USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1229 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: B 43 GLN : amide:sc= -1.81 K(o=-5.4,f=-6.8!) USER MOD Set 1.2: B 49 ASN : amide:sc= -3.57 K(o=-5.4,f=-9.6!) USER MOD Set 2.1: A 1 MET CE :methyl -110:sc= -2.86 (180deg=-7.11!) USER MOD Set 2.2: B 35 THR OG1 : rot 100:sc= 1.11 USER MOD Set 3.1: A 45 THR OG1 : rot 180:sc= -0.629 USER MOD Set 3.2: B 3 LYS NZ :NH3+ -160:sc= -0.156 (180deg=-0.328) USER MOD Set 4.1: A 43 GLN : amide:sc= -3.1 K(o=-6.9,f=-7.7) USER MOD Set 4.2: A 49 ASN : amide:sc= -3.79 K(o=-6.9,f=-11!) USER MOD Set 5.1: A 35 THR OG1 : rot 63:sc= 0.892 USER MOD Set 5.2: B 1 MET CE :methyl -112:sc= -5.33! (180deg=-11.8!) USER MOD Single : A 1 MET N :NH3+ -115:sc= -1.28 (180deg=-4.48!) USER MOD Single : A 2 ASN : amide:sc= -0.751! C(o=-0.75!,f=-15!) USER MOD Single : A 3 LYS NZ :NH3+ 129:sc= -0.272 (180deg=-1.45!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -153:sc= -0.839 (180deg=-2.05) USER MOD Single : A 12 GLN : amide:sc= -0.393 X(o=-0.39,f=0) USER MOD Single : A 14 THR OG1 : rot -70:sc= -9.02! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.291 K(o=-0.29,f=-2.6!) USER MOD Single : A 20 SER OG : rot -22:sc= -7.08! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -143:sc= -9.44! (180deg=-13.9!) USER MOD Single : A 27 SER OG : rot 89:sc= 1.04 USER MOD Single : A 30 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.0369) USER MOD Single : A 33 THR OG1 : rot 110:sc= -2.43! USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 89:sc= 0.571 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.187) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 145:sc= -0.532 (180deg=-2.94!) USER MOD Single : B 2 ASN : amide:sc= -0.818 K(o=-0.82,f=-3.2!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ -165:sc=-0.00477 (180deg=-0.129) USER MOD Single : B 12 GLN : amide:sc= -0.0533 K(o=-0.053,f=-2.6!) USER MOD Single : B 14 THR OG1 : rot -73:sc= -7.61! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -0.136 K(o=-0.14,f=-2.8!) USER MOD Single : B 20 SER OG : rot 167:sc= -11.2! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -167:sc= -13.1! (180deg=-15.3!) USER MOD Single : B 27 SER OG : rot 106:sc= 1.12 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 99:sc= -6.51! USER MOD Single : B 38 LYS NZ :NH3+ -141:sc= -0.0144 (180deg=-0.354) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -58:sc= 1.09 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= -0.535 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 SER OG : rot -160:sc= -0.102 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.754 3.450 10.450 1.00 0.00 N ATOM 2 CA MET A 1 4.088 4.784 10.330 1.00 0.00 C ATOM 3 C MET A 1 2.571 4.610 10.211 1.00 0.00 C ATOM 4 O MET A 1 2.053 3.526 10.399 1.00 0.00 O ATOM 5 CB MET A 1 4.660 5.409 9.056 1.00 0.00 C ATOM 6 CG MET A 1 5.968 6.131 9.388 1.00 0.00 C ATOM 7 SD MET A 1 7.134 5.936 8.018 1.00 0.00 S ATOM 8 CE MET A 1 6.478 7.263 6.980 1.00 0.00 C ATOM 0 H1 MET A 1 5.204 3.369 11.384 1.00 0.00 H new ATOM 0 H2 MET A 1 4.045 2.697 10.341 1.00 0.00 H new ATOM 0 H3 MET A 1 5.477 3.355 9.709 1.00 0.00 H new ATOM 0 HA MET A 1 4.268 5.412 11.203 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.838 4.637 8.307 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.943 6.110 8.628 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.776 7.189 9.567 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.397 5.725 10.304 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.989 