USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 832 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 84 ASN : amide:sc= -0.369 X(o=-1.2,f=-1.3) USER MOD Set 1.2: A 102 THR OG1 : rot -36:sc= -0.782! USER MOD Set 2.1: A 63 HIS : no HD1:sc= -5.45 K(o=-8.7,f=-7.4!) USER MOD Set 2.2: A 79 TYR OH : rot -66:sc= -3.25! USER MOD Set 3.1: A 55 THR OG1 : rot -179:sc= -6.56! USER MOD Set 3.2: A 57 GLN : amide:sc= -1.17 K(o=-7.7,f=-14!) USER MOD Set 4.1: A 5 SER OG : rot 180:sc= -0.232 USER MOD Set 4.2: A 14 HIS : no HD1:sc= -12.9! C(o=-13!,f=-18!) USER MOD Set 4.3: A 15 ASN : amide:sc= -0.0433 X(o=-13,f=-14) USER MOD Single : A 1 VAL N :NH3+ -148:sc= -0.206 (180deg=-1.41!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0.404 K(o=0.4,f=-4.7!) USER MOD Single : A 8 SER OG : rot 180:sc= 0.004 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.441 K(o=-0.44,f=-4.9!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -15:sc= -1.66 USER MOD Single : A 22 THR OG1 : rot 180:sc= -1.93! USER MOD Single : A 25 SER OG : rot -176:sc= 0.466 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.149 USER MOD Single : A 29 TYR OH : rot -84:sc= -2.07! USER MOD Single : A 30 SER OG : rot 177:sc= -1.01 USER MOD Single : A 32 ASN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A 33 SER OG : rot -31:sc= 0.803 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -100:sc= -1.69! USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 67:sc= 1.01 USER MOD Single : A 46 SER OG : rot -69:sc= 1.02 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 61:sc= 0.151 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -1.25 K(o=-1.3,f=-2.7) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 47:sc= 0.906 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 52:sc= 0.241 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.738! C(o=-0.74!,f=-8.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -124:sc= -0.0373 (180deg=-0.437) USER MOD Single : A 96 SER OG : rot -42:sc= -0.409! USER MOD Single : A 98 SER OG : rot 60:sc= -2.97! USER MOD Single : A 99 SER OG : rot -29:sc= -0.44 USER MOD Single : A 100 SER OG : rot 63:sc= 1.07 USER MOD Single : A 101 SER OG : rot 84:sc= -0.15! USER MOD Single : A 104 SER OG : rot 180:sc= -0.738 USER MOD Single : A 107 ASN : amide:sc= -3.43! C(o=-3.4!,f=-6.8!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.903 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 29.150 24.515 32.630 1.00 0.00 N ATOM 2 CA VAL A 1 28.586 23.325 31.930 1.00 0.00 C ATOM 3 C VAL A 1 27.878 23.757 30.642 1.00 0.00 C ATOM 4 O VAL A 1 27.569 24.917 30.453 1.00 0.00 O ATOM 5 CB VAL A 1 27.587 22.724 32.917 1.00 0.00 C ATOM 6 CG1 VAL A 1 26.955 21.471 32.309 1.00 0.00 C ATOM 7 CG2 VAL A 1 28.314 22.349 34.210 1.00 0.00 C ATOM 0 H1 VAL A 1 30.020 24.243 33.131 1.00 0.00 H new ATOM 0 H2 VAL A 1 29.369 25.256 31.934 1.00 0.00 H new ATOM 0 H3 VAL A 1 28.455 24.877 33.314 1.00 0.00 H new ATOM 0 HA VAL A 1 29.356 22.609 31.643 1.00 0.00 H new ATOM 0 HB VAL A 1 26.807 23.455 33.133 1.00 0.00 H new ATOM 0 HG11 VAL A 1 26.243 21.044 33.015 1.00 0.00 H new ATOM 0 HG12 VAL A 1 26.438 21.735 31.387 1.00 0.00 H new ATOM 0 HG13 VAL A 1 27.733 20.740 32.092 1.00 0.00 H new ATOM 0 HG21 VAL A 1 27.603 21.920 34.916 1.00 0.00 H new ATOM 0 HG22 VAL A 1 29.093 21.619 33.991 1.00 0.00 H new ATOM 0 HG23 VAL A 1 28.765 23.241 34.646 1.00 0.00 H new ATOM 19 N LYS A 2 27.620 22.835 29.756 1.00 0.00 N ATOM 20 CA LYS A 2 26.933 23.197 28.482 1.00 0.00 C ATOM 21 C LYS A 2 25.419 23.003 28.621 1.00 0.00 C ATOM 22 O LYS A 2 24.947 22.361 29.538 1.00 0.00 O ATOM 23 CB LYS A 2 27.506 22.237 27.440 1.00 0.00 C ATOM 24 CG LYS A 2 29.023 22.423 27.352 1.00 0.00 C ATOM 25 CD LYS A 2 29.589 21.503 26.268 1.00 0.00 C ATOM 26 CE LYS A 2 31.115 21.627 26.236 1.00 0.00 C ATOM 27 NZ LYS A 2 31.616 20.229 26.098 1.00 0.00 N ATOM 0 H LYS A 2 27.854 21.848 29.858 1.00 0.00 H new ATOM 0 HA LYS A 2 27.092 24.240 28.207 1.00 0.00 H new ATOM 0 HB2 LYS A 2 27.270 21.208 27.710 1.00 0.00 H new ATOM 0 HB3 LYS A 2 27.049 22.424 26.468 1.00 0.00 H new ATOM 0 HG2 LYS A 2 29.260 23.462 27.122 1.00 0.00 H new ATOM 0 HG3 LYS A 2 29.484 22.196 28.313 1.00 0.00 H new ATOM 0 HD2 LYS A 2 29.302 20.470 26.467 1.00 0.00 H new ATOM 0 HD3 LYS A 2 29.172 21.769 25.297 1.00 0.00 H new ATOM 0 HE2 LYS A 2 31.443 22.247 25.402 1.00 0.00 H new ATOM 0 HE3 LYS A 2 31.492 22.093 27.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 32.656 20.234 26.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 31.295 19.663 26.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 31.247 19.813 25.219 1.00 0.00 H new ATOM 41 N CYS A 3 24.653 23.555 27.717 1.00 0.00 N ATOM 42 CA CYS A 3 23.170 23.402 27.797 1.00 0.00 C ATOM 43 C CYS A 3 22.606 22.973 26.442 1.00 0.00 C ATOM 44 O CYS A 3 22.147 23.787 25.666 1.00 0.00 O ATOM 45 CB CYS A 3 22.646 24.787 28.173 1.00 0.00 C ATOM 46 SG CYS A 3 22.211 24.820 29.930 1.00 0.00 S ATOM 0 H CYS A 3 24.990 24.105 26.927 1.00 0.00 H new ATOM 0 HA CYS A 3 22.876 22.642 28.521 1.00 0.00 H new ATOM 0 HB2 CYS A 3 23.403 25.542 27.962 1.00 0.00 H new ATOM 0 HB3 CYS A 3 21.773 25.033 27.568 1.00 0.00 H new ATOM 51 N GLN A 4 22.628 21.703 26.151 1.00 0.00 N ATOM 52 CA GLN A 4 22.083 21.236 24.845 1.00 0.00 C ATOM 53 C GLN A 4 20.592 21.533 24.769 1.00 0.00 C ATOM 54 O GLN A 4 20.001 22.059 25.691 1.00 0.00 O ATOM 55 CB GLN A 4 22.313 19.728 24.820 1.00 0.00 C ATOM 56 CG GLN A 4 21.816 19.115 26.131 1.00 0.00 C ATOM 57 CD GLN A 4 23.009 18.629 26.954 1.00 0.00 C ATOM 58 OE1 GLN A 4 23.899 19.395 27.266 1.00 0.00 O ATOM 59 NE2 GLN A 4 23.063 17.379 27.325 1.00 0.00 N ATOM 0 H GLN A 4 22.998 20.971 26.757 1.00 0.00 H new ATOM 0 HA GLN A 4 22.564 21.735 24.003 1.00 0.00 H new ATOM 0 HB2 GLN A 4 21.787 19.283 23.975 1.00 0.00 H new ATOM 0 HB3 GLN A 4 23.373 19.513 24.684 1.00 0.00 H new ATOM 0 HG2 GLN A 4 21.247 19.853 26.697 1.00 0.00 H new ATOM 0 HG3 GLN A 4 21.142 18.284 25.923 1.00 0.00 H new ATOM 0 HE21 GLN A 4 22.316 16.736 27.063 1.00 0.00 H new ATOM 0 HE22 GLN A 4 23.853 17.045 27.877 1.00 0.00 H new ATOM 68 N SER A 5 19.979 21.188 23.679 1.00 0.00 N ATOM 69 CA SER A 5 18.519 21.439 23.543 1.00 0.00 C ATOM 70 C SER A 5 17.808 21.018 24.830 1.00 0.00 C ATOM 71 O SER A 5 18.195 20.059 25.469 1.00 0.00 O ATOM 72 CB SER A 5 18.070 20.570 22.370 1.00 0.00 C ATOM 73 OG SER A 5 17.573 19.334 22.866 1.00 0.00 O ATOM 0 H SER A 5 20.422 20.743 22.875 1.00 0.00 H new ATOM 0 HA SER A 5 18.288 22.490 23.372 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.297 21.083 21.797 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.905 20.394 21.692 1.00 0.00 H new ATOM 0 HG SER A 5 17.282 18.774 22.116 1.00 0.00 H new ATOM 79 N PRO A 6 16.795 21.759 25.171 1.00 0.00 N ATOM 80 CA PRO A 6 16.022 21.475 26.405 1.00 0.00 C ATOM 81 C PRO A 6 15.203 20.190 26.256 1.00 0.00 C ATOM 82 O PRO A 6 14.936 19.744 25.161 1.00 0.00 O ATOM 83 CB PRO A 6 15.110 22.689 26.535 1.00 0.00 C ATOM 84 CG PRO A 6 14.975 23.222 25.149 1.00 0.00 C ATOM 85 CD PRO A 6 16.275 22.925 24.448 1.00 0.00 C ATOM 0 HA PRO A 6 16.656 21.321 27.278 1.00 0.00 H new ATOM 0 HB2 PRO A 6 14.140 22.411 26.947 1.00 0.00 H new ATOM 0 HB3 PRO A 6 15.539 23.435 27.204 1.00 0.00 H new ATOM 0 HG2 PRO A 6 14.139 22.751 24.632 1.00 0.00 H new ATOM 0 HG3 PRO A 6 14.778 24.294 25.163 1.00 0.00 H new ATOM 0 HD2 PRO A 6 16.120 22.706 23.391 1.00 0.00 H new ATOM 0 HD3 PRO A 6 16.962 23.770 24.501 1.00 0.00 H new ATOM 93 N PRO A 7 14.829 19.641 27.378 1.00 0.00 N ATOM 94 CA PRO A 7 14.023 18.397 27.386 1.00 0.00 C ATOM 95 C PRO A 7 12.575 18.702 26.991 1.00 0.00 C ATOM 96 O PRO A 7 12.179 19.845 26.883 1.00 0.00 O ATOM 97 CB PRO A 7 14.102 17.930 28.835 1.00 0.00 C ATOM 98 CG PRO A 7 14.376 19.168 29.631 1.00 0.00 C ATOM 99 CD PRO A 7 15.121 20.122 28.732 1.00 0.00 C ATOM 0 HA PRO A 7 14.382 17.647 26.682 1.00 0.00 H new ATOM 0 HB2 PRO A 7 13.171 17.458 29.148 1.00 0.00 H new ATOM 0 HB3 PRO A 7 14.893 17.192 28.969 1.00 0.00 H new ATOM 0 HG2 PRO A 7 13.445 19.615 29.979 1.00 0.00 H new ATOM 0 HG3 PRO A 7 14.967 18.933 30.516 1.00 0.00 H new ATOM 0 HD2 PRO A 7 14.782 21.148 28.872 1.00 0.00 H new ATOM 0 HD3 PRO A 7 16.191 20.109 28.937 1.00 0.00 H new ATOM 107 N SER A 8 11.781 17.689 26.780 1.00 0.00 N ATOM 108 CA SER A 8 10.359 17.927 26.397 1.00 0.00 C ATOM 109 C SER A 8 9.563 18.414 27.605 1.00 0.00 C ATOM 110 O SER A 8 10.084 18.550 28.694 1.00 0.00 O ATOM 111 CB SER A 8 9.839 16.572 25.927 1.00 0.00 C ATOM 112 OG SER A 8 9.975 15.625 26.978 1.00 0.00 O ATOM 0 H SER A 8 12.053 16.709 26.856 1.00 0.00 H new ATOM 0 HA SER A 8 10.264 18.689 25.623 1.00 0.00 H new ATOM 0 HB2 SER A 8 8.794 16.654 25.630 1.00 0.00 H new ATOM 0 HB3 SER A 8 10.395 16.241 25.050 1.00 0.00 H new ATOM 0 HG SER A 8 9.640 14.754 26.679 1.00 0.00 H new ATOM 118 N ILE A 9 8.302 18.681 27.420 1.00 0.00 N ATOM 119 CA ILE A 9 7.470 19.165 28.560 1.00 0.00 C ATOM 120 C ILE A 9 6.047 18.645 28.479 1.00 0.00 C ATOM 121 O ILE A 9 5.720 17.769 27.702 1.00 0.00 O ATOM 122 CB ILE A 9 7.453 20.694 28.492 1.00 0.00 C ATOM 123 CG1 ILE A 9 7.635 21.205 27.054 1.00 0.00 C ATOM 124 CG2 ILE A 9 8.558 21.233 29.381 1.00 0.00 C ATOM 125 CD1 ILE A 9 6.448 22.098 26.695 1.00 0.00 C ATOM 0 H ILE A 9 7.810 18.586 26.532 1.00 0.00 H new ATOM 0 HA ILE A 9 7.895 18.804 29.497 1.00 0.00 H new ATOM 0 HB ILE A 9 6.481 21.047 28.838 1.00 0.00 H new ATOM 0 HG12 ILE A 9 8.567 21.763 26.967 1.00 0.00 H new ATOM 0 HG13 ILE A 9 7.700 20.366 26.361 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.558 22.322 29.342 1.00 0.00 H new ATOM 0 HG22 ILE A 9 8.391 20.906 30.407 1.00 0.00 H new ATOM 0 HG23 ILE A 9 9.520 20.858 29.033 1.00 0.00 H new ATOM 0 HD11 ILE A 9 6.565 22.467 25.676 1.00 0.00 H new ATOM 0 HD12 ILE A 9 5.525 21.523 26.768 1.00 0.00 H new ATOM 0 HD13 ILE A 9 6.406 22.942 27.384 1.00 0.00 H new ATOM 137 N SER A 10 5.209 19.185 29.307 1.00 0.00 N ATOM 138 CA SER A 10 3.792 18.751 29.341 1.00 0.00 C ATOM 139 C SER A 10 3.179 18.749 27.936 1.00 0.00 C ATOM 140 O SER A 10 2.780 19.774 27.421 1.00 0.00 O ATOM 141 CB SER A 10 3.087 19.769 30.234 1.00 0.00 C ATOM 142 OG SER A 10 1.893 19.194 30.748 1.00 0.00 O ATOM 0 H SER A 10 5.448 19.920 29.972 1.00 0.00 H new ATOM 0 HA SER A 10 3.692 17.733 29.718 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.742 20.068 31.052 1.00 0.00 H new ATOM 0 HB3 SER A 10 2.855 20.670 29.666 1.00 0.00 H new ATOM 0 HG SER A 10 1.438 19.844 31.323 1.00 0.00 H new ATOM 148 N ASN A 11 3.091 17.596 27.327 1.00 0.00 N ATOM 149 CA ASN A 11 2.492 17.495 25.960 1.00 0.00 C ATOM 150 C ASN A 11 2.855 18.711 25.101 1.00 0.00 C ATOM 151 O ASN A 11 1.995 19.382 24.566 1.00 0.00 O ATOM 152 CB ASN A 11 0.983 17.438 26.193 1.00 0.00 C ATOM 153 CG ASN A 11 0.622 16.106 26.850 1.00 0.00 C ATOM 154 OD1 ASN A 11 1.439 15.506 27.521 1.00 0.00 O ATOM 155 ND2 ASN A 11 -0.574 15.612 26.685 1.00 0.00 N ATOM 0 H ASN A 11 3.411 16.711 27.720 1.00 0.00 H new ATOM 0 HA ASN A 11 2.863 16.622 25.424 1.00 0.00 H new ATOM 0 HB2 ASN A 11 0.670 18.266 26.829 1.00 0.00 H new ATOM 0 HB3 ASN A 11 0.453 17.545 25.246 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -0.823 14.723 27.119 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -1.260 16.115 26.122 1.00 0.00 H new ATOM 162 N GLY A 12 4.119 18.991 24.952 1.00 0.00 N ATOM 163 CA GLY A 12 4.531 20.153 24.115 1.00 0.00 C ATOM 164 C GLY A 12 5.900 19.867 23.498 1.00 0.00 C ATOM 165 O GLY A 12 6.348 18.738 23.461 1.00 0.00 O ATOM 0 H GLY A 12 4.885 18.466 25.373 1.00 0.00 H new ATOM 0 HA2 GLY A 12 3.795 20.331 23.331 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.574 21.057 24.722 1.00 0.00 H new ATOM 169 N ARG A 13 6.569 20.875 23.014 1.00 0.00 N ATOM 170 CA ARG A 13 7.911 20.647 22.402 1.00 0.00 C ATOM 171 C ARG A 13 8.809 21.864 22.621 1.00 0.00 C ATOM 172 O ARG A 13 8.389 22.877 23.143 1.00 0.00 O ATOM 173 CB ARG A 13 7.656 20.431 20.906 1.00 0.00 C ATOM 174 CG ARG A 13 6.526 21.344 20.427 1.00 0.00 C ATOM 175 CD ARG A 13 5.273 20.507 20.163 1.00 0.00 C ATOM 176 NE ARG A 13 4.985 20.697 18.715 1.00 0.00 N ATOM 177 CZ ARG A 13 4.542 19.698 18.002 1.00 0.00 C ATOM 178 NH1 ARG A 13 5.374 18.800 17.549 1.00 0.00 N ATOM 179 NH2 ARG A 13 3.267 19.595 17.743 1.00 0.00 N ATOM 0 H ARG A 13 6.248 21.843 23.014 1.00 0.00 H new ATOM 0 HA ARG A 13 8.417 19.791 22.849 1.00 0.00 H new ATOM 0 HB2 ARG A 13 8.565 20.638 20.341 1.00 0.00 H new ATOM 0 HB3 ARG A 13 7.395 19.389 20.721 1.00 0.00 H new ATOM 0 HG2 ARG A 13 6.316 22.106 21.178 1.00 0.00 H new ATOM 0 HG3 ARG A 13 6.826 21.866 19.518 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.443 19.456 20.398 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.438 20.840 20.779 1.00 0.00 H new ATOM 0 HE ARG A 13 5.134 21.608 18.280 1.00 0.00 H new ATOM 0 HH11 ARG A 13 6.370 18.879 17.752 1.00 0.00 H new ATOM 0 HH12 ARG A 13 5.028 18.019 16.992 1.00 0.00 H new ATOM 0 HH21 ARG A 13 2.616 20.296 18.098 1.00 0.00 H new ATOM 0 HH22 ARG A 13 2.921 18.814 17.186 1.00 0.00 H new ATOM 193 N HIS A 14 10.046 21.763 22.227 1.00 0.00 N ATOM 194 CA HIS A 14 10.991 22.901 22.407 1.00 0.00 C ATOM 195 C HIS A 14 11.901 23.025 21.183 