 C ATOM 0 H THR B 706 -16.019 10.473 -31.212 1.00 0.00 H new ATOM 0 HA THR B 706 -18.315 12.118 -30.787 1.00 0.00 H new ATOM 0 HB THR B 706 -16.819 13.149 -29.156 1.00 0.00 H new ATOM 0 HG1 THR B 706 -14.870 11.179 -29.810 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.456 11.066 -27.802 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.039 11.037 -28.614 1.00 0.00 H new ATOM 0 HG23 THR B 706 -16.685 10.087 -29.271 1.00 0.00 H new ATOM 1820 N GLY B 707 -15.827 13.328 -32.568 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.460 14.241 -33.630 1.00 0.00 C ATOM 1822 C GLY B 707 -14.273 15.069 -33.186 1.00 0.00 C ATOM 1823 O GLY B 707 -13.150 14.837 -33.638 1.00 0.00 O ATOM 0 H GLY B 707 -15.108 12.627 -32.389 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.213 13.685 -34.535 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.301 14.890 -33.874 1.00 0.00 H new ATOM 1827 N SER B 708 -14.526 15.949 -32.216 1.00 0.00 N ATOM 1828 CA SER B 708 -13.527 16.836 -31.635 1.00 0.00 C ATOM 1829 C SER B 708 -13.163 16.348 -30.225 1.00 0.00 C ATOM 1830 O SER B 708 -12.895 17.163 -29.339 1.00 0.00 O ATOM 1831 CB SER B 708 -14.035 18.291 -31.674 1.00 0.00 C ATOM 1832 OG SER B 708 -14.722 18.597 -32.888 1.00 0.00 O ATOM 0 H SER B 708 -15.453 16.064 -31.806 1.00 0.00 H new ATOM 0 HA SER B 708 -12.607 16.816 -32.219 1.00 0.00 H new ATOM 0 HB2 SER B 708 -14.702 18.462 -30.829 1.00 0.00 H new ATOM 0 HB3 SER B 708 -13.191 18.971 -31.556 1.00 0.00 H new ATOM 0 HG SER B 708 -15.026 19.528 -32.866 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.222 15.022 -30.001 1.00 0.00 N ATOM 1839 CA ASP B 709 -12.854 14.303 -28.774 1.00 0.00 C ATOM 1840 C ASP B 709 -13.537 14.773 -27.474 1.00 0.00 C ATOM 1841 O ASP B 709 -13.174 14.329 -26.382 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.324 14.232 -28.615 1.00 0.00 C ATOM 1843 CG ASP B 709 -10.642 15.552 -28.173 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -10.755 15.981 -26.994 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -9.926 16.134 -29.023 1.00 0.00 O ATOM 0 H ASP B 709 -13.551 14.383 -30.725 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.256 13.301 -28.923 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.087 13.458 -27.886 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -10.891 13.919 -29.565 1.00 0.00 H new ATOM 1850 N PHE B 710 -14.593 15.588 -27.586 1.00 0.00 N ATOM 1851 CA PHE B 710 -15.268 16.333 -26.535 1.00 0.00 C ATOM 1852 C PHE B 710 -14.311 17.282 -25.795 1.00 0.00 C ATOM 1853 O PHE B 710 -14.414 18.498 -25.985 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.016 15.391 -25.581 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.136 14.541 -26.163 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.048 15.055 -27.108 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.307 13.231 -25.680 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.107 14.252 -27.577 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.366 12.436 -26.144 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.268 12.945 -27.089 1.00 0.00 C ATOM 0 H PHE B 710 -15.028 15.752 -28.494 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.016 16.968 -27.009 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -15.285 14.720 -25.130 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -16.436 15.993 -24.775 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -17.935 16.065 -27.473 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -16.619 12.835 -24.948 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -19.795 14.642 -28.312 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.487 11.429 -25.772 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.085 12.333 -27.441 1.00 0.00 H new ATOM 1870 N HIS B 711 -13.410 16.761 -24.957 1.00 0.00 N ATOM 1871 CA HIS B 711 -12.574 17.524 -24.025 1.00 0.00 C ATOM 1872 C HIS B 711 -11.645 16.562 -23.281 1.00 0.00 C ATOM 1873 O HIS B 711 -11.816 16.305 -22.092 1.00 0.00 O ATOM 1874 CB HIS B 711 -13.411 18.400 -23.057 1.00 0.00 C ATOM 1875 CG HIS B 711 -14.738 17.827 -22.587 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -15.952 18.530 -22.593 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -14.962 16.571 -22.090 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -16.872 17.682 -22.105 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -16.307 16.500 -21.802 1.00 0.00 N ATOM 0 H HIS B 711 -13.236 15.757 -24.907 1.00 0.00 H new ATOM 0 HA HIS B 711 -11.968 18.227 -24.597 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -12.802 18.612 -22.178 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -13.607 19.354 -23.546 