6.833 6.106 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.755 7.847 7.550 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.294 7.910 6.658 1.00 0.00 H new ATOM 20 N ASN A 2 1.849 5.660 9.900 1.00 0.00 N ATOM 21 CA ASN A 2 0.365 5.520 9.775 1.00 0.00 C ATOM 22 C ASN A 2 -0.287 6.809 9.264 1.00 0.00 C ATOM 23 O ASN A 2 0.370 7.691 8.748 1.00 0.00 O ATOM 24 CB ASN A 2 -0.129 5.199 11.190 1.00 0.00 C ATOM 25 CG ASN A 2 -1.313 4.234 11.119 1.00 0.00 C ATOM 26 OD1 ASN A 2 -2.283 4.495 10.436 1.00 0.00 O ATOM 27 ND2 ASN A 2 -1.275 3.121 11.799 1.00 0.00 N ATOM 0 H ASN A 2 2.217 6.596 9.729 1.00 0.00 H new ATOM 0 HA ASN A 2 0.104 4.744 9.055 1.00 0.00 H new ATOM 0 HB2 ASN A 2 0.678 4.757 11.775 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.426 6.116 11.698 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -2.060 2.471 11.757 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -0.461 2.901 12.373 1.00 0.00 H new ATOM 34 N LYS A 3 -1.590 6.921 9.413 1.00 0.00 N ATOM 35 CA LYS A 3 -2.305 8.150 8.945 1.00 0.00 C ATOM 36 C LYS A 3 -1.805 9.385 9.715 1.00 0.00 C ATOM 37 O LYS A 3 -2.207 10.495 9.442 1.00 0.00 O ATOM 38 CB LYS A 3 -3.794 7.893 9.229 1.00 0.00 C ATOM 39 CG LYS A 3 -4.584 7.848 7.909 1.00 0.00 C ATOM 40 CD LYS A 3 -6.090 7.901 8.209 1.00 0.00 C ATOM 41 CE LYS A 3 -6.903 7.782 6.905 1.00 0.00 C ATOM 42 NZ LYS A 3 -8.288 8.187 7.279 1.00 0.00 N ATOM 0 H LYS A 3 -2.187 6.212 9.839 1.00 0.00 H new ATOM 0 HA LYS A 3 -2.129 8.347 7.887 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.913 6.951 9.765 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.190 8.678 9.872 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.299 8.687 7.274 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.344 6.937 7.360 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.360 7.093 8.888 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.334 8.836 8.713 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.499 8.429 6.127 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.880 6.764 6.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.629 8.911 6.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -8.915 7.358 7.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.288 8.574 8.244 1.00 0.00 H new ATOM 56 N THR A 4 -0.923 9.197 10.667 1.00 0.00 N ATOM 57 CA THR A 4 -0.377 10.353 11.443 1.00 0.00 C ATOM 58 C THR A 4 1.149 10.340 11.342 1.00 0.00 C ATOM 59 O THR A 4 1.791 11.367 11.187 1.00 0.00 O ATOM 60 CB THR A 4 -0.832 10.122 12.885 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.251 10.059 12.928 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.345 11.273 13.767 1.00 0.00 C ATOM 0 H THR A 4 -0.556 8.286 10.941 1.00 0.00 H new ATOM 0 HA THR A 4 -0.724 11.318 11.073 1.00 0.00 H new ATOM 0 HB THR A 4 -0.414 9.184 13.252 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.544 9.909 13.851 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.670 11.107 14.794 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.743 11.321 13.734 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.761 12.212 13.402 1.00 0.00 H new ATOM 70 N GLU A 5 1.737 9.177 11.398 1.00 0.00 N ATOM 71 CA GLU A 5 3.215 9.098 11.268 1.00 0.00 C ATOM 72 C GLU A 5 3.598 9.603 9.879 1.00 0.00 C ATOM 73 O GLU A 5 4.370 10.533 9.733 1.00 0.00 O ATOM 74 CB GLU A 5 3.569 7.622 11.439 1.00 0.00 C ATOM 75 CG GLU A 5 4.524 7.458 12.622 1.00 0.00 C ATOM 76 CD GLU A 5 5.889 8.047 12.263 1.00 0.00 C ATOM 77 OE1 GLU A 5 5.917 9.145 11.733 1.00 0.00 O