1.00 0.00 C ATOM 196 O HIS A 14 11.561 22.596 20.099 1.00 0.00 O ATOM 197 CB HIS A 14 11.805 22.537 23.645 1.00 0.00 C ATOM 198 CG HIS A 14 12.748 21.411 23.321 1.00 0.00 C ATOM 199 ND1 HIS A 14 14.034 21.640 22.865 1.00 0.00 N ATOM 200 CD2 HIS A 14 12.622 20.048 23.420 1.00 0.00 C ATOM 201 CE1 HIS A 14 14.632 20.449 22.719 1.00 0.00 C ATOM 202 NE2 HIS A 14 13.815 19.441 23.039 1.00 0.00 N ATOM 0 H HIS A 14 10.447 20.936 21.785 1.00 0.00 H new ATOM 0 HA HIS A 14 10.479 23.856 22.520 1.00 0.00 H new ATOM 0 HB2 HIS A 14 12.366 23.405 23.991 1.00 0.00 H new ATOM 0 HB3 HIS A 14 11.139 22.244 24.456 1.00 0.00 H new ATOM 0 HD2 HIS A 14 11.733 19.526 23.744 1.00 0.00 H new ATOM 0 HE1 HIS A 14 15.650 20.320 22.383 1.00 0.00 H new ATOM 0 HE2 HIS A 14 14.021 18.442 23.010 1.00 0.00 H new ATOM 210 N ASN A 15 13.060 23.600 21.352 1.00 0.00 N ATOM 211 CA ASN A 15 14.002 23.747 20.202 1.00 0.00 C ATOM 212 C ASN A 15 13.470 24.778 19.204 1.00 0.00 C ATOM 213 O ASN A 15 12.530 24.528 18.477 1.00 0.00 O ATOM 214 CB ASN A 15 14.069 22.360 19.558 1.00 0.00 C ATOM 215 CG ASN A 15 15.503 22.073 19.106 1.00 0.00 C ATOM 216 OD1 ASN A 15 16.130 21.150 19.586 1.00 0.00 O ATOM 217 ND2 ASN A 15 16.052 22.832 18.196 1.00 0.00 N ATOM 0 H ASN A 15 13.398 23.976 22.238 1.00 0.00 H new ATOM 0 HA ASN A 15 14.985 24.095 20.521 1.00 0.00 H new ATOM 0 HB2 ASN A 15 13.742 21.601 20.269 1.00 0.00 H new ATOM 0 HB3 ASN A 15 13.391 22.310 18.706 1.00 0.00 H new ATOM 0 HD21 ASN A 15 17.007 22.650 17.888 1.00 0.00 H new ATOM 0 HD22 ASN A 15 15.526 23.607 17.793 1.00 0.00 H new ATOM 224 N GLY A 16 14.070 25.935 19.165 1.00 0.00 N ATOM 225 CA GLY A 16 13.609 26.986 18.216 1.00 0.00 C ATOM 226 C GLY A 16 14.666 28.086 18.130 1.00 0.00 C ATOM 227 O GLY A 16 14.363 29.261 18.202 1.00 0.00 O ATOM 0 H GLY A 16 14.862 26.198 19.751 1.00 0.00 H new ATOM 0 HA2 GLY A 16 13.437 26.553 17.231 1.00 0.00 H new ATOM 0 HA3 GLY A 16 12.659 27.403 18.551 1.00 0.00 H new ATOM 231 N TYR A 17 15.909 27.716 17.978 1.00 0.00 N ATOM 232 CA TYR A 17 16.983 28.745 17.890 1.00 0.00 C ATOM 233 C TYR A 17 18.352 28.081 17.735 1.00 0.00 C ATOM 234 O TYR A 17 19.232 28.599 17.076 1.00 0.00 O ATOM 235 CB TYR A 17 16.906 29.509 19.211 1.00 0.00 C ATOM 236 CG TYR A 17 16.576 30.958 18.940 1.00 0.00 C ATOM 237 CD1 TYR A 17 17.524 31.790 18.333 1.00 0.00 C ATOM 238 CD2 TYR A 17 15.322 31.468 19.297 1.00 0.00 C ATOM 239 CE1 TYR A 17 17.218 33.134 18.083 1.00 0.00 C ATOM 240 CE2 TYR A 17 15.016 32.811 19.047 1.00 0.00 C ATOM 241 CZ TYR A 17 15.964 33.644 18.440 1.00 0.00 C ATOM 242 OH TYR A 17 15.662 34.969 18.194 1.00 0.00 O ATOM 0 H TYR A 17 16.226 26.749 17.911 1.00 0.00 H new ATOM 0 HA TYR A 17 16.853 29.400 17.028 1.00 0.00 H new ATOM 0 HB2 TYR A 17 16.146 29.067 19.855 1.00 0.00 H new ATOM 0 HB3 TYR A 17 17.855 29.435 19.741 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.491 31.396 18.057 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.591 30.826 19.765 1.00 0.00 H new ATOM 0 HE1 TYR A 17 17.949 33.776 17.615 1.00 0.00 H new ATOM 0 HE2 TYR A 17 14.049 33.205 19.322 1.00 0.00 H new ATOM 0 HH TYR A 17 14.751 35.160 18.502 1.00 0.00 H new ATOM 252 N GLU A 18 18.545 26.942 18.339 1.00 0.00 N ATOM 253 CA GLU A 18 19.867 26.259 18.223 1.00 0.00 C ATOM 254 C GLU A 18 19.867 24.942 19.001 1.00 0.00 C ATOM 255 O GLU A 18 18.842 24.466 19.446 1.00 0.00 O ATOM 256 CB GLU A 18 20.867 27.233 18.845 1.00 0.00 C ATOM 257 CG GLU A 18 20.399 27.617 20.252 1.00 0.00 C ATOM 258 CD GLU A 18 21.204 28.821 20.745 1.00 0.00 C ATOM 259 OE1 GLU A 18 20.820 29.935 20.429 1.00 0.00 O ATOM 260 OE2 GLU A 18 22.190 28.610 21.432 1.00 0.00 O ATOM 0 H GLU A 18 17.850 26.455 18.905 1.00 0.00 H new ATOM 0 HA GLU A 18 20.108 26.015 17.188 1.00 0.00 H new ATOM 0 HB2 GLU A 18 21.855 26.776 18.891 1.00 0.00 H new ATOM 0 HB3 GLU A 18 20.957 28.124 18.224 1.00 0.00 H new ATOM 0 HG2 GLU A 18 19.336 27.857 20.241 1.00 0.00 H new ATOM 0 HG3 GLU A 18 20.529 26.776 20.933 1.00 0.00 H new ATOM 267 N ASP A 19 21.020 24.357 19.173 1.00 0.00 N ATOM 268 CA ASP A 19 21.109 23.076 19.928 1.00 0.00 C ATOM 269 C ASP A 19 21.901 23.294 21.219 1.00 0.00 C ATOM 270 O ASP A 19 21.545 22.801 22.271 1.00 0.00 O ATOM 271 CB ASP A 19 21.851 22.118 18.995 1.00 0.00 C ATOM 272 CG ASP A 19 22.361 20.918 19.794 1.00 0.00 C ATOM 273 OD1 ASP A 19 23.323 21.086 20.527 1.00 0.00 O ATOM 274 OD2 ASP A 19 21.783 19.853 19.660 1.00 0.00 O ATOM 0 H ASP A 19 21.909 24.713 18.821 1.00 0.00 H new ATOM 0 HA ASP A 19 20.131 22.686 20.211 1.00 0.00 H new ATOM 0 HB2 ASP A 19 21.187 21.782 18.199 1.00 0.00 H new ATOM 0 HB3 ASP A 19 22.686 22.632 18.518 1.00 0.00 H new ATOM 279 N PHE A 20 22.969 24.041 21.145 1.00 0.00 N ATOM 280 CA PHE A 20 23.786 24.306 22.363 1.00 0.00 C ATOM 281 C PHE A 20 23.365 25.639 22.988 1.00 0.00 C ATOM 282 O PHE A 20 23.275 26.647 22.316 1.00 0.00 O ATOM 283 CB PHE A 20 25.230 24.386 21.865 1.00 0.00 C ATOM 284 CG PHE A 20 25.802 22.994 21.733 1.00 0.00 C ATOM 285 CD1 PHE A 20 26.255 22.312 22.868 1.00 0.00 C ATOM 286 CD2 PHE A 20 25.884 22.389 20.473 1.00 0.00 C ATOM 287 CE1 PHE A 20 26.790 21.024 22.744 1.00 0.00 C ATOM 288 CE2 PHE A 20 26.419 21.101 20.349 1.00 0.00 C ATOM 289 CZ PHE A 20 26.872 20.419 21.484 1.00 0.00 C ATOM 0 H PHE A 20 23.312 24.480 20.291 1.00 0.00 H new ATOM 0 HA PHE A 20 23.661 23.535 23.123 1.00 0.00 H new ATOM 0 HB2 PHE A 20 25.265 24.897 20.903 1.00 0.00 H new ATOM 0 HB3 PHE A 20 25.832 24.972 22.559 1.00 0.00 H new ATOM 0 HD1 PHE A 20 26.192 22.779 23.840 1.00 0.00 H new ATOM 0 HD2 PHE A 20 25.535 22.916 19.597 1.00 0.00 H new ATOM 0 HE1 PHE A 20 27.139 20.497 23.620 1.00 0.00 H new ATOM 0 HE2 PHE A 20 26.482 20.634 19.377 1.00 0.00 H new ATOM 0 HZ PHE A 20 27.285 19.426 21.388 1.00 0.00 H new ATOM 299 N TYR A 21 23.106 25.655 24.265 1.00 0.00 N ATOM 300 CA TYR A 21 22.690 26.927 24.920 1.00 0.00 C ATOM 301 C TYR A 21 23.644 27.282 26.063 1.00 0.00 C ATOM 302 O TYR A 21 23.561 28.340 26.651 1.00 0.00 O ATOM 303 CB TYR A 21 21.291 26.659 25.446 1.00 0.00 C ATOM 304 CG TYR A 21 20.302 27.314 24.511 1.00 0.00 C ATOM 305 CD1 TYR A 21 20.507 28.636 24.105 1.00 0.00 C ATOM 306 CD2 TYR A 21 19.191 26.604 24.045 1.00 0.00 C ATOM 307 CE1 TYR A 21 19.600 29.253 23.237 1.00 0.00 C ATOM 308 CE2 TYR A 21 18.282 27.220 23.175 1.00 0.00 C ATOM 309 CZ TYR A 21 18.486 28.545 22.772 1.00 0.00 C ATOM 310 OH TYR A 21 17.591 29.153 21.915 1.00 0.00 O ATOM 0 H TYR A 21 23.164 24.845 24.883 1.00 0.00 H new ATOM 0 HA TYR A 21 22.710 27.770 24.230 1.00 0.00 H new ATOM 0 HB2 TYR A 21 21.106 25.586 25.505 1.00 0.00 H new ATOM 0 HB3 TYR A 21 21.181 27.057 26.455 1.00 0.00 H new ATOM 0 HD1 TYR A 21 21.368 29.182 24.462 1.00 0.00 H new ATOM 0 HD2 TYR A 21 19.034 25.582 24.356 1.00 0.00 H new ATOM 0 HE1 TYR A 21 19.759 30.275 22.926 1.00 0.00 H new ATOM 0 HE2 TYR A 21 17.424 26.672 22.815 1.00 0.00 H new ATOM 0 HH TYR A 21 17.737 30.122 21.923 1.00 0.00 H new ATOM 320 N THR A 22 24.551 26.403 26.371 1.00 0.00 N ATOM 321 CA THR A 22 25.529 26.665 27.468 1.00 0.00 C ATOM 322 C THR A 22 24.847 27.206 28.733 1.00 0.00 C ATOM 323 O THR A 22 24.377 26.453 29.561 1.00 0.00 O ATOM 324 CB THR A 22 26.511 27.693 26.899 1.00 0.00 C ATOM 325 OG1 THR A 22 25.820 28.901 26.612 1.00 0.00 O ATOM 326 CG2 THR A 22 27.144 27.147 25.618 1.00 0.00 C ATOM 0 H THR A 22 24.661 25.502 25.906 1.00 0.00 H new ATOM 0 HA THR A 22 26.026 25.745 27.775 1.00 0.00 H new ATOM 0 HB THR A 22 27.294 27.888 27.632 1.00 0.00 H new ATOM 0 HG1 THR A 22 26.449 29.559 26.249 1.00 0.00 H new ATOM 0 HG21 THR A 22 27.842 27.881 25.216 1.00 0.00 H new ATOM 0 HG22 THR A 22 27.677 26.223 25.841 1.00 0.00 H new ATOM 0 HG23 THR A 22 26.364 26.947 24.883 1.00 0.00 H new ATOM 334 N ASP A 23 24.818 28.499 28.910 1.00 0.00 N ATOM 335 CA ASP A 23 24.193 29.063 30.144 1.00 0.00 C ATOM 336 C ASP A 23 23.702 30.489 29.894 1.00 0.00 C ATOM 337 O ASP A 23 24.308 31.247 29.163 1.00 0.00 O ATOM 338 CB ASP A 23 25.320 29.059 31.178 1.00 0.00 C ATOM 339 CG ASP A 23 24.947 29.968 32.352 1.00 0.00 C ATOM 340 OD1 ASP A 23 24.985 31.175 32.175 1.00 0.00 O ATOM 341 OD2 ASP A 23 24.633 29.444 33.407 1.00 0.00 O ATOM 0 H ASP A 23 25.197 29.187 28.259 1.00 0.00 H new ATOM 0 HA ASP A 23 23.326 28.489 30.470 1.00 0.00 H new ATOM 0 HB2 ASP A 23 25.497 28.044 31.534 1.00 0.00 H new ATOM 0 HB3 ASP A 23 26.248 29.402 30.720 1.00 0.00 H new ATOM 346 N GLY A 24 22.607 30.860 30.499 1.00 0.00 N ATOM 347 CA GLY A 24 22.076 32.236 30.299 1.00 0.00 C ATOM 348 C GLY A 24 21.277 32.278 29.000 1.00 0.00 C ATOM 349 O GLY A 24 21.233 33.281 28.317 1.00 0.00 O ATOM 0 H GLY A 24 22.058 30.269 31.123 1.00 0.00 H new ATOM 0 HA2 GLY A 24 21.443 32.521 31.139 1.00 0.00 H new ATOM 0 HA3 GLY A 24 22.896 32.954 30.260 1.00 0.00 H new ATOM 353 N SER A 25 20.649 31.189 28.651 1.00 0.00 N ATOM 354 CA SER A 25 19.855 31.160 27.391 1.00 0.00 C ATOM 355 C SER A 25 18.404 30.795 27.689 1.00 0.00 C ATOM 356 O SER A 25 18.059 30.444 28.800 1.00 0.00 O ATOM 357 CB SER A 25 20.511 30.085 26.535 1.00 0.00 C ATOM 358 OG SER A 25 21.811 29.811 27.038 1.00 0.00 O ATOM 0 H SER A 25 20.651 30.319 29.183 1.00 0.00 H new ATOM 0 HA SER A 25 19.842 32.128 26.890 1.00 0.00 H new ATOM 0 HB2 SER A 25 19.907 29.178 26.544 1.00 0.00 H new ATOM 0 HB3 SER A 25 20.572 30.417 25.499 1.00 0.00 H new ATOM 0 HG SER A 25 22.256 29.160 26.456 1.00 0.00 H new ATOM 364 N VAL A 26 17.548 30.879 26.710 1.00 0.00 N ATOM 365 CA VAL A 26 16.121 30.540 26.953 1.00 0.00 C ATOM 366 C VAL A 26 15.519 29.831 25.745 1.00 0.00 C ATOM 367 O VAL A 26 15.953 30.003 24.623 1.00 0.00 O ATOM 368 CB VAL A 26 15.438 31.890 27.208 1.00 0.00 C ATOM 369 CG1 VAL A 26 13.916 31.730 27.190 1.00 0.00 C ATOM 370 CG2 VAL A 26 15.868 32.430 28.572 1.00 0.00 C ATOM 0 H VAL A 26 17.774 31.166 25.758 1.00 0.00 H new ATOM 0 HA VAL A 26 15.994 29.857 27.792 1.00 0.00 H new ATOM 0 HB VAL A 26 15.733 32.585 26.422 1.00 0.00 H new ATOM 0 HG11 VAL A 26 13.446 32.697 27.372 1.00 0.00 H new ATOM 0 HG12 VAL A 26 13.601 31.352 26.217 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.615 31.028 27.967 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.383 33.389 28.753 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.578 31.724 29.350 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.950 32.562 28.586 1.00 0.00 H new ATOM 380 N VAL A 27 14.526 29.021 25.976 1.00 0.00 N ATOM 381 CA VAL A 27 13.898 28.281 24.850 1.00 0.00 C ATOM 382 C VAL A 27 12.390 28.431 24.862 1.00 0.00 C ATOM 383 O VAL A 27 11.722 28.064 25.807 1.00 0.00 O ATOM 384 CB VAL A 27 14.291 26.829 25.078 1.00 0.00 C ATOM 385 CG1 VAL A 27 13.358 25.890 24.304 1.00 0.00 C ATOM 386 CG2 VAL A 27 15.704 26.647 24.580 1.00 0.00 C ATOM 0 H VAL A 27 14.123 28.840 26.895 1.00 0.00 H new ATOM 0 HA VAL A 27 14.230 28.659 23.883 1.00 0.00 H new ATOM 0 HB VAL A 27 14.216 26.590 26.139 1.00 0.00 H new ATOM 0 HG11 VAL A 27 13.655 24.856 24.480 1.00 0.00 H new ATOM 0 HG12 VAL A 27 12.332 26.036 24.643 1.00 0.00 H new ATOM 0 HG13 VAL A 27 13.423 26.110 23.238 1.00 0.00 H new ATOM 0 HG21 VAL A 27 16.013 25.613 24.731 1.00 0.00 H new ATOM 0 HG22 VAL A 27 15.749 26.887 23.518 1.00 0.00 H new ATOM 0 HG23 VAL A 27 16.372 27.309 25.131 1.00 0.00 H new ATOM 396 N THR A 28 11.841 28.932 23.802 1.00 0.00 N ATOM 397 CA THR A 28 10.374 29.054 23.755 1.00 0.00 C ATOM 398 C THR A 28 9.797 27.666 23.514 1.00 0.00 C ATOM 399 O THR A 28 9.833 27.147 22.417 1.00 0.00 O ATOM 400 CB THR A 28 10.066 29.999 22.593 1.00 0.00 C ATOM 401 OG1 THR A 28 11.280 30.504 22.054 1.00 0.00 O ATOM 402 CG2 THR A 28 9.211 31.158 23.100 1.00 0.00 C ATOM 0 H THR A 28 12.341 29.259 22.975 1.00 0.00 H new ATOM 0 HA THR A 28 9.942 29.445 24.676 1.00 0.00 H new ATOM 0 HB THR A 28 9.526 29.458 21.816 1.00 0.00 H new ATOM 0 HG1 THR A 28 11.081 31.108 21.308 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.989 31.835 22.275 1.00 0.00 H new ATOM 0 HG22 THR A 28 8.279 30.770 23.512 1.00 0.00 H new ATOM 0 HG23 THR A 28 9.754 31.698 23.876 1.00 0.00 H new ATOM 410 N TYR A 29 9.296 27.051 24.542 1.00 0.00 N ATOM 411 CA TYR A 29 8.749 25.678 24.389 1.00 0.00 C ATOM 412 C TYR A 29 7.477 25.706 23.539 1.00 0.00 C ATOM 413 O TYR A 29 6.505 26.343 23.889 1.00 0.00 O ATOM 414 CB TYR A 29 8.394 25.237 25.811 1.00 0.00 C ATOM 415 CG TYR A 29 9.541 24.503 26.464 1.00 0.00 C ATOM 416 CD1 TYR A 29 10.794 24.418 25.843 1.00 0.00 C ATOM 417 CD2 TYR A 29 9.344 23.915 27.716 1.00 0.00 C ATOM 418 CE1 TYR A 29 11.842 23.741 26.475 1.00 0.00 C ATOM 419 CE2 TYR A 29 10.391 23.241 28.348 1.00 0.00 C ATOM 420 CZ TYR A 29 11.640 23.150 27.730 1.00 0.00 C ATOM 421 OH TYR A 29 12.671 22.485 28.359 1.00 0.00 O ATOM 0 H TYR A 29 9.241 27.439 25.484 1.00 0.00 H new ATOM 0 HA TYR A 29 9.459 25.010 23.902 1.00 0.00 H new ATOM 0 HB2 TYR A 29 8.131 26.110 26.409 1.00 0.00 H new ATOM 0 HB3 TYR A 29 7.516 24.592 25.785 1.00 0.00 H new ATOM 0 HD1 TYR A 29 10.950 24.875 24.877 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.379 23.982 28.196 1.00 0.00 H new ATOM 0 HE1 TYR A 29 12.808 23.673 25.996 1.00 0.00 H new ATOM 0 HE2 TYR A 29 10.235 22.789 29.316 1.00 0.00 H new ATOM 0 HH TYR A 29 12.714 21.563 28.031 1.00 0.00 H new ATOM 431 N SER