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -14.229 15.790 -21.951 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -17.918 17.916 -21.974 1.00 0.00 H new ATOM 0 HE2 HIS B 711 -16.793 15.687 -21.423 1.00 0.00 H new ATOM 1887 N ILE B 712 -10.688 15.958 -23.987 1.00 0.00 N ATOM 1888 CA ILE B 712 -9.873 14.869 -23.451 1.00 0.00 C ATOM 1889 C ILE B 712 -9.087 15.188 -22.176 1.00 0.00 C ATOM 1890 O ILE B 712 -8.840 14.266 -21.405 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.049 14.253 -24.607 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -9.923 13.141 -25.206 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -7.678 13.687 -24.228 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.251 12.397 -26.346 1.00 0.00 C ATOM 0 H ILE B 712 -10.457 16.211 -24.948 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.546 14.104 -23.064 1.00 0.00 H new ATOM 0 HB ILE B 712 -8.811 15.056 -25.305 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.183 12.431 -24.421 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -10.856 13.575 -25.565 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.193 13.283 -25.117 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.061 14.480 -23.807 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -7.803 12.894 -23.491 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -9.923 11.626 -26.723 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.015 13.096 -27.148 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.332 11.934 -25.987 1.00 0.00 H new ATOM 1906 N GLY B 713 -8.732 16.439 -21.887 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.084 16.810 -20.623 1.00 0.00 C ATOM 1908 C GLY B 713 -9.112 17.512 -19.741 1.00 0.00 C ATOM 1909 O GLY B 713 -8.897 18.655 -19.339 1.00 0.00 O ATOM 0 H GLY B 713 -8.884 17.225 -22.519 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -7.697 15.923 -20.121 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.235 17.467 -20.811 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.265 16.859 -19.553 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.458 17.416 -18.914 1.00 0.00 C ATOM 1915 C HIS B 714 -11.122 18.059 -17.560 1.00 0.00 C ATOM 1916 O HIS B 714 -10.385 17.473 -16.763 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.499 16.298 -18.751 1.00 0.00 C ATOM 1918 CG HIS B 714 -13.797 16.796 -18.169 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -14.306 16.457 -16.914 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -14.647 17.678 -18.773 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -15.449 17.153 -16.789 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -15.681 17.885 -17.892 1.00 0.00 N ATOM 0 H HIS B 714 -10.395 15.893 -19.854 1.00 0.00 H new ATOM 0 HA HIS B 714 -11.866 18.206 -19.545 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -12.692 15.842 -19.722 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -12.092 15.518 -18.107 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.530 18.124 -19.749 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -16.092 17.128 -15.922 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.487 18.491 -18.048 1.00 0.00 H new ATOM 1930 N LYS B 715 -11.660 19.254 -17.295 1.00 0.00 N ATOM 1931 CA LYS B 715 -11.445 19.996 -16.059 1.00 0.00 C ATOM 1932 C LYS B 715 -12.639 20.926 -15.882 1.00 0.00 C ATOM 1933 O LYS B 715 -13.509 20.640 -15.032 1.00 0.00 O ATOM 1934 CB LYS B 715 -10.117 20.771 -16.127 1.00 0.00 C ATOM 1935 CG LYS B 715 -9.803 21.526 -14.821 1.00 0.00 C ATOM 1936 CD LYS B 715 -9.075 22.863 -15.051 1.00 0.00 C ATOM 1937 CE LYS B 715 -10.023 24.071 -15.215 1.00 0.00 C ATOM 1938 NZ LYS B 715 -10.863 24.031 -16.444 1.00 0.00 N ATOM 1939 OXT LYS B 715 -12.710 21.944 -16.614 1.00 0.00 O ATOM 0 H LYS B 715 -12.270 19.739 -17.953 1.00 0.00 H new ATOM 0 HA LYS B 715 -11.370 19.328 -15.201 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -9.306 20.076 -16.344 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -10.157 21.482 -16.952 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -10.734 21.714 -14.286 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -9.190 20.892 -14.181 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -8.406 23.050 -14.211 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -8.453 22.778 -15.942 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -10.677 24.125 -14.344 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -9.429 24.985 -15.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -11.288 24.967 -16.605 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -10.272 23.774 -17.260 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -11.617 23.324 -16.326 1.00 0.00 H new TER 1953 LYS B 715