ATOM 78 OE2 GLU A 5 6.883 7.390 12.523 1.00 0.00 O ATOM 0 H GLU A 5 1.260 8.285 11.527 1.00 0.00 H new ATOM 0 HA GLU A 5 3.746 9.702 12.004 1.00 0.00 H new ATOM 0 HB2 GLU A 5 2.664 7.037 11.605 1.00 0.00 H new ATOM 0 HB3 GLU A 5 4.032 7.241 10.529 1.00 0.00 H new ATOM 0 HG2 GLU A 5 4.120 7.960 13.501 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.627 6.403 12.876 1.00 0.00 H new ATOM 85 N LEU A 6 3.034 9.017 8.853 1.00 0.00 N ATOM 86 CA LEU A 6 3.340 9.496 7.474 1.00 0.00 C ATOM 87 C LEU A 6 2.958 10.972 7.358 1.00 0.00 C ATOM 88 O LEU A 6 3.566 11.730 6.621 1.00 0.00 O ATOM 89 CB LEU A 6 2.478 8.640 6.543 1.00 0.00 C ATOM 90 CG LEU A 6 3.176 7.302 6.277 1.00 0.00 C ATOM 91 CD1 LEU A 6 2.171 6.159 6.437 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.732 7.292 4.851 1.00 0.00 C ATOM 0 H LEU A 6 2.381 8.235 8.911 1.00 0.00 H new ATOM 0 HA LEU A 6 4.397 9.408 7.224 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.500 8.468 6.993 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.308 9.166 5.603 1.00 0.00 H new ATOM 0 HG LEU A 6 3.991 7.172 6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.669 5.208 6.248 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.772 6.164 7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.355 6.290 5.726 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.229 6.341 4.661 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.915 7.423 4.141 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.448 8.105 4.734 1.00 0.00 H new ATOM 104 N ILE A 7 1.971 11.398 8.108 1.00 0.00 N ATOM 105 CA ILE A 7 1.580 12.832 8.060 1.00 0.00 C ATOM 106 C ILE A 7 2.827 13.656 8.339 1.00 0.00 C ATOM 107 O ILE A 7 3.233 14.477 7.546 1.00 0.00 O ATOM 108 CB ILE A 7 0.525 13.009 9.162 1.00 0.00 C ATOM 109 CG1 ILE A 7 -0.858 12.742 8.569 1.00 0.00 C ATOM 110 CG2 ILE A 7 0.581 14.434 9.725 1.00 0.00 C ATOM 111 CD1 ILE A 7 -1.948 13.178 9.555 1.00 0.00 C ATOM 0 H ILE A 7 1.426 10.817 8.745 1.00 0.00 H new ATOM 0 HA ILE A 7 1.172 13.148 7.100 1.00 0.00 H new ATOM 0 HB ILE A 7 0.724 12.307 9.972 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -0.970 13.283 7.629 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.966 11.682 8.341 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.172 14.547 10.505 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.570 14.621 10.145 1.00 0.00 H new ATOM 0 HG23 ILE A 7 0.385 15.149 8.926 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -2.929 12.983 9.122 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.843 12.618 10.484 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.847 14.244 9.761 1.00 0.00 H new ATOM 123 N LYS A 8 3.455 13.404 9.451 1.00 0.00 N ATOM 124 CA LYS A 8 4.706 14.144 9.772 1.00 0.00 C ATOM 125 C LYS A 8 5.718 13.894 8.661 1.00 0.00 C ATOM 126 O LYS A 8 6.507 14.756 8.325 1.00 0.00 O ATOM 127 CB LYS A 8 5.225 13.565 11.087 1.00 0.00 C ATOM 128 CG LYS A 8 4.139 13.621 12.166 1.00 0.00 C ATOM 129 CD LYS A 8 4.623 12.875 13.415 1.00 0.00 C ATOM 130 CE LYS A 8 5.086 11.465 13.029 1.00 0.00 C ATOM 131 NZ LYS A 8 4.551 10.575 14.098 1.00 0.00 N ATOM 0 H LYS A 8 3.159 12.722 10.149 1.00 0.00 H new ATOM 0 HA LYS A 8 4.537 15.217 9.859 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.543 12.533 10.936 1.00 0.00 H new ATOM 0 HB3 LYS A 8 6.101 14.124 11.416 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.910 14.658 12.414 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.218 13.171 11.794 1.00 0.00 H new ATOM 0 HD2 LYS A 8 5.442 13.422 13.882 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.819 12.816 14.149 1.00 0.00 H new ATOM 0 HE2 LYS A 8 4.703 11.179 12.049 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.173 11.408 12.