A 30 7.461 25.010 22.437 1.00 0.00 N ATOM 432 CA SER A 30 6.229 24.999 21.601 1.00 0.00 C ATOM 433 C SER A 30 5.160 24.152 22.292 1.00 0.00 C ATOM 434 O SER A 30 5.367 23.644 23.376 1.00 0.00 O ATOM 435 CB SER A 30 6.639 24.368 20.273 1.00 0.00 C ATOM 436 OG SER A 30 5.477 23.903 19.597 1.00 0.00 O ATOM 0 H SER A 30 8.239 24.454 22.082 1.00 0.00 H new ATOM 0 HA SER A 30 5.816 25.997 21.452 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.165 25.098 19.657 1.00 0.00 H new ATOM 0 HB3 SER A 30 7.328 23.542 20.447 1.00 0.00 H new ATOM 0 HG SER A 30 5.730 23.542 18.722 1.00 0.00 H new ATOM 442 N CYS A 31 4.026 23.993 21.676 1.00 0.00 N ATOM 443 CA CYS A 31 2.946 23.175 22.304 1.00 0.00 C ATOM 444 C CYS A 31 2.067 22.548 21.219 1.00 0.00 C ATOM 445 O CYS A 31 2.088 22.961 20.077 1.00 0.00 O ATOM 446 CB CYS A 31 2.131 24.167 23.136 1.00 0.00 C ATOM 447 SG CYS A 31 3.174 24.880 24.432 1.00 0.00 S ATOM 0 H CYS A 31 3.796 24.392 20.766 1.00 0.00 H new ATOM 0 HA CYS A 31 3.343 22.361 22.910 1.00 0.00 H new ATOM 0 HB2 CYS A 31 1.739 24.957 22.496 1.00 0.00 H new ATOM 0 HB3 CYS A 31 1.273 23.663 23.582 1.00 0.00 H new ATOM 452 N ASN A 32 1.288 21.561 21.566 1.00 0.00 N ATOM 453 CA ASN A 32 0.405 20.924 20.549 1.00 0.00 C ATOM 454 C ASN A 32 -0.493 21.986 19.907 1.00 0.00 C ATOM 455 O ASN A 32 -0.906 22.932 20.549 1.00 0.00 O ATOM 456 CB ASN A 32 -0.431 19.910 21.330 1.00 0.00 C ATOM 457 CG ASN A 32 -0.789 18.732 20.421 1.00 0.00 C ATOM 458 OD1 ASN A 32 -0.347 17.622 20.643 1.00 0.00 O ATOM 459 ND2 ASN A 32 -1.577 18.928 19.399 1.00 0.00 N ATOM 0 H ASN A 32 1.225 21.169 22.506 1.00 0.00 H new ATOM 0 HA ASN A 32 0.966 20.449 19.745 1.00 0.00 H new ATOM 0 HB2 ASN A 32 0.125 19.557 22.198 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.339 20.383 21.704 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -1.822 18.150 18.787 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -1.948 19.860 19.212 1.00 0.00 H new ATOM 466 N SER A 33 -0.795 21.841 18.646 1.00 0.00 N ATOM 467 CA SER A 33 -1.661 22.848 17.968 1.00 0.00 C ATOM 468 C SER A 33 -2.955 23.060 18.757 1.00 0.00 C ATOM 469 O SER A 33 -3.804 22.193 18.823 1.00 0.00 O ATOM 470 CB SER A 33 -1.961 22.250 16.594 1.00 0.00 C ATOM 471 OG SER A 33 -3.180 21.521 16.654 1.00 0.00 O ATOM 0 H SER A 33 -0.480 21.070 18.056 1.00 0.00 H new ATOM 0 HA SER A 33 -1.177 23.822 17.893 1.00 0.00 H new ATOM 0 HB2 SER A 33 -2.034 23.042 15.848 1.00 0.00 H new ATOM 0 HB3 SER A 33 -1.147 21.595 16.284 1.00 0.00 H new ATOM 0 HG SER A 33 -3.294 21.147 17.553 1.00 0.00 H new ATOM 477 N GLY A 34 -3.114 24.211 19.354 1.00 0.00 N ATOM 478 CA GLY A 34 -4.354 24.482 20.135 1.00 0.00 C ATOM 479 C GLY A 34 -4.025 24.532 21.629 1.00 0.00 C ATOM 480 O GLY A 34 -4.764 25.086 22.417 1.00 0.00 O ATOM 0 H GLY A 34 -2.438 24.975 19.334 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.795 25.427 19.818 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.094 23.705 19.942 1.00 0.00 H new ATOM 484 N TYR A 35 -2.921 23.958 22.026 1.00 0.00 N ATOM 485 CA TYR A 35 -2.551 23.976 23.471 1.00 0.00 C ATOM 486 C TYR A 35 -1.943 25.329 23.848 1.00 0.00 C ATOM 487 O TYR A 35 -1.071 25.840 23.173 1.00 0.00 O ATOM 488 CB TYR A 35 -1.512 22.864 23.629 1.00 0.00 C ATOM 489 CG TYR A 35 -2.208 21.535 23.820 1.00 0.00 C ATOM 490 CD1 TYR A 35 -3.522 21.356 23.368 1.00 0.00 C ATOM 491 CD2 TYR A 35 -1.534 20.479 24.445 1.00 0.00 C ATOM 492 CE1 TYR A 35 -4.162 20.123 23.544 1.00 0.00 C ATOM 493 CE2 TYR A 35 -2.173 19.245 24.619 1.00 0.00 C ATOM 494 CZ TYR A 35 -3.487 19.067 24.168 1.00 0.00 C ATOM 495 OH TYR A 35 -4.117 17.849 24.338 1.00 0.00 O ATOM 0 H TYR A 35 -2.261 23.479 21.414 1.00 0.00 H new ATOM 0 HA TYR A 35 -3.416 23.824 24.117 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.870 22.826 22.749 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -0.869 23.074 24.483 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -4.042 22.169 22.884 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -0.521 20.616 24.793 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -5.176 19.987 23.198 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -1.653 18.431 25.101 1.00 0.00 H new ATOM 0 HH TYR A 35 -3.508 17.226 24.787 1.00 0.00 H new ATOM 505 N SER A 36 -2.393 25.913 24.924 1.00 0.00 N ATOM 506 CA SER A 36 -1.838 27.229 25.345 1.00 0.00 C ATOM 507 C SER A 36 -0.518 27.042 26.085 1.00 0.00 C ATOM 508 O SER A 36 -0.370 26.153 26.902 1.00 0.00 O ATOM 509 CB SER A 36 -2.878 27.821 26.287 1.00 0.00 C ATOM 510 OG SER A 36 -2.969 29.221 26.059 1.00 0.00 O ATOM 0 H SER A 36 -3.121 25.535 25.530 1.00 0.00 H new ATOM 0 HA SER A 36 -1.640 27.873 24.488 1.00 0.00 H new ATOM 0 HB2 SER A 36 -3.847 27.349 26.122 1.00 0.00 H new ATOM 0 HB3 SER A 36 -2.601 27.626 27.323 1.00 0.00 H new ATOM 0 HG SER A 36 -2.457 29.698 26.745 1.00 0.00 H new ATOM 516 N LEU A 37 0.438 27.885 25.818 1.00 0.00 N ATOM 517 CA LEU A 37 1.741 27.768 26.521 1.00 0.00 C ATOM 518 C LEU A 37 1.669 28.519 27.849 1.00 0.00 C ATOM 519 O LEU A 37 1.834 29.721 27.905 1.00 0.00 O ATOM 520 CB LEU A 37 2.765 28.420 25.594 1.00 0.00 C ATOM 521 CG LEU A 37 4.118 28.473 26.302 1.00 0.00 C ATOM 522 CD1 LEU A 37 5.049 27.425 25.696 1.00 0.00 C ATOM 523 CD2 LEU A 37 4.731 29.864 26.130 1.00 0.00 C ATOM 0 H LEU A 37 0.373 28.648 25.144 1.00 0.00 H new ATOM 0 HA LEU A 37 2.005 26.733 26.740 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.848 27.853 24.667 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.442 29.426 25.325 1.00 0.00 H new ATOM 0 HG LEU A 37 3.982 28.267 27.364 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.015 27.461 26.200 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.612 26.434 25.821 1.00 0.00 H new ATOM 0 HD13 LEU A 37 5.186 27.630 24.634 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.696 29.901 26.635 1.00 0.00 H new ATOM 0 HD22 LEU A 37 4.869 30.072 25.069 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.066 30.611 26.563 1.00 0.00 H new ATOM 535 N ILE A 38 1.428 27.819 28.920 1.00 0.00 N ATOM 536 CA ILE A 38 1.351 28.496 30.245 1.00 0.00 C ATOM 537 C ILE A 38 2.749 28.538 30.867 1.00 0.00 C ATOM 538 O ILE A 38 3.561 27.664 30.642 1.00 0.00 O ATOM 539 CB ILE A 38 0.404 27.656 31.124 1.00 0.00 C ATOM 540 CG1 ILE A 38 -0.553 26.796 30.278 1.00 0.00 C ATOM 541 CG2 ILE A 38 -0.429 28.587 31.992 1.00 0.00 C ATOM 542 CD1 ILE A 38 -1.359 27.689 29.327 1.00 0.00 C ATOM 0 H ILE A 38 1.281 26.810 28.937 1.00 0.00 H new ATOM 0 HA ILE A 38 0.983 29.518 30.153 1.00 0.00 H new ATOM 0 HB ILE A 38 1.019 26.993 31.733 1.00 0.00 H new ATOM 0 HG12 ILE A 38 0.014 26.061 29.707 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -1.229 26.241 30.929 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.101 27.998 32.616 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.230 29.179 32.627 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -1.014 29.252 31.356 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.033 27.072 28.733 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.940 28.407 29.906 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.678 28.224 28.665 1.00 0.00 H new ATOM 554 N GLY A 39 3.045 29.543 31.642 1.00 0.00 N ATOM 555 CA GLY A 39 4.398 29.620 32.263 1.00 0.00 C ATOM 556 C GLY A 39 5.214 30.727 31.593 1.00 0.00 C ATOM 557 O GLY A 39 4.676 31.708 31.119 1.00 0.00 O ATOM 0 H GLY A 39 2.414 30.311 31.872 1.00 0.00 H new ATOM 0 HA2 GLY A 39 4.307 29.818 33.331 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.911 28.664 32.159 1.00 0.00 H new ATOM 561 N ASN A 40 6.511 30.577 31.553 1.00 0.00 N ATOM 562 CA ASN A 40 7.366 31.620 30.915 1.00 0.00 C ATOM 563 C ASN A 40 7.474 31.372 29.408 1.00 0.00 C ATOM 564 O ASN A 40 7.649 30.254 28.966 1.00 0.00 O ATOM 565 CB ASN A 40 8.737 31.461 31.575 1.00 0.00 C ATOM 566 CG ASN A 40 9.113 32.753 32.304 1.00 0.00 C ATOM 567 OD1 ASN A 40 9.570 33.699 31.694 1.00 0.00 O ATOM 568 ND2 ASN A 40 8.943 32.830 33.596 1.00 0.00 N ATOM 0 H ASN A 40 7.016 29.777 31.935 1.00 0.00 H new ATOM 0 HA ASN A 40 6.957 32.622 31.045 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.718 30.628 32.278 1.00 0.00 H new ATOM 0 HB3 ASN A 40 9.489 31.226 30.822 1.00 0.00 H new ATOM 0 HD21 ASN A 40 9.194 33.684 34.093 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.559 32.036 34.108 1.00 0.00 H new ATOM 575 N SER A 41 7.383 32.406 28.616 1.00 0.00 N ATOM 576 CA SER A 41 7.494 32.226 27.140 1.00 0.00 C ATOM 577 C SER A 41 8.961 32.023 26.761 1.00 0.00 C ATOM 578 O SER A 41 9.512 32.741 25.950 1.00 0.00 O ATOM 579 CB SER A 41 6.962 33.525 26.540 1.00 0.00 C ATOM 580 OG SER A 41 7.920 34.557 26.735 1.00 0.00 O ATOM 0 H SER A 41 7.237 33.366 28.927 1.00 0.00 H new ATOM 0 HA SER A 41 6.940 31.359 26.780 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.763 33.394 25.476 1.00 0.00 H new ATOM 0 HB3 SER A 41 6.017 33.796 27.010 1.00 0.00 H new ATOM 0 HG SER A 41 8.720 34.365 26.203 1.00 0.00 H new ATOM 586 N GLY A 42 9.598 31.056 27.357 1.00 0.00 N ATOM 587 CA GLY A 42 11.032 30.802 27.055 1.00 0.00 C ATOM 588 C GLY A 42 11.674 30.129 28.265 1.00 0.00 C ATOM 589 O GLY A 42 11.682 30.669 29.354 1.00 0.00 O ATOM 0 H GLY A 42 9.184 30.427 28.045 1.00 0.00 H new ATOM 0 HA2 GLY A 42 11.126 30.166 26.175 1.00 0.00 H new ATOM 0 HA3 GLY A 42 11.542 31.738 26.828 1.00 0.00 H new ATOM 593 N VAL A 43 12.217 28.958 28.089 1.00 0.00 N ATOM 594 CA VAL A 43 12.859 28.268 29.245 1.00 0.00 C ATOM 595 C VAL A 43 14.121 29.033 29.616 1.00 0.00 C ATOM 596 O VAL A 43 14.428 30.035 29.013 1.00 0.00 O ATOM 597 CB VAL A 43 13.214 26.853 28.778 1.00 0.00 C ATOM 598 CG1 VAL A 43 13.249 25.925 29.994 1.00 0.00 C ATOM 599 CG2 VAL A 43 12.167 26.331 27.794 1.00 0.00 C ATOM 0 H VAL A 43 12.245 28.451 27.204 1.00 0.00 H new ATOM 0 HA VAL A 43 12.203 28.225 30.115 1.00 0.00 H new ATOM 0 HB VAL A 43 14.185 26.879 28.283 1.00 0.00 H new ATOM 0 HG11 VAL A 43 13.501 24.914 29.673 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.000 26.279 30.700 1.00 0.00 H new ATOM 0 HG13 VAL A 43 12.271 25.920 30.476 1.00 0.00 H new ATOM 0 HG21 VAL A 43 12.438 25.325 27.474 1.00 0.00 H new ATOM 0 HG22 VAL A 43 11.191 26.307 28.279 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.124 26.988 26.925 1.00 0.00 H new ATOM 609 N LEU A 44 14.862 28.583 30.586 1.00 0.00 N ATOM 610 CA LEU A 44 16.104 29.321 30.948 1.00 0.00 C ATOM 611 C LEU A 44 17.209 28.350 31.359 1.00 0.00 C ATOM 612 O LEU A 44 17.276 27.920 32.493 1.00 0.00 O ATOM 613 CB LEU A 44 15.721 30.218 32.128 1.00 0.00 C ATOM 614 CG LEU A 44 16.985 30.850 32.725 1.00 0.00 C ATOM 615 CD1 LEU A 44 17.189 32.246 32.139 1.00 0.00 C ATOM 616 CD2 LEU A 44 16.836 30.952 34.245 1.00 0.00 C ATOM 0 H LEU A 44 14.667 27.748 31.138 1.00 0.00 H new ATOM 0 HA LEU A 44 16.485 29.898 30.105 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.034 30.997 31.798 1.00 0.00 H new ATOM 0 HB3 LEU A 44 15.200 29.635 32.887 1.00 0.00 H new ATOM 0 HG LEU A 44 17.847 30.228 32.484 1.00 0.00 H new ATOM 0 HD11 LEU A 44 18.088 32.692 32.565 1.00 0.00 H new ATOM 0 HD12 LEU A 44 17.298 32.174 31.057 1.00 0.00 H new ATOM 0 HD13 LEU A 44 16.327 32.870 32.376 1.00 0.00 H new ATOM 0 HD21 LEU A 44 17.734 31.401 34.669 1.00 0.00 H new ATOM 0 HD22 LEU A 44 15.972 31.572 34.485 1.00 0.00 H new ATOM 0 HD23 LEU A 44 16.696 29.956 34.664 1.00 0.00 H new ATOM 628 N CYS A 45 18.094 28.021 30.460 1.00 0.00 N ATOM 629 CA CYS A 45 19.202 27.102 30.838 1.00 0.00 C ATOM 630 C CYS A 45 20.344 27.916 31.438 1.00 0.00 C ATOM 631 O CYS A 45 20.958 28.730 30.772 1.00 0.00 O ATOM 632 CB CYS A 45 19.658 26.418 29.551 1.00 0.00 C ATOM 633 SG CYS A 45 20.194 24.731 29.941 1.00 0.00 S ATOM 0 H CYS A 45 18.099 28.344 29.492 1.00 0.00 H new ATOM 0 HA CYS A 45 18.885 26.365 31.575 1.00 0.00 H new ATOM 0 HB2 CYS A 45 18.844 26.397 28.827 1.00 0.00 H new ATOM 0 HB3 CYS A 45 20.475 26.977 29.096 1.00 0.00 H new ATOM 638 N SER A 46 20.624 27.714 32.692 1.00 0.00 N ATOM 639 CA SER A 46 21.723 28.484 33.340 1.00 0.00 C ATOM 640 C SER A 46 22.762 27.527 33.933 1.00 0.00 C ATOM 641 O SER A 46 22.649 27.095 35.063 1.00 0.00 O ATOM 642 CB SER A 46 21.043 29.288 34.448 1.00 0.00 C ATOM 643 OG SER A 46 21.938 29.427 35.543 1.00 0.00 O ATOM 0 H SER A 46 20.141 27.050 33.298 1.00 0.00 H new ATOM 0 HA SER A 46 22.249 29.126 32.634 1.00 0.00 H new ATOM 0 HB2 SER A 46 20.752 30.270 34.075 1.00 0.00 H new ATOM 0 HB3 SER A 46 20.131 28.786 34.770 1.00 0.00 H new ATOM 0 HG SER A 46 22.065 28.556 35.974 1.00 0.00 H new ATOM 649 N GLY A 47 23.773 27.192 33.179 1.00 0.00 N ATOM 650 CA GLY A 47 24.815 26.263 33.700 1.00 0.00 C ATOM 651 C GLY A 47 24.292 24.829 33.631 1.00 0.00 C ATOM 652 O GLY A 47 24.121 24.169 34.637 1.00 0.00 O ATOM 0 H GLY A 47 23.922 27.521 32.225 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.729 26.358 33.114 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.068 26.521 34.728 1.00 0.00 H new ATOM 656 N GLY A 48 24.033 24.341 32.450 1.00 0.00 N ATOM 657 CA GLY A 48 23.517 22.951 32.317 1.00 0.00 C ATOM 658 C GLY A 48 22.387 22.730 33.321 1.00 0.00 C ATOM 659 O GLY A 48 22.405 21.796 34.098 1.00 0.00 O ATOM 0 H GLY A 48 24.156 24.845 31.572 1.00 0.00 