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 5.157 9.735 14.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.537 11.088 15.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 3.584 10.280 13.853 1.00 0.00 H new ATOM 145 N ALA A 9 5.694 12.719 8.075 1.00 0.00 N ATOM 146 CA ALA A 9 6.647 12.430 6.971 1.00 0.00 C ATOM 147 C ALA A 9 6.550 13.531 5.925 1.00 0.00 C ATOM 148 O ALA A 9 7.539 13.961 5.371 1.00 0.00 O ATOM 149 CB ALA A 9 6.190 11.104 6.383 1.00 0.00 C ATOM 0 H ALA A 9 5.059 11.958 8.315 1.00 0.00 H new ATOM 0 HA ALA A 9 7.681 12.383 7.312 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.848 10.825 5.560 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.225 10.333 7.153 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.169 11.202 6.014 1.00 0.00 H new ATOM 155 N ILE A 10 5.361 14.013 5.674 1.00 0.00 N ATOM 156 CA ILE A 10 5.196 15.100 4.699 1.00 0.00 C ATOM 157 C ILE A 10 5.165 16.403 5.475 1.00 0.00 C ATOM 158 O ILE A 10 5.683 17.412 5.054 1.00 0.00 O ATOM 159 CB ILE A 10 3.849 14.790 4.024 1.00 0.00 C ATOM 160 CG1 ILE A 10 4.086 14.356 2.577 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.936 16.023 4.046 1.00 0.00 C ATOM 162 CD1 ILE A 10 5.023 13.144 2.538 1.00 0.00 C ATOM 0 H ILE A 10 4.499 13.690 6.112 1.00 0.00 H new ATOM 0 HA ILE A 10 5.988 15.183 3.955 1.00 0.00 H new ATOM 0 HB ILE A 10 3.363 13.985 4.575 1.00 0.00 H new ATOM 0 HG12 ILE A 10 3.136 14.107 2.104 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.519 15.179 2.009 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.988 15.783 3.564 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.752 16.321 5.078 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.418 16.842 3.512 1.00 0.00 H new ATOM 0 HD11 ILE A 10 5.185 12.843 1.503 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.978 13.407 2.993 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.573 12.319 3.090 1.00 0.00 H new ATOM 174 N ALA A 11 4.600 16.382 6.638 1.00 0.00 N ATOM 175 CA ALA A 11 4.581 17.624 7.438 1.00 0.00 C ATOM 176 C ALA A 11 6.028 18.041 7.733 1.00 0.00 C ATOM 177 O ALA A 11 6.294 19.154 8.142 1.00 0.00 O ATOM 178 CB ALA A 11 3.814 17.261 8.707 1.00 0.00 C ATOM 0 H ALA A 11 4.155 15.570 7.066 1.00 0.00 H new ATOM 0 HA ALA A 11 4.107 18.467 6.934 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.755 18.133 9.358 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.808 16.936 8.443 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.331 16.455 9.227 1.00 0.00 H new ATOM 184 N GLN A 12 6.969 17.154 7.495 1.00 0.00 N ATOM 185 CA GLN A 12 8.397 17.494 7.722 1.00 0.00 C ATOM 186 C GLN A 12 9.140 17.487 6.383 1.00 0.00 C ATOM 187 O GLN A 12 9.897 18.390 6.087 1.00 0.00 O ATOM 188 CB GLN A 12 8.943 16.409 8.655 1.00 0.00 C ATOM 189 CG GLN A 12 8.095 16.339 9.930 1.00 0.00 C ATOM 190 CD GLN A 12 8.824 17.052 11.072 1.00 0.00 C ATOM 191 OE1 GLN A 12 8.994 16.496 12.138 1.00 0.00 O ATOM 192 NE2 GLN A 12 9.263 18.267 10.891 1.00 0.00 N ATOM 0 H GLN A 12 6.800 16.208 7.152 1.00 0.00 H new ATOM 0 HA GLN A 12 8.523 18.484 8.161 1.00 0.00 H new ATOM 0 HB2 GLN A 12 8.934 15.444 8.149 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.981 16.625 8.910 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.124 16.804 9.759 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.908 15.299 10.198 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.120 18.733 9.995 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.750 18.751 11.645 1.00 0.00 H new ATOM 201 N ASP A 13 8.898 16.504 5.547 1.00 0.00 N ATOM 202 CA ASP A 13 9.568 16.505 4.211 1.00 0.00 C ATOM 203 C ASP A 13 9.052 17.726 3.473 1.00 0.00 C ATOM 204 O ASP A 13 9.777 18.448 2.817 1.00 0.00 O ATOM 205 CB ASP A 13 9.115 15.226 3.507 1.00 0.00 C ATOM 206 CG ASP A 13 9.903 14.036 4.057 1.00 0.00 C ATOM 207 OD1 ASP A 13 10.019 13.936 5.268 1.00 0.00 O ATOM 208 OD2 ASP A 13 10.377 13.245 3.258 1.00 0.00 O ATOM 0 H ASP A 13 8.277 15.716 5.729 1.00 0.00 H new ATOM 0 HA ASP A 13 10.656 16.538 4.264 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.047 15.072 3.662 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.272 15.314 2.432 1.00 0.00 H new ATOM 213 N THR A 14 7.788 17.970 3.643 1.00 0.00 N ATOM 214 CA THR A 14 7.147 19.152 3.040 1.00 0.00 C ATOM 215 C THR A 14 7.285 20.291 4.065 1.00 0.00 C ATOM 216 O THR A 14 8.155 21.133 3.954 1.00 0.00 O ATOM 217 CB THR A 14 5.686 18.710 2.824 1.00 0.00 C ATOM 218 OG1 THR A 14 5.558 17.332 3.138 1.00 0.00 O ATOM 219 CG2 THR A 14 5.294 18.879 1.369 1.00 0.00 C ATOM 0 H THR A 14 7.161 17.381 4.190 1.00 0.00 H new ATOM 0 HA THR A 14 7.572 19.502 2.100 1.00 0.00 H new ATOM 0 HB THR A 14 5.047 19.321 3.462 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.018 16.797 2.458 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.260 18.563 1.232 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.394 19.926 1.085 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.946 18.269 0.743 1.00 0.00 H new ATOM 227 N GLY A 15 6.466 20.291 5.083 1.00 0.00 N ATOM 228 CA GLY A 15 6.579 21.339 6.150 1.00 0.00 C ATOM 229 C GLY A 15 6.105 22.690 5.628 1.00 0.00 C ATOM 230 O GLY A 15 6.237 23.706 6.282 1.00 0.00 O ATOM 0 H GLY A 15 5.720 19.610 5.226 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.985 21.049 7.016 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.614 21.415 6.484 1.00 0.00 H new ATOM 234 N LEU A 16 5.552 22.702 4.459 1.00 0.00 N ATOM 235 CA LEU A 16 5.054 23.976 3.868 1.00 0.00 C ATOM 236 C LEU A 16 4.083 24.662 4.813 1.00 0.00 C ATOM 237 O LEU A 16 4.349 25.717 5.354 1.00 0.00 O ATOM 238 CB LEU A 16 4.318 23.546 2.605 1.00 0.00 C ATOM 239 CG LEU A 16 5.337 23.087 1.577 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.559 21.588 1.698 1.00 0.00 C ATOM 241 CD2 LEU A 16 4.831 23.422 0.165 1.00 0.00 C ATOM 0 H LEU A 16 5.419 21.877 3.875 1.00 0.00 H new ATOM 0 HA LEU A 16 5.863 24.680 3.673 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.620 22.740 2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.730 24.375 2.210 1.00 0.00 H new ATOM 0 HG LEU A 16 6.281 23.602 1.756 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.291 21.268 0.957 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.927 21.354 2.697 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.618 21.066 1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.563 23.092 -0.572 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.883 22.913 -0.012 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.687 24.499 0.076 1.00 0.00 H new ATOM 253 N THR A 17 2.949 24.065 4.997 1.00 0.00 N ATOM 254 CA THR A 17 1.924 24.654 5.884 1.00 0.00 C ATOM 255 C THR A 17 1.207 23.547 6.647 1.00 0.00 C ATOM 256 O THR A 17 0.193 23.777 7.276 1.00 0.00 O ATOM 257 CB THR A 17 0.962 25.358 4.915 1.00 0.00 C ATOM 258 OG1 THR A 17 0.573 26.611 5.459 