H new ATOM 0 HA2 GLY A 48 23.155 22.781 31.303 1.00 0.00 H new ATOM 0 HA3 GLY A 48 24.320 22.235 32.493 1.00 0.00 H new ATOM 663 N GLU A 49 21.404 23.584 33.311 1.00 0.00 N ATOM 664 CA GLU A 49 20.270 23.426 34.267 1.00 0.00 C ATOM 665 C GLU A 49 19.023 24.137 33.743 1.00 0.00 C ATOM 666 O GLU A 49 18.633 25.173 34.245 1.00 0.00 O ATOM 667 CB GLU A 49 20.743 24.086 35.560 1.00 0.00 C ATOM 668 CG GLU A 49 21.171 23.006 36.557 1.00 0.00 C ATOM 669 CD GLU A 49 20.991 23.525 37.985 1.00 0.00 C ATOM 670 OE1 GLU A 49 19.863 23.542 38.450 1.00 0.00 O ATOM 671 OE2 GLU A 49 21.984 23.896 38.588 1.00 0.00 O ATOM 0 H GLU A 49 21.335 24.385 32.683 1.00 0.00 H new ATOM 0 HA GLU A 49 20.005 22.378 34.410 1.00 0.00 H new ATOM 0 HB2 GLU A 49 21.577 24.757 35.354 1.00 0.00 H new ATOM 0 HB3 GLU A 49 19.943 24.692 35.985 1.00 0.00 H new ATOM 0 HG2 GLU A 49 20.576 22.104 36.409 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.212 22.732 36.387 1.00 0.00 H new ATOM 678 N TRP A 50 18.385 23.590 32.747 1.00 0.00 N ATOM 679 CA TRP A 50 17.158 24.246 32.215 1.00 0.00 C ATOM 680 C TRP A 50 16.153 24.441 33.353 1.00 0.00 C ATOM 681 O TRP A 50 15.966 23.569 34.178 1.00 0.00 O ATOM 682 CB TRP A 50 16.594 23.270 31.179 1.00 0.00 C ATOM 683 CG TRP A 50 17.355 23.382 29.897 1.00 0.00 C ATOM 684 CD1 TRP A 50 18.227 22.459 29.427 1.00 0.00 C ATOM 685 CD2 TRP A 50 17.321 24.451 28.909 1.00 0.00 C ATOM 686 NE1 TRP A 50 18.734 22.897 28.218 1.00 0.00 N ATOM 687 CE2 TRP A 50 18.205 24.120 27.855 1.00 0.00 C ATOM 688 CE3 TRP A 50 16.618 25.665 28.827 1.00 0.00 C ATOM 689 CZ2 TRP A 50 18.387 24.962 26.762 1.00 0.00 C ATOM 690 CZ3 TRP A 50 16.797 26.516 27.726 1.00 0.00 C ATOM 691 CH2 TRP A 50 17.680 26.165 26.696 1.00 0.00 C ATOM 0 H TRP A 50 18.657 22.724 32.281 1.00 0.00 H new ATOM 0 HA TRP A 50 17.365 25.223 31.779 1.00 0.00 H new ATOM 0 HB2 TRP A 50 16.655 22.250 31.559 1.00 0.00 H new ATOM 0 HB3 TRP A 50 15.539 23.483 31.004 1.00 0.00 H new ATOM 0 HD1 TRP A 50 18.484 21.532 29.917 1.00 0.00 H new ATOM 0 HE1 TRP A 50 19.415 22.380 27.662 1.00 0.00 H new ATOM 0 HE3 TRP A 50 15.936 25.945 29.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 19.069 24.688 25.971 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 16.251 27.446 27.672 1.00 0.00 H new ATOM 0 HH2 TRP A 50 17.814 26.824 25.851 1.00 0.00 H new ATOM 702 N SER A 51 15.509 25.574 33.415 1.00 0.00 N ATOM 703 CA SER A 51 14.526 25.798 34.515 1.00 0.00 C ATOM 704 C SER A 51 13.357 26.675 34.049 1.00 0.00 C ATOM 705 O SER A 51 13.424 27.344 33.035 1.00 0.00 O ATOM 706 CB SER A 51 15.324 26.503 35.614 1.00 0.00 C ATOM 707 OG SER A 51 14.669 27.713 35.977 1.00 0.00 O ATOM 0 H SER A 51 15.618 26.348 32.759 1.00 0.00 H new ATOM 0 HA SER A 51 14.083 24.863 34.857 1.00 0.00 H new ATOM 0 HB2 SER A 51 15.417 25.853 36.484 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.335 26.715 35.265 1.00 0.00 H new ATOM 0 HG SER A 51 15.180 28.163 36.682 1.00 0.00 H new ATOM 713 N ASP A 52 12.289 26.671 34.803 1.00 0.00 N ATOM 714 CA ASP A 52 11.091 27.495 34.455 1.00 0.00 C ATOM 715 C ASP A 52 10.490 27.067 33.115 1.00 0.00 C ATOM 716 O ASP A 52 10.482 27.821 32.162 1.00 0.00 O ATOM 717 CB ASP A 52 11.594 28.939 34.391 1.00 0.00 C ATOM 718 CG ASP A 52 11.383 29.616 35.747 1.00 0.00 C ATOM 719 OD1 ASP A 52 10.238 29.837 36.104 1.00 0.00 O ATOM 720 OD2 ASP A 52 12.371 29.902 36.405 1.00 0.00 O ATOM 0 H ASP A 52 12.194 26.124 35.658 1.00 0.00 H new ATOM 0 HA ASP A 52 10.298 27.374 35.192 1.00 0.00 H new ATOM 0 HB2 ASP A 52 12.651 28.955 34.126 1.00 0.00 H new ATOM 0 HB3 ASP A 52 11.062 29.486 33.613 1.00 0.00 H new ATOM 725 N PRO A 53 9.985 25.868 33.104 1.00 0.00 N ATOM 726 CA PRO A 53 9.346 25.306 31.902 1.00 0.00 C ATOM 727 C PRO A 53 7.842 25.603 31.915 1.00 0.00 C ATOM 728 O PRO A 53 7.167 25.341 32.890 1.00 0.00 O ATOM 729 CB PRO A 53 9.589 23.812 32.054 1.00 0.00 C ATOM 730 CG PRO A 53 9.767 23.577 33.533 1.00 0.00 C ATOM 731 CD PRO A 53 9.975 24.919 34.207 1.00 0.00 C ATOM 0 HA PRO A 53 9.736 25.716 30.970 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.749 23.237 31.664 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.474 23.501 31.499 1.00 0.00 H new ATOM 0 HG2 PRO A 53 8.891 23.076 33.946 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.622 22.925 33.714 1.00 0.00 H new ATOM 0 HD2 PRO A 53 9.176 25.138 34.915 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.911 24.945 34.765 1.00 0.00 H new ATOM 739 N PRO A 54 7.368 26.137 30.825 1.00 0.00 N ATOM 740 CA PRO A 54 5.929 26.469 30.706 1.00 0.00 C ATOM 741 C PRO A 54 5.123 25.207 30.367 1.00 0.00 C ATOM 742 O PRO A 54 5.680 24.179 30.035 1.00 0.00 O ATOM 743 CB PRO A 54 5.895 27.473 29.561 1.00 0.00 C ATOM 744 CG PRO A 54 7.115 27.183 28.735 1.00 0.00 C ATOM 745 CD PRO A 54 8.119 26.479 29.617 1.00 0.00 C ATOM 0 HA PRO A 54 5.493 26.867 31.623 1.00 0.00 H new ATOM 0 HB2 PRO A 54 4.986 27.363 28.970 1.00 0.00 H new ATOM 0 HB3 PRO A 54 5.909 28.496 29.936 1.00 0.00 H new ATOM 0 HG2 PRO A 54 6.856 26.560 27.879 1.00 0.00 H new ATOM 0 HG3 PRO A 54 7.537 28.107 28.340 1.00 0.00 H new ATOM 0 HD2 PRO A 54 8.518 25.588 29.132 1.00 0.00 H new ATOM 0 HD3 PRO A 54 8.967 27.124 29.846 1.00 0.00 H new ATOM 753 N THR A 55 3.819 25.268 30.456 1.00 0.00 N ATOM 754 CA THR A 55 2.994 24.059 30.147 1.00 0.00 C ATOM 755 C THR A 55 2.255 24.215 28.822 1.00 0.00 C ATOM 756 O THR A 55 1.834 25.292 28.451 1.00 0.00 O ATOM 757 CB THR A 55 1.963 23.965 31.273 1.00 0.00 C ATOM 758 OG1 THR A 55 1.132 25.109 31.238 1.00 0.00 O ATOM 759 CG2 THR A 55 2.668 23.885 32.625 1.00 0.00 C ATOM 0 H THR A 55 3.291 26.097 30.728 1.00 0.00 H new ATOM 0 HA THR A 55 3.626 23.175 30.070 1.00 0.00 H new ATOM 0 HB THR A 55 1.361 23.067 31.136 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.479 25.062 31.967 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.925 23.818 33.420 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.307 23.002 32.651 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.277 24.777 32.771 1.00 0.00 H new ATOM 767 N CYS A 56 2.052 23.131 28.133 1.00 0.00 N ATOM 768 CA CYS A 56 1.290 23.189 26.861 1.00 0.00 C ATOM 769 C CYS A 56 -0.052 22.518 27.097 1.00 0.00 C ATOM 770 O CYS A 56 -0.272 21.377 26.742 1.00 0.00 O ATOM 771 CB CYS A 56 2.128 22.423 25.840 1.00 0.00 C ATOM 772 SG CYS A 56 3.690 23.296 25.573 1.00 0.00 S ATOM 0 H CYS A 56 2.383 22.203 28.398 1.00 0.00 H new ATOM 0 HA CYS A 56 1.106 24.203 26.506 1.00 0.00 H new ATOM 0 HB2 CYS A 56 2.320 21.411 26.196 1.00 0.00 H new ATOM 0 HB3 CYS A 56 1.584 22.332 24.900 1.00 0.00 H new ATOM 777 N GLN A 57 -0.939 23.225 27.731 1.00 0.00 N ATOM 778 CA GLN A 57 -2.273 22.649 28.047 1.00 0.00 C ATOM 779 C GLN A 57 -3.368 23.381 27.274 1.00 0.00 C ATOM 780 O GLN A 57 -3.101 24.148 26.376 1.00 0.00 O ATOM 781 CB GLN A 57 -2.486 22.847 29.559 1.00 0.00 C ATOM 782 CG GLN A 57 -1.371 23.694 30.189 1.00 0.00 C ATOM 783 CD GLN A 57 -1.668 23.900 31.676 1.00 0.00 C ATOM 784 OE1 GLN A 57 -0.803 23.721 32.510 1.00 0.00 O ATOM 785 NE2 GLN A 57 -2.865 24.271 32.046 1.00 0.00 N ATOM 0 H GLN A 57 -0.797 24.184 28.047 1.00 0.00 H new ATOM 0 HA GLN A 57 -2.317 21.596 27.768 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -3.449 23.329 29.730 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -2.525 21.875 30.050 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.408 23.198 30.064 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -1.301 24.657 29.684 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -3.591 24.421 31.346 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -3.073 24.410 33.035 1.00 0.00 H new ATOM 794 N ILE A 58 -4.601 23.156 27.630 1.00 0.00 N ATOM 795 CA ILE A 58 -5.717 23.851 26.928 1.00 0.00 C ATOM 796 C ILE A 58 -6.252 24.959 27.835 1.00 0.00 C ATOM 797 O ILE A 58 -6.444 24.763 29.019 1.00 0.00 O ATOM 798 CB ILE A 58 -6.808 22.797 26.658 1.00 0.00 C ATOM 799 CG1 ILE A 58 -6.268 21.371 26.845 1.00 0.00 C ATOM 800 CG2 ILE A 58 -7.297 22.948 25.219 1.00 0.00 C ATOM 801 CD1 ILE A 58 -6.476 20.934 28.296 1.00 0.00 C ATOM 0 H ILE A 58 -4.885 22.521 28.376 1.00 0.00 H new ATOM 0 HA ILE A 58 -5.391 24.300 25.990 1.00 0.00 H new ATOM 0 HB ILE A 58 -7.620 22.957 27.367 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -6.780 20.685 26.170 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -5.208 21.336 26.591 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -8.070 22.206 25.018 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.708 23.948 25.077 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.463 22.798 24.534 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -6.093 19.922 28.430 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -5.944 21.614 28.961 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -7.540 20.954 28.533 1.00 0.00 H new ATOM 813 N VAL A 59 -6.475 26.127 27.302 1.00 0.00 N ATOM 814 CA VAL A 59 -6.974 27.243 28.157 1.00 0.00 C ATOM 815 C VAL A 59 -8.281 27.792 27.628 1.00 0.00 C ATOM 816 O VAL A 59 -8.495 28.984 27.586 1.00 0.00 O ATOM 817 CB VAL A 59 -5.892 28.310 28.078 1.00 0.00 C ATOM 818 CG1 VAL A 59 -4.555 27.714 28.516 1.00 0.00 C ATOM 819 CG2 VAL A 59 -5.796 28.798 26.634 1.00 0.00 C ATOM 0 H VAL A 59 -6.335 26.358 26.318 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.164 26.912 29.178 1.00 0.00 H new ATOM 0 HB VAL A 59 -6.137 29.145 28.735 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.780 28.478 28.459 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.636 27.354 29.542 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.294 26.884 27.860 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.024 29.564 26.559 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -5.541 27.961 25.983 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -6.754 29.217 26.327 1.00 0.00 H new ATOM 829 N LYS A 60 -9.162 26.935 27.250 1.00 0.00 N ATOM 830 CA LYS A 60 -10.470 27.419 26.738 1.00 0.00 C ATOM 831 C LYS A 60 -11.391 27.712 27.925 1.00 0.00 C ATOM 832 O LYS A 60 -12.013 26.826 28.476 1.00 0.00 O ATOM 833 CB LYS A 60 -11.024 26.277 25.884 1.00 0.00 C ATOM 834 CG LYS A 60 -10.341 26.281 24.515 1.00 0.00 C ATOM 835 CD LYS A 60 -10.543 24.922 23.841 1.00 0.00 C ATOM 836 CE LYS A 60 -11.209 25.119 22.477 1.00 0.00 C ATOM 837 NZ LYS A 60 -12.661 24.905 22.726 1.00 0.00 N ATOM 0 H LYS A 60 -9.044 25.922 27.269 1.00 0.00 H new ATOM 0 HA LYS A 60 -10.383 28.335 26.154 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -10.856 25.322 26.382 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.102 26.389 25.764 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.756 27.073 23.892 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -9.277 26.488 24.628 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.584 24.419 23.719 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -11.161 24.281 24.470 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -11.018 26.118 22.085 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -10.825 24.410 21.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.187 25.023 21.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.812 23.944 23.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -13.000 25.599 23.423 1.00 0.00 H new ATOM 851 N CYS A 61 -11.460 28.947 28.336 1.00 0.00 N ATOM 852 CA CYS A 61 -12.314 29.301 29.506 1.00 0.00 C ATOM 853 C CYS A 61 -13.800 29.175 29.171 1.00 0.00 C ATOM 854 O CYS A 61 -14.185 29.141 28.019 1.00 0.00 O ATOM 855 CB CYS A 61 -11.954 30.750 29.826 1.00 0.00 C ATOM 856 SG CYS A 61 -10.155 30.904 29.921 1.00 0.00 S ATOM 0 H CYS A 61 -10.961 29.729 27.912 1.00 0.00 H new ATOM 0 HA CYS A 61 -12.140 28.633 30.349 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -12.348 31.414 29.057 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -12.408 31.051 30.770 1.00 0.00 H new ATOM 861 N PRO A 62 -14.580 29.107 30.214 1.00 0.00 N ATOM 862 CA PRO A 62 -16.051 28.979 30.074 1.00 0.00 C ATOM 863 C PRO A 62 -16.663 30.299 29.604 1.00 0.00 C ATOM 864 O PRO A 62 -16.798 30.554 28.423 1.00 0.00 O ATOM 865 CB PRO A 62 -16.514 28.652 31.493 1.00 0.00 C ATOM 866 CG PRO A 62 -15.451 29.201 32.388 1.00 0.00 C ATOM 867 CD PRO A 62 -14.159 29.145 31.619 1.00 0.00 C ATOM 0 HA PRO A 62 -16.346 28.227 29.342 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -17.482 29.106 31.706 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -16.629 27.577 31.632 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -15.683 30.226 32.679 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -15.380 28.617 33.306 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -13.535 30.015 31.825 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -13.575 28.264 31.884 1.00 0.00 H new ATOM 875 N HIS A 63 -17.033 31.137 30.528 1.00 0.00 N ATOM 876 CA HIS A 63 -17.637 32.443 30.172 1.00 0.00 C ATOM 877 C HIS A 63 -17.543 33.365 31.378 1.00 0.00 C ATOM 878 O HIS A 63 -17.860 32.969 32.482 1.00 0.00 O ATOM 879 CB HIS A 63 -19.094 32.130 29.856 1.00 0.00 C ATOM 880 CG HIS A 63 -19.395 32.510 28.434 1.00 0.00 C ATOM 881 ND1 HIS A 63 -20.468 31.977 27.737 1.00 0.00 N ATOM 882 CD2 HIS A 63 -18.777 33.374 27.567 1.00 0.00 C ATOM 883 CE1 HIS A 63 -20.462 32.523 26.507 1.00 0.00 C ATOM 884 NE2 HIS A 63 -19.451 33.381 26.351 1.00 0.00 N ATOM 0 H HIS A 63 -16.940 30.968 31.530 1.00 0.00 H new ATOM 0 HA HIS A 63 -17.142 32.931 29.333 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -19.290 31.069 30.008 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -19.749 32.676 30.535 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -17.899 33.961 27.794 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -21.187 32.295 25.739 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -19.222 33.925 25.519 1.00 0.00 H new ATOM 892 N PRO A 64 -17.103 34.560 31.143 1.00 0.00 N ATOM 893 CA PRO A 64 -16.963 35.519 32.248 1.00 0.00 C ATOM 894 C PRO A 64 -18.331 36.100 32.593 1.00 0.00 C ATOM 895 O PRO A 64 -18.585 37.273 32.411 1.00 0.00 O ATOM 896 CB PRO A 64 -16.046 36.585 31.680 1.00 0.00 C ATOM 897 CG PRO A 64 -16.242 36.526 30.195 1.00 0.00 C ATOM 898 CD PRO A 64 -16.702 35.129 29.852 1.00 0.00 C ATOM 0 HA PRO A 64 -16.569 35.080 33.165 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -16.299 37.570 32.071 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -15.007 36.393 31.947 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -16.981 37.262 29.876 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.313 36.762 29.676 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -17.533 35.144 29.147 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -15.904 34.548 29.391 1.00 0.00 H new ATOM 906 N THR A 65 -19.214 35.280 33.080 1.00 0.00 N ATOM 907 CA THR A 65 -20.574 35.774 33.433 1.00 0.00 C ATOM 908 C THR A 65 -20.563 36.407 34.820 1.00 0.00 C ATOM 909 O THR A 65 -19.562 36.401 35.508 1.00 0.00 O ATOM 910 CB THR A 65 -21.463 34.533 33.420 1.00 0.00 C ATOM 911 OG1 THR A 65 -20.658 33.372 33.565 1.00 0.00 O ATOM 912 CG2 THR A 65 -22.218 34.472 32.096 1.00 0.00 C ATOM 0 H THR A 65 -19.055 34.287 33.250 1.00 0.00 H new ATOM 0 HA THR A 65 -20.927 36.536 32.739 1.00 0.00 H new ATOM 0 HB THR A 65 -22.175 34.581 34.244 1.00 0.00 H new ATOM 0 HG1 THR A 65 -20.182 33.409 34.421 1.00 0.00 H new ATOM 0 HG21 THR A 65 -22.855 33.588 32.081 1.00 0.00 H new ATOM 0 HG22 THR A 65 -22.834 35.365 31.987 1.00 0.00 H new ATOM 0 HG23 THR A 65 -21.505 34.420 31.273 1.00 0.00 H new ATOM 920 N ILE A 66 -21.666 36.958 35.238 1.00 0.00 N ATOM 921 CA ILE A 66 -21.702 37.592 36.583 1.00 0.00 C ATOM 922 C ILE A 66 -23.112 38.102 36.902 1.00 0.00 C ATOM 923 O ILE A 66 -23.950 38.244 36.033 1.00 0.00 O ATOM 924 CB ILE A 66 -20.677 38.748 36.526 1.00 0.00 C ATOM 925 CG1 ILE A 66 -21.133 39.916 37.408 1.00 0.00 C ATOM 926 CG2 ILE A 66 -20.501 39.247 35.088 1.00 0.00 C ATOM 927 CD1 ILE A 66 -19.974 40.896 37.581 1.00 0.00 C ATOM 0 H ILE A 66 -22.538 36.997 34.711 1.00 0.00 H new ATOM 0 HA ILE A 66 -21.451 36.886 37.374 1.00 0.00 H new ATOM 0 HB ILE A 66 -19.725 38.365 36.893 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -21.986 40.420 36.953 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -21.461 39.547 38.380 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -19.775 40.060 35.071 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -20.145 38.430 34.460 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -21.457 39.606 34.708 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -20.292 41.729 38.208 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -19.134 40.387 38.054 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -19.667 41.273 36.605 1.00 0.00 H new ATOM 939 N SER A 67 -23.373 38.373 38.153 1.00 0.00 N ATOM 940 CA SER A 67 -24.721 38.869 38.551 1.00 0.00 C ATOM 941 C SER A 67 -24.894 40.342 38.169 1.00 0.00 C ATOM 942 O SER A 67 -24.319 41.224 38.776 1.00 0.00 O ATOM 943 CB SER A 67 -24.772 38.697 40.068 1.00 0.00 C ATOM 944 OG SER A 67 -25.288 37.408 40.376 1.00 0.00 O ATOM 0 H SER A 67 -22.707 38.271 38.919 1.00 0.00 H new ATOM 0 HA SER A 67 -25.520 38.324 38.048 1.00 0.00 H new ATOM 0 HB2 SER A 67 -23.775 38.814 40.493 1.00 0.00 H new ATOM 0 HB3 SER A 67 -25.400 39.469 40.512 1.00 0.00 H new ATOM 0 HG SER A 67 -25.321 37.293 41.349 1.00 0.00 H new ATOM 950 N ASN A 68 -25.689 40.610 37.168 1.00 0.00 N ATOM 951 CA ASN A 68 -25.913 42.021 36.741 1.00 0.00 C ATOM 952 C ASN A 68 -24.590 42.788 36.717 1.00 0.00 C ATOM 953 O ASN A 68 -24.530 43.948 37.068 1.00 0.00 O ATOM 954 CB ASN A 68 -26.851 42.613 37.794 1.00 0.00 C ATOM 955 CG ASN A 68 -28.298 42.248 37.452 1.00 0.00 C ATOM 956 OD1 ASN A 68 -28.544 41.285 36.755 1.00 0.00 O ATOM 957 ND2 ASN A 68 -29.272 42.984 37.915 1.00 0.00 N ATOM 0 H ASN A 68 -26.195 39.909 36.626 1.00 0.00 H new ATOM 0 HA ASN A 68 -26.334 42.081 35.737 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -26.592 42.232 38.782 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -26.737 43.696 37.830 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -30.239 42.750 37.691 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -29.066 43.793 38.501 1.00 0.00 H new ATOM 964 N GLY A 69 -23.528 42.156 36.305 1.00 0.00 N ATOM 965 CA GLY A 69 -22.222 42.867 36.266 1.00 0.00 C ATOM 966 C GLY A 69 -21.407 42.379 35.071 1.00 0.00 C ATOM 967 O GLY A 69 -20.196 42.411 35.087 1.00 0.00 O ATOM 0 H GLY A 69 -23.507 41.184 35.996 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -22.384 43.942 36.193 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -21.672 42.689 37.190 1.00 0.00 H new ATOM 971 N TYR A 70 -22.067 41.916 34.044 1.00 0.00 N ATOM 972 CA TYR A 70 -21.342 41.411 32.840 1.00 0.00 C ATOM 973 C TYR A 70 -20.205 42.330 32.440 1.00 0.00 C ATOM 974 O TYR A 70 -19.950 43.347 33.044 1.00 0.00 O ATOM 975 CB TYR A 70 -22.361 41.385 31.706 1.00 0.00 C ATOM 976 CG TYR A 70 -22.764 42.801 31.348 1.00 0.00 C ATOM 977 CD1 TYR A 70 -23.633 43.524 32.178 1.00 0.00 C ATOM 978 CD2 TYR A 70 -22.261 43.395 30.184 1.00 0.00 C ATOM 979 CE1 TYR A 70 -23.996 44.834 31.842 1.00 0.00 C ATOM 980 CE2 TYR A 70 -22.623 44.704 29.850 1.00 0.00 C ATOM 981 CZ TYR A 70 -23.490 45.424 30.679 1.00 0.00 C ATOM 982 OH TYR A 70 -23.846 46.716 30.349 1.00 0.00 O ATOM 0 H TYR A 70 -23.084 41.865 33.986 1.00 0.00 H new ATOM 0 HA TYR A 70 -20.915 40.431 33.053 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -21.937 40.886 30.835 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -23.238 40.812 32.006 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -24.023 43.070 33.077 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -21.592 42.841 29.542 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -24.667 45.389 32.481 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -22.233 45.159 28.952 1.00 0.00 H new ATOM 0 HH TYR A 70 -23.406 46.973 29.512 1.00 0.00 H new ATOM 992 N LEU A 71 -19.542 41.970 31.392 1.00 0.00 N ATOM 993 CA LEU A 71 -18.415 42.812 30.897 1.00 0.00 C ATOM 994 C LEU A 71 -18.785 43.498 29.578 1.00 0.00 C ATOM 995 O LEU A 71 -19.655 43.065 28.852 1.00 0.00 O ATOM 996 CB LEU A 71 -17.193 41.880 30.744 1.00 0.00 C ATOM 997 CG LEU A 71 -17.530 40.569 30.016 1.00 0.00 C ATOM 998 CD1 LEU A 71 -18.108 39.572 31.011 1.00 0.00 C ATOM 999 CD2 LEU A 71 -18.528 40.798 28.879 1.00 0.00 C ATOM 0 H LEU A 71 -19.726 41.127 30.848 1.00 0.00 H new ATOM 0 HA LEU A 71 -18.185 43.615 31.597 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -16.409 42.403 30.196 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -16.792 41.649 31.731 1.00 0.00 H new ATOM 0 HG LEU A 71 -16.611 40.176 29.582 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -18.348 38.642 30.496 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -17.377 39.375 31.795 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -19.014 39.985 31.455 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -18.743 39.849 28.387 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -19.451 41.214 29.283 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -18.102 41.494 28.156 1.00 0.00 H new ATOM 1011 N SER A 72 -18.144 44.587 29.272 1.00 0.00 N ATOM 1012 CA SER A 72 -18.475 45.304 28.013 1.00 0.00 C ATOM 1013 C SER A 72 -17.188 45.667 27.261 1.00 0.00 C ATOM 1014 O SER A 72 -17.200 46.444 26.329 1.00 0.00 O ATOM 1015 CB SER A 72 -19.209 46.569 28.463 1.00 0.00 C ATOM 1016 OG SER A 72 -18.587 47.710 27.885 1.00 0.00 O ATOM 0 H SER A 72 -17.408 45.011 29.836 1.00 0.00 H new ATOM 0 HA SER A 72 -19.080 44.700 27.336 1.00 0.00 H new ATOM 0 HB2 SER A 72 -20.256 46.521 28.163 1.00 0.00 H new ATOM 0 HB3 SER A 72 -19.193 46.644 29.550 1.00 0.00 H new ATOM 0 HG SER A 72 -18.440 47.553 26.929 1.00 0.00 H new ATOM 1022 N SER A 73 -16.077 45.117 27.673 1.00 0.00 N ATOM 1023 CA SER A 73 -14.787 45.439 26.995 1.00 0.00 C ATOM 1024 C SER A 73 -14.575 44.545 25.771 1.00 0.00 C ATOM 1025 O SER A 73 -14.799 44.951 24.648 1.00 0.00 O ATOM 1026 CB SER A 73 -13.712 45.167 28.048 1.00 0.00 C ATOM 1027 OG SER A 73 -13.029 46.378 28.346 1.00 0.00 O ATOM 0 H SER A 73 -16.007 44.459 28.449 1.00 0.00 H new ATOM 0 HA SER A 73 -14.763 46.467 26.634 1.00 0.00 H new ATOM 0 HB2 SER A 73 -14.166 44.760 28.952 1.00 0.00 H new ATOM 0 HB3 SER A 73 -13.008 44.420 27.681 1.00 0.00 H new ATOM 0 HG SER A 73 -12.340 46.207 29.022 1.00 0.00 H new ATOM 1033 N GLY A 74 -14.139 43.334 25.977 1.00 0.00 N ATOM 1034 CA GLY A 74 -13.905 42.422 24.824 1.00 0.00 C ATOM 1035 C GLY A 74 -14.336 41.003 25.190 1.00 0.00 C ATOM 1036 O GLY A 74 -13.536 40.181 25.592 1.00 0.00 O ATOM 0 H GLY A 74 -13.935 42.937 26.894 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -14.464 42.769 23.955 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.850 42.432 24.549 1.00 0.00 H new ATOM 1040 N PHE A 75 -15.597 40.712 25.050 1.00 0.00 N ATOM 1041 CA PHE A 75 -16.094 39.347 25.384 1.00 0.00 C ATOM 1042 C PHE A 75 -16.231 38.514 24.105 1.00 0.00 C ATOM 1043 O PHE A 75 -16.284 39.043 23.013 1.00 0.00 O ATOM 1044 CB PHE A 75 -17.452 39.589 26.052 1.00 0.00 C ATOM 1045 CG PHE A 75 -18.364 38.397 25.854 1.00 0.00 C ATOM 1046 CD1 PHE A 75 -18.973 38.179 24.612 1.00 0.00 C ATOM 1047 CD2 PHE A 75 -18.604 37.516 26.915 1.00 0.00 C ATOM 1048 CE1 PHE A 75 -19.820 37.078 24.431 1.00 0.00 C ATOM 1049 CE2 PHE A 75 -19.451 36.416 26.733 1.00 0.00 C ATOM 1050 CZ PHE A 75 -20.059 36.197 25.491 1.00 0.00 C ATOM 0 H PHE A 75 -16.309 41.362 24.717 1.00 0.00 H new ATOM 0 HA PHE A 75 -15.421 38.791 26.037 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -17.312 39.773 27.117 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -17.916 40.482 25.633 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -18.790 38.860 23.794 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -18.136 37.685 27.874 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -20.289 36.909 23.473 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -19.635 35.736 27.551 1.00 0.00 H new ATOM 0 HZ PHE A 75 -20.712 35.348 25.351 1.00 0.00 H new ATOM 1060 N LYS A 76 -16.281 37.216 24.232 1.00 0.00 N ATOM 1061 CA LYS A 76 -16.406 36.357 23.020 1.00 0.00 C ATOM 1062 C LYS A 76 -17.085 35.030 23.370 1.00 0.00 C ATOM 1063 O LYS A 76 -17.067 34.591 24.502 1.00 0.00 O ATOM 1064 CB LYS A 76 -14.969 36.113 22.566 1.00 0.00 C ATOM 1065 CG LYS A 76 -14.963 35.678 21.100 1.00 0.00 C ATOM 1066 CD LYS A 76 -13.696 34.872 20.815 1.00 0.00 C ATOM 1067 CE LYS A 76 -12.482 35.804 20.840 1.00 0.00 C ATOM 1068 NZ LYS A 76 -11.369 35.009 20.249 1.00 0.00 N ATOM 0 H LYS A 76 -16.241 36.714 25.119 1.00 0.00 H new ATOM 0 HA LYS A 76 -17.012 36.826 22.245 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -14.379 37.021 22.689 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -14.506 35.345 23.186 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -15.846 35.077 20.884 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -15.005 36.552 20.450 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -13.578 34.084 21.559 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -13.773 34.384 19.843 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.669 36.710 20.263 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -12.246 36.117 21.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.502 35.584 20.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.209 34.156 20.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.618 34.731 19.278 1.00 0.00 H new ATOM 1082 N ARG A 77 -17.677 34.385 22.403 1.00 0.00 N ATOM 1083 CA ARG A 77 -18.349 33.084 22.677 1.00 0.00 C ATOM 1084 C ARG A 77 -17.373 32.129 23.368 1.00 0.00 C ATOM 1085 O ARG A 77 -17.759 31.282 24.147 1.00 0.00 O ATOM 1086 CB ARG A 77 -18.744 32.546 21.302 1.00 0.00 C ATOM 1087 CG ARG A 77 -20.219 32.855 21.044 1.00 0.00 C ATOM 1088 CD ARG A 77 -20.649 32.247 19.706 1.00 0.00 C ATOM 1089 NE ARG A 77 -20.428 30.782 19.857 1.00 0.00 N ATOM 1090 CZ ARG A 77 -21.372 30.026 20.348 1.00 0.00 C ATOM 1091 NH1 ARG A 77 -22.355 29.629 19.586 1.00 0.00 N ATOM 1092 NH2 ARG A 77 -21.332 29.667 21.601 1.00 0.00 N ATOM 0 H ARG A 77 -17.724 34.703 21.435 1.00 0.00 H new ATOM 0 HA ARG A 77 -19.212 33.191 23.334 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -18.125 33.001 20.529 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -18.572 31.471 21.256 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -20.831 32.452 21.851 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -20.378 33.933 21.032 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -21.694 32.468 19.490 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -20.061 32.652 18.882 1.00 0.00 H new ATOM 0 HE ARG A 77 -19.538 30.369 19.577 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -22.386 29.910 18.606 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -23.092 29.038 19.971 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -20.564 29.977 22.196 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -22.069 29.076 21.986 1.00 0.00 H new ATOM 1106 N SER A 78 -16.109 32.266 23.083 1.00 0.00 N ATOM 1107 CA SER A 78 -15.095 31.374 23.717 1.00 0.00 C ATOM 1108 C SER A 78 -13.826 32.166 24.047 1.00 0.00 C ATOM 1109 O SER A 78 -13.678 33.309 23.661 1.00 0.00 O ATOM 1110 CB SER A 78 -14.799 30.305 22.666 1.00 0.00 C ATOM 1111 OG SER A 78 -14.955 30.866 21.369 1.00 0.00 O ATOM 0 H SER A 78 -15.732 32.959 22.437 1.00 0.00 H new ATOM 0 HA SER A 78 -15.452 30.941 24.652 1.00 0.00 H new ATOM 0 HB2 SER A 78 -13.785 29.926 22.791 1.00 0.00 H new ATOM 0 HB3 SER A 78 -15.473 29.458 22.792 1.00 0.00 H new ATOM 0 HG SER A 78 -14.764 30.183 20.692 1.00 0.00 H new ATOM 1117 N TYR A 79 -12.909 31.568 24.758 1.00 0.00 N ATOM 1118 CA TYR A 79 -11.652 32.290 25.114 1.00 0.00 C ATOM 1119 C TYR A 79 -10.461 31.325 25.107 1.00 0.00 C ATOM 1120 O TYR A 79 -10.612 30.141 24.880 1.00 0.00 O ATOM 1121 CB TYR A 79 -11.896 32.826 26.522 1.00 0.00 C ATOM 1122 CG TYR A 79 -13.226 33.537 26.566 1.00 0.00 C ATOM 1123 CD1 TYR A 79 -14.393 32.819 26.849 1.00 0.00 C ATOM 1124 CD2 TYR A 79 -13.292 34.915 26.326 1.00 0.00 C ATOM 1125 CE1 TYR A 79 -15.626 33.477 26.891 1.00 0.00 C ATOM 1126 CE2 TYR A 79 -14.525 35.574 26.369 1.00 0.00 C ATOM 1127 CZ TYR A 79 -15.693 34.855 26.653 1.00 0.00 C ATOM 1128 OH TYR A 79 -16.910 35.505 26.699 1.00 0.00 O ATOM 0 H TYR A 79 -12.975 30.612 25.108 1.00 0.00 H new ATOM 0 HA TYR A 79 -11.417 33.084 24.406 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -11.885 32.007 27.241 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.096 33.510 26.806 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -14.341 31.756 27.035 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.391 35.469 26.108 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -16.527 32.922 27.107 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -14.576 36.637 26.183 1.00 0.00 H new ATOM 0 HH TYR A 79 -17.482 35.181 25.972 1.00 0.00 H new ATOM 1138 N SER A 80 -9.277 31.821 25.355 1.00 0.00 N ATOM 1139 CA SER A 80 -8.084 30.926 25.363 1.00 0.00 C ATOM 1140 C SER A 80 -6.908 31.613 26.079 1.00 0.00 C ATOM 1141 O SER A 80 -6.144 32.330 25.467 1.00 0.00 O ATOM 1142 CB SER A 80 -7.750 30.706 23.887 1.00 0.00 C ATOM 1143 OG SER A 80 -7.806 31.951 23.202 1.00 0.00 O ATOM 0 H SER A 80 -9.086 32.803 25.552 1.00 0.00 H new ATOM 0 HA SER A 80 -8.274 29.989 25.887 1.00 0.00 H new ATOM 0 HB2 SER A 80 -6.757 30.268 23.788 1.00 0.00 H new ATOM 0 HB3 SER A 80 -8.454 30.002 23.444 1.00 0.00 H new ATOM 0 HG SER A 80 -7.252 32.609 23.673 1.00 0.00 H new ATOM 1149 N TYR A 81 -6.753 31.398 27.367 1.00 0.00 N ATOM 1150 CA TYR A 81 -5.628 32.050 28.113 1.00 0.00 C ATOM 1151 C TYR A 81 -5.700 33.581 27.955 1.00 0.00 C ATOM 1152 O TYR A 81 -5.933 34.098 26.882 1.00 0.00 O ATOM 1153 CB TYR A 81 -4.355 31.484 27.480 1.00 0.00 C ATOM 1154 CG TYR A 81 -3.191 32.412 27.740 1.00 0.00 C ATOM 1155 CD1 TYR A 81 -2.677 32.539 29.035 1.00 0.00 C ATOM 1156 CD2 TYR A 81 -2.629 33.143 26.688 1.00 0.00 C ATOM 1157 CE1 TYR A 81 -1.600 33.398 29.279 1.00 0.00 C ATOM 1158 CE2 TYR A 81 -1.551 34.002 26.931 1.00 0.00 C ATOM 1159 CZ TYR A 81 -1.036 34.130 28.227 1.00 0.00 C ATOM 1160 OH TYR A 81 0.025 34.979 28.467 1.00 0.00 O ATOM 0 H TYR A 81 -7.356 30.800 27.932 1.00 0.00 H new ATOM 0 HA TYR A 81 -5.665 31.851 29.184 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -4.143 30.497 27.891 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.498 31.358 26.407 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -3.112 31.974 29.846 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -3.027 33.045 25.689 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -1.204 33.497 30.279 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -1.116 34.566 26.119 1.00 0.00 H new ATOM 0 HH TYR A 81 0.296 35.409 27.629 1.00 0.00 H new ATOM 1170 N ASN A 82 -5.504 34.309 29.020 1.00 0.00 N ATOM 1171 CA ASN A 82 -5.566 35.800 28.933 1.00 0.00 C ATOM 1172 C ASN A 82 -6.974 36.257 28.534 1.00 0.00 C ATOM 1173 O ASN A 82 -7.939 35.931 29.189 1.00 0.00 O ATOM 1174 CB ASN A 82 -4.538 36.183 27.873 1.00 0.00 C ATOM 1175 CG ASN A 82 -4.245 37.683 27.961 1.00 0.00 C ATOM 1176 OD1 ASN A 82 -5.073 38.498 27.605 1.00 0.00 O ATOM 1177 ND2 ASN A 82 -3.092 38.085 28.422 1.00 0.00 N ATOM 0 H ASN A 82 -5.303 33.938 29.949 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.350 36.278 29.889 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -3.620 35.614 28.019 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -4.913 35.933 26.881 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -2.887 39.082 28.483 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -2.396 37.402 28.721 1.00 0.00 H new ATOM 1184 N ASP A 83 -7.109 37.027 27.491 1.00 0.00 N ATOM 1185 CA ASP A 83 -8.467 37.505 27.112 1.00 0.00 C ATOM 1186 C ASP A 83 -9.110 38.188 28.320 1.00 0.00 C ATOM 1187 O ASP A 83 -10.016 37.664 28.937 1.00 0.00 O ATOM 1188 CB ASP A 83 -9.248 36.251 26.712 1.00 0.00 C ATOM 1189 CG ASP A 83 -9.896 36.468 25.343 1.00 0.00 C ATOM 1190 OD1 ASP A 83 -10.399 37.555 25.113 1.00 0.00 O ATOM 1191 OD2 ASP A 83 -9.880 35.542 24.549 1.00 0.00 O ATOM 0 H ASP A 83 -6.347 37.343 26.891 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.448 38.228 26.296 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.581 35.390 26.678 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.013 36.033 27.458 1.00 0.00 H new ATOM 1196 N ASN A 84 -8.624 39.347 28.674 1.00 0.00 N ATOM 1197 CA ASN A 84 -9.176 40.064 29.858 1.00 0.00 C ATOM 1198 C ASN A 84 -10.558 40.659 29.556 1.00 0.00 C ATOM 1199 O ASN A 84 -10.775 41.252 28.518 1.00 0.00 O ATOM 1200 CB ASN A 84 -8.173 41.183 30.141 1.00 0.00 C ATOM 1201 CG ASN A 84 -8.762 42.142 31.177 1.00 0.00 C ATOM 1202 OD1 ASN A 84 -8.605 41.941 32.365 1.00 0.00 O ATOM 1203 ND2 ASN A 84 -9.438 43.183 30.775 1.00 0.00 N ATOM 0 H ASN A 84 -7.866 39.829 28.192 1.00 0.00 H new ATOM 0 HA ASN A 84 -9.308 39.392 30.706 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.237 40.763 30.509 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.942 41.721 29.221 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -9.835 43.828 31.458 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -9.570 43.352 29.778 1.00 0.00 H new ATOM 1210 N VAL A 85 -11.486 40.528 30.470 1.00 0.00 N ATOM 1211 CA VAL A 85 -12.842 41.113 30.249 1.00 0.00 C ATOM 1212 C VAL A 85 -13.193 42.058 31.396 1.00 0.00 C ATOM 1213 O VAL A 85 -13.312 41.652 32.534 1.00 0.00 O ATOM 1214 CB VAL A 85 -13.819 39.945 30.221 1.00 0.00 C ATOM 1215 CG1 VAL A 85 -13.629 39.152 28.926 1.00 0.00 C ATOM 1216 CG2 VAL A 85 -13.578 39.035 31.426 1.00 0.00 C ATOM 0 H VAL A 85 -11.363 40.042 31.358 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.881 41.682 29.320 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.839 40.328 30.265 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -14.328 38.316 28.905 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -13.815 39.802 28.071 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -12.608 38.773 28.878 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -14.280 38.202 31.399 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -12.558 38.651 31.394 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -13.723 39.602 32.345 1.00 0.00 H new ATOM 1226 N ASP A 86 -13.375 43.312 31.103 1.00 0.00 N ATOM 1227 CA ASP A 86 -13.737 44.280 32.177 1.00 0.00 C ATOM 1228 C ASP A 86 -15.222 44.128 32.490 1.00 0.00 C ATOM 1229 O ASP A 86 -16.036 43.993 31.600 1.00 0.00 O ATOM 1230 CB ASP A 86 -13.441 45.664 31.596 1.00 0.00 C ATOM 1231 CG ASP A 86 -13.647 46.725 32.679 1.00 0.00 C ATOM 1232 OD1 ASP A 86 -14.425 46.474 33.585 1.00 0.00 O ATOM 1233 OD2 ASP A 86 -13.023 47.769 32.585 1.00 0.00 O ATOM 0 H ASP A 86 -13.289 43.711 30.168 1.00 0.00 H new ATOM 0 HA ASP A 86 -13.182 44.119 33.101 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -12.417 45.703 31.224 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -14.096 45.862 30.748 1.00 0.00 H new ATOM 1238 N PHE A 87 -15.586 44.113 33.738 1.00 0.00 N ATOM 1239 CA PHE A 87 -17.022 43.925 34.069 1.00 0.00 C ATOM 1240 C PHE A 87 -17.748 45.255 34.260 1.00 0.00 C ATOM 1241 O PHE A 87 -17.319 46.128 34.988 1.00 0.00 O ATOM 1242 CB PHE A 87 -17.019 43.087 35.341 1.00 0.00 C ATOM 1243 CG PHE A 87 -16.682 41.679 34.936 1.00 0.00 C ATOM 1244 CD1 PHE A 87 -17.682 40.843 34.430 1.00 0.00 C ATOM 1245 CD2 PHE A 87 -15.364 41.223 35.023 1.00 0.00 C ATOM 1246 CE1 PHE A 87 -17.366 39.552 34.008 1.00 0.00 C ATOM 1247 CE2 PHE A 87 -15.049 39.926 34.608 1.00 0.00 C ATOM 1248 CZ PHE A 87 -16.051 39.093 34.097 1.00 0.00 C ATOM 0 H PHE A 87 -14.960 44.221 34.536 1.00 0.00 H new ATOM 0 HA PHE A 87 -17.563 43.434 33.260 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -16.288 43.469 36.053 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -17.992 43.125 35.831 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -18.700 41.197 34.366 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -14.591 41.871 35.410 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -18.138 38.908 33.613 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -14.033 39.567 34.682 1.00 0.00 H new ATOM 0 HZ PHE A 87 -15.806 38.093 33.771 1.00 0.00 H new ATOM 1258 N LYS A 88 -18.859 45.392 33.592 1.00 0.00 N ATOM 1259 CA LYS A 88 -19.671 46.633 33.685 1.00 0.00 C ATOM 1260 C LYS A 88 -20.833 46.415 34.654 1.00 0.00 C ATOM 1261 O LYS A 88 -21.902 45.988 34.263 1.00 0.00 O ATOM 1262 CB LYS A 88 -20.200 46.833 32.265 1.00 0.00 C ATOM 1263 CG LYS A 88 -20.524 48.311 32.035 1.00 0.00 C ATOM 1264 CD LYS A 88 -19.241 49.071 31.694 1.00 0.00 C ATOM 1265 CE LYS A 88 -19.524 50.574 31.693 1.00 0.00 C ATOM 1266 NZ LYS A 88 -18.287 51.198 32.237 1.00 0.00 N ATOM 0 H LYS A 88 -19.245 44.679 32.973 1.00 0.00 H new ATOM 0 HA LYS A 88 -19.104 47.491 34.047 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -19.458 46.497 31.540 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -21.093 46.227 32.111 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -21.246 48.414 31.225 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -20.984 48.736 32.927 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -18.463 48.837 32.421 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -18.870 48.759 30.718 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -19.739 50.935 30.687 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -20.391 50.813 32.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -18.404 52.231 32.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -18.112 50.841 33.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -17.480 50.959 31.626 1.00 0.00 H new ATOM 1280 N CYS A 89 -20.641 46.694 35.914 1.00 0.00 N ATOM 1281 CA CYS A 89 -21.750 46.486 36.886 1.00 0.00 C ATOM 1282 C CYS A 89 -23.057 47.020 36.304 1.00 0.00 C ATOM 1283 O CYS A 89 -23.127 48.142 35.841 1.00 0.00 O ATOM 1284 CB CYS A 89 -21.358 47.272 38.135 1.00 0.00 C ATOM 1285 SG CYS A 89 -21.735 46.279 39.599 1.00 0.00 S ATOM 0 H CYS A 89 -19.772 47.054 36.310 1.00 0.00 H new ATOM 0 HA CYS A 89 -21.903 45.431 37.113 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -20.296 47.515 38.109 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -21.901 48.217 38.171 1.00 0.00 H new ATOM 1290 N LYS A 90 -24.088 46.219 36.315 1.00 0.00 N ATOM 1291 CA LYS A 90 -25.396 46.672 35.754 1.00 0.00 C ATOM 1292 C LYS A 90 -25.651 48.139 36.108 1.00 0.00 C ATOM 1293 O LYS A 90 -25.479 49.024 35.293 1.00 0.00 O ATOM 1294 CB LYS A 90 -26.445 45.778 36.414 1.00 0.00 C ATOM 1295 CG LYS A 90 -26.828 44.650 35.455 1.00 0.00 C ATOM 1296 CD LYS A 90 -27.302 45.249 34.129 1.00 0.00 C ATOM 1297 CE LYS A 90 -28.572 44.530 33.669 1.00 0.00 C ATOM 1298 NZ LYS A 90 -28.825 45.039 32.292 1.00 0.00 N ATOM 0 H LYS A 90 -24.082 45.270 36.688 1.00 0.00 H new ATOM 0 HA LYS A 90 -25.420 46.599 34.667 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -26.053 45.363 37.343 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -27.327 46.364 36.674 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -25.973 43.995 35.286 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -27.616 44.038 35.893 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -27.498 46.315 34.248 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -26.522 45.151 33.374 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -28.436 43.448 33.671 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -29.410 44.748 34.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -29.682 44.591 31.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -28.957 46.070 32.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -28.013 44.811 31.683 1.00 0.00 H new ATOM 1312 N TYR A 91 -26.061 48.401 37.318 1.00 0.00 N ATOM 1313 CA TYR A 91 -26.330 49.811 37.729 1.00 0.00 C ATOM 1314 C TYR A 91 -26.513 49.898 39.247 1.00 0.00 C ATOM 1315 O TYR A 91 -27.102 49.032 39.861 1.00 0.00 O ATOM 1316 CB TYR A 91 -27.624 50.187 37.009 1.00 0.00 C ATOM 1317 CG TYR A 91 -27.386 51.408 36.154 1.00 0.00 C ATOM 1318 CD1 TYR A 91 -27.437 52.686 36.724 1.00 0.00 C ATOM 1319 CD2 TYR A 91 -27.113 51.262 34.789 1.00 0.00 C ATOM 1320 CE1 TYR A 91 -27.216 53.818 35.929 1.00 0.00 C ATOM 1321 CE2 TYR A 91 -26.892 52.393 33.994 1.00 0.00 C ATOM 1322 CZ TYR A 91 -26.943 53.671 34.563 1.00 0.00 C ATOM 1323 OH TYR A 91 -26.724 54.785 33.779 1.00 0.00 O ATOM 0 H TYR A 91 -26.222 47.700 38.042 1.00 0.00 H new ATOM 0 HA TYR A 91 -25.509 50.481 37.473 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -27.963 49.356 36.390 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -28.412 50.386 37.735 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -27.647 52.799 37.777 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -27.073 50.277 34.349 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -27.256 54.803 36.369 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -26.682 52.279 32.941 1.00 0.00 H new ATOM 0 HH TYR A 91 -26.548 54.506 32.856 1.00 0.00 H new ATOM 1333 N GLY A 92 -26.013 50.937 39.859 1.00 0.00 N ATOM 1334 CA GLY A 92 -26.159 51.074 41.337 1.00 0.00 C ATOM 1335 C GLY A 92 -25.723 49.770 42.005 1.00 0.00 C ATOM 1336 O GLY A 92 -26.453 49.178 42.773 1.00 0.00 O ATOM 0 H GLY A 92 -25.510 51.697 39.400 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -25.552 51.904 41.700 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -27.194 51.300 41.593 1.00 0.00 H new ATOM 1340 N TYR A 93 -24.537 49.316 41.706 1.00 0.00 N ATOM 1341 CA TYR A 93 -24.041 48.044 42.307 1.00 0.00 C ATOM 1342 C TYR A 93 -22.510 48.010 42.249 1.00 0.00 C ATOM 1343 O TYR A 93 -21.902 48.595 41.375 1.00 0.00 O ATOM 1344 CB TYR A 93 -24.637 46.949 41.424 1.00 0.00 C ATOM 1345 CG TYR A 93 -26.093 46.737 41.773 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -26.494 46.640 43.112 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -27.042 46.634 40.749 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -27.846 46.439 43.424 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -28.392 46.433 41.062 1.00 0.00 C ATOM 1350 CZ TYR A 93 -28.794 46.336 42.399 1.00 0.00 C ATOM 1351 OH TYR A 93 -30.124 46.136 42.707 1.00 0.00 O ATOM 0 H TYR A 93 -23.886 49.774 41.068 1.00 0.00 H new ATOM 0 HA TYR A 93 -24.325 47.927 43.353 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -24.543 47.226 40.374 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -24.083 46.020 41.559 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -25.763 46.720 43.903 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -26.733 46.710 39.717 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -28.156 46.364 44.456 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -29.123 46.353 40.271 1.00 0.00 H new ATOM 0 HH TYR A 93 -30.648 46.088 41.880 1.00 0.00 H new ATOM 1361 N LYS A 94 -21.881 47.333 43.171 1.00 0.00 N ATOM 1362 CA LYS A 94 -20.390 47.271 43.157 1.00 0.00 C ATOM 1363 C LYS A 94 -19.924 45.868 42.760 1.00 0.00 C ATOM 1364 O LYS A 94 -20.431 44.876 43.243 1.00 0.00 O ATOM 1365 CB LYS A 94 -19.964 47.598 44.589 1.00 0.00 C ATOM 1366 CG LYS A 94 -19.852 49.116 44.754 1.00 0.00 C ATOM 1367 CD LYS A 94 -19.266 49.441 46.130 1.00 0.00 C ATOM 1368 CE LYS A 94 -20.380 49.944 47.052 1.00 0.00 C ATOM 1369 NZ LYS A 94 -20.688 51.319 46.569 1.00 0.00 N ATOM 0 H LYS A 94 -22.332 46.822 43.930 1.00 0.00 H new ATOM 0 HA LYS A 94 -19.954 47.964 42.438 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -20.690 47.197 45.296 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -19.007 47.126 44.812 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -19.218 49.531 43.970 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -20.834 49.577 44.648 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -18.798 48.554 46.557 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -18.487 50.198 46.036 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -21.258 49.301 46.998 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -20.056 49.954 48.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -20.585 51.994 47.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -20.030 51.574 45.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -21.664 51.351 46.211 1.00 0.00 H new ATOM 1383 N LEU A 95 -18.963 45.778 41.880 1.00 0.00 N ATOM 1384 CA LEU A 95 -18.468 44.438 41.447 1.00 0.00 C ATOM 1385 C LEU A 95 -17.657 43.777 42.565 1.00 0.00 C ATOM 1386 O LEU A 95 -16.515 44.118 42.799 1.00 0.00 O ATOM 1387 CB LEU A 95 -17.567 44.715 40.240 1.00 0.00 C ATOM 1388 CG LEU A 95 -18.423 44.939 38.992 1.00 0.00 C ATOM 1389 CD1 LEU A 95 -17.849 46.101 38.179 1.00 0.00 C ATOM 1390 CD2 LEU A 95 -18.420 43.673 38.134 1.00 0.00 C ATOM 0 H LEU A 95 -18.499 46.574 41.442 1.00 0.00 H new ATOM 0 HA LEU A 95 -19.289 43.763 41.205 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -16.949 45.593 40.430 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -16.889 43.876 40.081 1.00 0.00 H new ATOM 0 HG LEU A 95 -19.444 45.173 39.294 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -18.460 46.260 37.290 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -17.851 47.006 38.787 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -16.827 45.866 37.880 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -19.030 43.834 37.245 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -17.398 43.439 37.835 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -18.829 42.843 38.709 1.00 0.00 H new ATOM 1402 N SER A 96 -18.231 42.825 43.249 1.00 0.00 N ATOM 1403 CA SER A 96 -17.481 42.139 44.339 1.00 0.00 C ATOM 1404 C SER A 96 -16.634 41.006 43.751 1.00 0.00 C ATOM 1405 O SER A 96 -17.154 40.026 43.255 1.00 0.00 O ATOM 1406 CB SER A 96 -18.553 41.583 45.277 1.00 0.00 C ATOM 1407 OG SER A 96 -18.449 40.165 45.332 1.00 0.00 O ATOM 0 H SER A 96 -19.184 42.493 43.101 1.00 0.00 H new ATOM 0 HA SER A 96 -16.801 42.810 44.863 1.00 0.00 H new ATOM 0 HB2 SER A 96 -18.433 42.006 46.274 1.00 0.00 H new ATOM 0 HB3 SER A 96 -19.544 41.872 44.926 1.00 0.00 H new ATOM 0 HG SER A 96 -18.286 39.814 44.432 1.00 0.00 H new ATOM 1413 N GLY A 97 -15.337 41.133 43.795 1.00 0.00 N ATOM 1414 CA GLY A 97 -14.467 40.062 43.232 1.00 0.00 C ATOM 1415 C GLY A 97 -13.401 40.690 42.335 1.00 0.00 C ATOM 1416 O GLY A 97 -12.257 40.832 42.718 1.00 0.00 O ATOM 0 H GLY A 97 -14.842 41.930 44.195 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -13.994 39.501 44.038 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -15.067 39.354 42.661 1.00 0.00 H new ATOM 1420 N SER A 98 -13.768 41.064 41.142 1.00 0.00 N ATOM 1421 CA SER A 98 -12.776 41.683 40.214 1.00 0.00 C ATOM 1422 C SER A 98 -13.488 42.310 39.010 1.00 0.00 C ATOM 1423 O SER A 98 -14.049 41.621 38.181 1.00 0.00 O ATOM 1424 CB SER A 98 -11.883 40.528 39.767 1.00 0.00 C ATOM 1425 OG SER A 98 -10.527 40.854 40.037 1.00 0.00 O ATOM 0 H SER A 98 -14.712 40.969 40.767 1.00 0.00 H new ATOM 0 HA SER A 98 -12.207 42.480 40.692 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.161 39.614 40.291 1.00 0.00 H new ATOM 0 HB3 SER A 98 -12.019 40.339 38.702 1.00 0.00 H new ATOM 0 HG SER A 98 -10.412 41.006 40.998 1.00 0.00 H new ATOM 1431 N SER A 99 -13.467 43.611 38.906 1.00 0.00 N ATOM 1432 CA SER A 99 -14.141 44.280 37.754 1.00 0.00 C ATOM 1433 C SER A 99 -13.376 44.004 36.458 1.00 0.00 C ATOM 1434 O SER A 99 -13.819 44.346 35.381 1.00 0.00 O ATOM 1435 CB SER A 99 -14.110 45.772 38.084 1.00 0.00 C ATOM 1436 OG SER A 99 -14.754 46.496 37.044 1.00 0.00 O ATOM 0 H SER A 99 -13.013 44.240 39.568 1.00 0.00 H new ATOM 0 HA SER A 99 -15.158 43.916 37.607 1.00 0.00 H new ATOM 0 HB2 SER A 99 -14.610 45.956 39.035 1.00 0.00 H new ATOM 0 HB3 SER A 99 -13.080 46.111 38.195 1.00 0.00 H new ATOM 0 HG SER A 99 -14.657 46.010 36.198 1.00 0.00 H new ATOM 1442 N SER A 100 -12.231 43.387 36.552 1.00 0.00 N ATOM 1443 CA SER A 100 -11.442 43.090 35.321 1.00 0.00 C ATOM 1444 C SER A 100 -10.823 41.694 35.419 1.00 0.00 C ATOM 1445 O SER A 100 -9.797 41.501 36.041 1.00 0.00 O ATOM 1446 CB SER A 100 -10.352 44.159 35.279 1.00 0.00 C ATOM 1447 OG SER A 100 -9.380 43.878 36.277 1.00 0.00 O ATOM 0 H SER A 100 -11.807 43.076 37.426 1.00 0.00 H new ATOM 0 HA SER A 100 -12.057 43.104 34.421 1.00 0.00 H new ATOM 0 HB2 SER A 100 -9.884 44.179 34.295 1.00 0.00 H new ATOM 0 HB3 SER A 100 -10.787 45.145 35.446 1.00 0.00 H new ATOM 0 HG SER A 100 -8.950 43.019 36.082 1.00 0.00 H new ATOM 1453 N SER A 101 -11.437 40.718 34.809 1.00 0.00 N ATOM 1454 CA SER A 101 -10.878 39.337 34.873 1.00 0.00 C ATOM 1455 C SER A 101 -10.253 38.953 33.545 1.00 0.00 C ATOM 1456 O SER A 101 -10.143 39.756 32.639 1.00 0.00 O ATOM 1457 CB SER A 101 -12.061 38.425 35.193 1.00 0.00 C ATOM 1458 OG SER A 101 -12.807 38.983 36.266 1.00 0.00 O ATOM 0 H SER A 101 -12.298 40.815 34.271 1.00 0.00 H new ATOM 0 HA SER A 101 -10.094 39.256 35.626 1.00 0.00 H new ATOM 0 HB2 SER A 101 -12.696 38.311 34.314 1.00 0.00 H new ATOM 0 HB3 SER A 101 -11.706 37.430 35.461 1.00 0.00 H new ATOM 0 HG SER A 101 -13.438 39.646 35.916 1.00 0.00 H new ATOM 1464 N THR A 102 -9.821 37.734 33.428 1.00 0.00 N ATOM 1465 CA THR A 102 -9.182 37.313 32.165 1.00 0.00 C ATOM 1466 C THR A 102 -9.235 35.795 31.995 1.00 0.00 C ATOM 1467 O THR A 102 -8.948 35.039 32.905 1.00 0.00 O ATOM 1468 CB THR A 102 -7.740 37.793 32.297 1.00 0.00 C ATOM 1469 OG1 THR A 102 -7.728 39.156 32.698 1.00 0.00 O ATOM 1470 CG2 THR A 102 -7.040 37.643 30.955 1.00 0.00 C ATOM 0 H THR A 102 -9.884 37.016 34.150 1.00 0.00 H new ATOM 0 HA THR A 102 -9.685 37.727 31.291 1.00 0.00 H new ATOM 0 HB THR A 102 -7.220 37.197 33.047 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.478 39.627 32.279 1.00 0.00 H new ATOM 0 HG21 THR A 102 -6.009 37.984 31.042 1.00 0.00 H new ATOM 0 HG22 THR A 102 -7.051 36.595 30.654 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.558 38.241 30.206 1.00 0.00 H new ATOM 1478 N CYS A 103 -9.587 35.353 30.820 1.00 0.00 N ATOM 1479 CA CYS A 103 -9.647 33.893 30.546 1.00 0.00 C ATOM 1480 C CYS A 103 -8.251 33.288 30.711 1.00 0.00 C ATOM 1481 O CYS A 103 -7.497 33.184 29.765 1.00 0.00 O ATOM 1482 CB CYS A 103 -10.110 33.799 29.089 1.00 0.00 C ATOM 1483 SG CYS A 103 -9.702 32.168 28.417 1.00 0.00 S ATOM 0 H CYS A 103 -9.838 35.948 30.031 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.313 33.355 31.221 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -11.185 33.968 29.028 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -9.631 34.577 28.495 1.00 0.00 H new ATOM 1488 N SER A 104 -7.897 32.896 31.899 1.00 0.00 N ATOM 1489 CA SER A 104 -6.544 32.314 32.111 1.00 0.00 C ATOM 1490 C SER A 104 -6.498 30.864 31.645 1.00 0.00 C ATOM 1491 O SER A 104 -7.492 30.309 31.218 1.00 0.00 O ATOM 1492 CB SER A 104 -6.307 32.400 33.617 1.00 0.00 C ATOM 1493 OG SER A 104 -5.159 33.201 33.866 1.00 0.00 O ATOM 0 H SER A 104 -8.483 32.952 32.732 1.00 0.00 H new ATOM 0 HA SER A 104 -5.780 32.846 31.543 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.179 32.830 34.110 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.166 31.402 34.032 1.00 0.00 H new ATOM 0 HG SER A 104 -5.005 33.260 34.832 1.00 0.00 H new ATOM 1499 N PRO A 105 -5.327 30.304 31.743 1.00 0.00 N ATOM 1500 CA PRO A 105 -5.117 28.904 31.327 1.00 0.00 C ATOM 1501 C PRO A 105 -5.739 27.947 32.339 1.00 0.00 C ATOM 1502 O PRO A 105 -5.657 28.142 33.535 1.00 0.00 O ATOM 1503 CB PRO A 105 -3.600 28.765 31.273 1.00 0.00 C ATOM 1504 CG PRO A 105 -3.076 29.820 32.195 1.00 0.00 C ATOM 1505 CD PRO A 105 -4.099 30.924 32.249 1.00 0.00 C ATOM 0 HA PRO A 105 -5.584 28.662 30.372 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -3.284 27.772 31.591 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -3.227 28.908 30.259 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -2.903 29.409 33.189 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -2.119 30.201 31.837 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.230 31.295 33.265 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.800 31.774 31.635 1.00 0.00 H new ATOM 1513 N GLY A 106 -6.379 26.922 31.857 1.00 0.00 N ATOM 1514 CA GLY A 106 -7.035 25.950 32.766 1.00 0.00 C ATOM 1515 C GLY A 106 -8.545 25.978 32.510 1.00 0.00 C ATOM 1516 O GLY A 106 -9.282 25.148 33.003 1.00 0.00 O ATOM 0 H GLY A 106 -6.476 26.715 30.863 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -6.642 24.948 32.595 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.823 26.202 33.805 1.00 0.00 H new ATOM 1520 N ASN A 107 -9.000 26.943 31.738 1.00 0.00 N ATOM 1521 CA ASN A 107 -10.456 27.076 31.412 1.00 0.00 C ATOM 1522 C ASN A 107 -11.188 27.769 32.558 1.00 0.00 C ATOM 1523 O ASN A 107 -11.855 27.136 33.350 1.00 0.00 O ATOM 1524 CB ASN A 107 -10.995 25.655 31.203 1.00 0.00 C ATOM 1525 CG ASN A 107 -9.980 24.829 30.409 1.00 0.00 C ATOM 1526 OD1 ASN A 107 -9.039 25.367 29.860 1.00 0.00 O ATOM 1527 ND2 ASN A 107 -10.132 23.536 30.324 1.00 0.00 N ATOM 0 H ASN A 107 -8.408 27.657 31.313 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.608 27.679 30.517 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.188 25.183 32.167 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -11.945 25.691 30.670 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -9.461 22.977 29.797 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.922 23.084 30.785 1.00 0.00 H new ATOM 1534 N THR A 108 -11.066 29.066 32.655 1.00 0.00 N ATOM 1535 CA THR A 108 -11.755 29.790 33.760 1.00 0.00 C ATOM 1536 C THR A 108 -11.608 31.303 33.598 1.00 0.00 C ATOM 1537 O THR A 108 -11.069 31.790 32.624 1.00 0.00 O ATOM 1538 CB THR A 108 -11.050 29.329 35.034 1.00 0.00 C ATOM 1539 OG1 THR A 108 -9.909 28.551 34.698 1.00 0.00 O ATOM 1540 CG2 THR A 108 -12.012 28.490 35.863 1.00 0.00 C ATOM 0 H THR A 108 -10.522 29.652 32.021 1.00 0.00 H new ATOM 0 HA THR A 108 -12.824 29.578 33.774 1.00 0.00 H new ATOM 0 HB THR A 108 -10.732 30.199 35.608 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.459 28.259 35.518 1.00 0.00 H new ATOM 0 HG21 THR A 108 -11.513 28.158 36.774 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.885 29.089 36.124 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.328 27.621 35.285 1.00 0.00 H new ATOM 1548 N TRP A 109 -12.084 32.047 34.558 1.00 0.00 N ATOM 1549 CA TRP A 109 -11.978 33.531 34.488 1.00 0.00 C ATOM 1550 C TRP A 109 -11.270 34.058 35.739 1.00 0.00 C ATOM 1551 O TRP A 109 -11.890 34.367 36.738 1.00 0.00 O ATOM 1552 CB TRP A 109 -13.423 34.018 34.396 1.00 0.00 C ATOM 1553 CG TRP A 109 -13.814 34.026 32.953 1.00 0.00 C ATOM 1554 CD1 TRP A 109 -14.744 33.219 32.382 1.00 0.00 C ATOM 1555 CD2 TRP A 109 -13.284 34.860 31.881 1.00 0.00 C ATOM 1556 NE1 TRP A 109 -14.810 33.505 31.031 1.00 0.00 N ATOM 1557 CE2 TRP A 109 -13.935 34.512 30.675 1.00 0.00 C ATOM 1558 CE3 TRP A 109 -12.314 35.878 31.840 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 -13.633 35.148 29.470 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 -12.010 36.522 30.628 1.00 0.00 C ATOM 1561 CH2 TRP A 109 -12.668 36.158 29.447 1.00 0.00 C ATOM 0 H TRP A 109 -12.545 31.687 35.394 1.00 0.00 H new ATOM 0 HA TRP A 109 -11.392 33.883 33.639 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -14.083 33.364 34.967 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -13.517 35.017 34.822 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -15.335 32.476 32.898 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -15.431 33.029 30.376 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -11.800 36.166 32.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -14.142 34.861 28.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -11.264 37.303 30.608 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -12.430 36.657 28.519 1.00 0.00 H new ATOM 1572 N LYS A 110 -9.963 34.145 35.690 1.00 0.00 N ATOM 1573 CA LYS A 110 -9.194 34.631 36.876 1.00 0.00 C ATOM 1574 C LYS A 110 -8.768 36.096 36.683 1.00 0.00 C ATOM 1575 O LYS A 110 -8.304 36.461 35.621 1.00 0.00 O ATOM 1576 CB LYS A 110 -7.960 33.728 36.939 1.00 0.00 C ATOM 1577 CG LYS A 110 -8.358 32.355 37.485 1.00 0.00 C ATOM 1578 CD LYS A 110 -7.352 31.919 38.552 1.00 0.00 C ATOM 1579 CE LYS A 110 -7.904 32.249 39.940 1.00 0.00 C ATOM 1580 NZ LYS A 110 -6.732 32.743 40.716 1.00 0.00 N ATOM 0 H LYS A 110 -9.396 33.900 34.878 1.00 0.00 H new ATOM 0 HA LYS A 110 -9.786 34.592 37.790 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -7.522 33.623 35.946 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -7.199 34.178 37.577 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -9.360 32.398 37.911 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -8.386 31.625 36.676 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -7.160 30.849 38.470 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -6.400 32.426 38.398 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.687 33.006 39.883 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.345 31.369 40.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.033 32.990 41.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -6.006 32.000 40.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -6.338 33.585 40.251 1.00 0.00 H new ATOM 1594 N PRO A 111 -8.923 36.895 37.717 1.00 0.00 N ATOM 1595 CA PRO A 111 -9.493 36.418 39.007 1.00 0.00 C ATOM 1596 C PRO A 111 -10.976 36.074 38.858 1.00 0.00 C ATOM 1597 O PRO A 111 -11.622 36.448 37.899 1.00 0.00 O ATOM 1598 CB PRO A 111 -9.308 37.605 39.945 1.00 0.00 C ATOM 1599 CG PRO A 111 -9.228 38.792 39.043 1.00 0.00 C ATOM 1600 CD PRO A 111 -8.570 38.318 37.777 1.00 0.00 C ATOM 0 HA PRO A 111 -9.010 35.510 39.369 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -10.142 37.693 40.642 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -8.403 37.500 40.543 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -10.221 39.192 38.838 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -8.650 39.593 39.505 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -8.939 38.860 36.906 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -7.490 38.462 37.808 1.00 0.00 H new ATOM 1608 N GLU A 112 -11.507 35.349 39.801 1.00 0.00 N ATOM 1609 CA GLU A 112 -12.941 34.953 39.730 1.00 0.00 C ATOM 1610 C GLU A 112 -13.796 36.110 39.211 1.00 0.00 C ATOM 1611 O GLU A 112 -13.437 37.265 39.326 1.00 0.00 O ATOM 1612 CB GLU A 112 -13.327 34.606 41.167 1.00 0.00 C ATOM 1613 CG GLU A 112 -14.699 33.929 41.179 1.00 0.00 C ATOM 1614 CD GLU A 112 -15.252 33.919 42.605 1.00 0.00 C ATOM 1615 OE1 GLU A 112 -15.076 34.910 43.295 1.00 0.00 O ATOM 1616 OE2 GLU A 112 -15.841 32.920 42.983 1.00 0.00 O ATOM 0 H GLU A 112 -11.007 35.011 40.623 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.100 34.117 39.048 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.580 33.945 41.606 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -13.350 35.509 41.777 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -15.383 34.459 40.516 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -14.616 32.909 40.803 1.00 0.00 H new ATOM 1623 N LEU A 113 -14.928 35.802 38.642 1.00 0.00 N ATOM 1624 CA LEU A 113 -15.819 36.873 38.115 1.00 0.00 C ATOM 1625 C LEU A 113 -16.292 37.768 39.256 1.00 0.00 C ATOM 1626 O LEU A 113 -16.483 37.320 40.369 1.00 0.00 O ATOM 1627 CB LEU A 113 -16.996 36.124 37.482 1.00 0.00 C ATOM 1628 CG LEU A 113 -16.848 36.037 35.948 1.00 0.00 C ATOM 1629 CD1 LEU A 113 -15.382 36.194 35.514 1.00 0.00 C ATOM 1630 CD2 LEU A 113 -17.359 34.672 35.485 1.00 0.00 C ATOM 0 H LEU A 113 -15.276 34.851 38.519 1.00 0.00 H new ATOM 0 HA LEU A 113 -15.318 37.521 37.396 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -17.058 35.120 37.901 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -17.928 36.631 37.731 1.00 0.00 H new ATOM 0 HG LEU A 113 -17.425 36.845 35.498 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -15.315 36.128 34.428 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -15.007 37.164 35.842 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -14.783 35.402 35.964 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -17.261 34.595 34.402 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -16.774 33.884 35.959 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -18.407 34.562 35.763 1.00 0.00 H new ATOM 1642 N PRO A 114 -16.453 39.015 38.930 1.00 0.00 N ATOM 1643 CA PRO A 114 -16.897 40.016 39.925 1.00 0.00 C ATOM 1644 C PRO A 114 -18.377 39.830 40.273 1.00 0.00 C ATOM 1645 O PRO A 114 -19.063 39.006 39.703 1.00 0.00 O ATOM 1646 CB PRO A 114 -16.661 41.347 39.217 1.00 0.00 C ATOM 1647 CG PRO A 114 -16.686 41.032 37.756 1.00 0.00 C ATOM 1648 CD PRO A 114 -16.237 39.603 37.603 1.00 0.00 C ATOM 0 HA PRO A 114 -16.364 39.939 40.873 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -17.433 42.071 39.476 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -15.705 41.782 39.508 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -17.689 41.166 37.350 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -16.027 41.704 37.206 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -16.814 39.084 36.838 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -15.190 39.544 37.307 1.00 0.00 H new ATOM 1656 N LYS A 115 -18.867 40.594 41.210 1.00 0.00 N ATOM 1657 CA LYS A 115 -20.301 40.475 41.606 1.00 0.00 C ATOM 1658 C LYS A 115 -20.930 41.863 41.705 1.00 0.00 C ATOM 1659 O LYS A 115 -20.566 42.658 42.548 1.00 0.00 O ATOM 1660 CB LYS A 115 -20.279 39.794 42.975 1.00 0.00 C ATOM 1661 CG LYS A 115 -21.644 39.164 43.257 1.00 0.00 C ATOM 1662 CD LYS A 115 -21.454 37.871 44.055 1.00 0.00 C ATOM 1663 CE LYS A 115 -22.691 37.616 44.920 1.00 0.00 C ATOM 1664 NZ LYS A 115 -23.558 36.730 44.096 1.00 0.00 N ATOM 0 H LYS A 115 -18.335 41.298 41.721 1.00 0.00 H new ATOM 0 HA LYS A 115 -20.888 39.909 40.882 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -19.502 39.030 43.000 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -20.036 40.521 43.750 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -22.269 39.860 43.816 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -22.160 38.953 42.320 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -21.293 37.033 43.377 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -20.567 37.947 44.684 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -22.422 37.140 45.863 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -23.200 38.548 45.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -24.428 36.510 44.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -23.803 37.212 43.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -23.050 35.848 43.882 1.00 0.00 H new ATOM 1678 N CYS A 116 -21.873 42.167 40.854 1.00 0.00 N ATOM 1679 CA CYS A 116 -22.511 43.511 40.917 1.00 0.00 C ATOM 1680 C CYS A 116 -23.427 43.584 42.137 1.00 0.00 C ATOM 1681 O CYS A 116 -24.637 43.595 42.030 1.00 0.00 O ATOM 1682 CB CYS A 116 -23.297 43.640 39.611 1.00 0.00 C ATOM 1683 SG CYS A 116 -23.499 45.387 39.158 1.00 0.00 S ATOM 0 H CYS A 116 -22.226 41.548 40.124 1.00 0.00 H new ATOM 0 HA CYS A 116 -21.790 44.322 41.019 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -22.777 43.109 38.813 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -24.275 43.172 39.721 1.00 0.00 H new ATOM 1688 N VAL A 117 -22.838 43.629 43.298 1.00 0.00 N ATOM 1689 CA VAL A 117 -23.637 43.697 44.557 1.00 0.00 C ATOM 1690 C VAL A 117 -23.971 45.127 44.907 1.00 0.00 C ATOM 1691 O VAL A 117 -23.750 46.046 44.144 1.00 0.00 O ATOM 1692 CB VAL A 117 -22.745 43.124 45.651 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -22.678 41.621 45.497 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -21.337 43.712 45.541 1.00 0.00 C ATOM 0 H VAL A 117 -21.827 43.622 43.432 1.00 0.00 H new ATOM 0 HA VAL A 117 -24.573 43.150 44.446 1.00 0.00 H new ATOM 0 HB VAL A 117 -23.160 43.379 46.626 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -22.041 41.203 46.277 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -23.680 41.201 45.584 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -22.264 41.374 44.519 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -20.707 43.296 46.327 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -20.914 43.464 44.568 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -21.386 44.795 45.650 1.00 0.00 H new ATOM 1704 N ARG A 118 -24.492 45.315 46.076 1.00 0.00 N ATOM 1705 CA ARG A 118 -24.831 46.685 46.505 1.00 0.00 C ATOM 1706 C ARG A 118 -24.212 46.981 47.874 1.00 0.00 C ATOM 1707 O ARG A 118 -23.862 46.035 48.560 1.00 0.00 O ATOM 1708 CB ARG A 118 -26.359 46.728 46.577 1.00 0.00 C ATOM 1709 CG ARG A 118 -26.880 45.440 47.222 1.00 0.00 C ATOM 1710 CD ARG A 118 -28.336 45.631 47.655 1.00 0.00 C ATOM 1711 NE ARG A 118 -28.322 45.439 49.132 1.00 0.00 N ATOM 1712 CZ ARG A 118 -29.429 45.166 49.768 1.00 0.00 C ATOM 1713 NH1 ARG A 118 -30.246 44.263 49.300 1.00 0.00 N ATOM 1714 NH2 ARG A 118 -29.717 45.796 50.873 1.00 0.00 N ATOM 1715 OXT ARG A 118 -24.099 48.148 48.211 1.00 0.00 O ATOM 0 H ARG A 118 -24.697 44.580 46.752 1.00 0.00 H new ATOM 0 HA ARG A 118 -24.444 47.435 45.815 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -26.682 47.593 47.157 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -26.777 46.841 45.577 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -26.806 44.613 46.516 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -26.266 45.179 48.084 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -28.701 46.623 47.388 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -28.991 44.909 47.168 1.00 0.00 H new ATOM 0 HE ARG A 118 -27.446 45.521 49.648 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -30.020 43.769 48.436 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -31.111 44.050 49.798 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -29.078 46.501 51.239 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -30.582 45.584 51.371 1.00 0.00 H new