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.282 24.496 4.668 1.00 0.00 C ATOM 0 H THR A 17 2.685 23.180 4.564 1.00 0.00 H new ATOM 0 HA THR A 17 2.336 25.335 6.629 1.00 0.00 H new ATOM 0 HB THR A 17 1.473 25.512 3.965 1.00 0.00 H new ATOM 0 HG1 THR A 17 -0.039 27.060 4.840 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.951 25.012 3.979 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.017 23.541 4.236 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.797 24.322 5.613 1.00 0.00 H new ATOM 267 N GLN A 18 1.679 22.331 6.546 1.00 0.00 N ATOM 268 CA GLN A 18 0.955 21.214 7.203 1.00 0.00 C ATOM 269 C GLN A 18 -0.448 21.198 6.592 1.00 0.00 C ATOM 270 O GLN A 18 -1.401 20.745 7.192 1.00 0.00 O ATOM 271 CB GLN A 18 0.910 21.542 8.703 1.00 0.00 C ATOM 272 CG GLN A 18 2.272 22.076 9.157 1.00 0.00 C ATOM 273 CD GLN A 18 2.492 21.735 10.632 1.00 0.00 C ATOM 274 OE1 GLN A 18 1.887 20.818 11.153 1.00 0.00 O ATOM 275 NE2 GLN A 18 3.340 22.438 11.332 1.00 0.00 N ATOM 0 H GLN A 18 2.526 22.070 6.041 1.00 0.00 H new ATOM 0 HA GLN A 18 1.423 20.239 7.066 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.135 22.282 8.900 1.00 0.00 H new ATOM 0 HB3 GLN A 18 0.651 20.650 9.272 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.065 21.640 8.550 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.317 23.155 9.012 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.848 23.207 10.895 1.00 0.00 H new ATOM 0 HE22 GLN A 18 3.495 22.218 12.316 1.00 0.00 H new ATOM 284 N VAL A 19 -0.544 21.730 5.383 1.00 0.00 N ATOM 285 CA VAL A 19 -1.840 21.823 4.633 1.00 0.00 C ATOM 286 C VAL A 19 -2.973 21.172 5.420 1.00 0.00 C ATOM 287 O VAL A 19 -3.606 21.790 6.252 1.00 0.00 O ATOM 288 CB VAL A 19 -1.557 21.122 3.275 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.774 19.817 3.479 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.858 20.805 2.516 1.00 0.00 C ATOM 0 H VAL A 19 0.253 22.114 4.876 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.171 22.850 4.478 1.00 0.00 H new ATOM 0 HB VAL A 19 -0.962 21.818 2.684 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.590 19.348 2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.178 20.036 3.963 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.353 19.140 4.107 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.618 20.316 1.572 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.480 20.144 3.120 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.398 21.731 2.318 1.00 0.00 H new ATOM 300 N SER A 20 -3.193 19.935 5.189 1.00 0.00 N ATOM 301 CA SER A 20 -4.218 19.189 5.900 1.00 0.00 C ATOM 302 C SER A 20 -3.558 17.921 6.378 1.00 0.00 C ATOM 303 O SER A 20 -4.210 16.923 6.542 1.00 0.00 O ATOM 304 CB SER A 20 -5.302 18.899 4.869 1.00 0.00 C ATOM 305 OG SER A 20 -6.460 19.653 5.188 1.00 0.00 O ATOM 0 H SER A 20 -2.677 19.386 4.502 1.00 0.00 H new ATOM 0 HA SER A 20 -4.652 19.710 6.753 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.949 19.156 3.870 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.537 17.835 4.860 1.00 0.00 H new ATOM 0 HG SER A 20 -6.442 19.895 6.138 1.00 0.00 H new ATOM 311 N VAL A 21 -2.249 17.934 6.548 1.00 0.00 N ATOM 312 CA VAL A 21 -1.514 16.711 6.981 1.00 0.00 C ATOM 313 C VAL A 21 -2.479 15.754 7.649 1.00 0.00 C ATOM 314 O VAL A 21 -2.487 14.563 7.403 1.00 0.00 O ATOM 315 CB VAL A 21 -0.451 17.200 7.973 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.763 17.716 7.199 1.00 0.00 C ATOM 317 CG2 VAL A 21 -1.004 18.327 8.860 1.00 0.00 C ATOM 0 H VAL A 21 -1.660 18.754 6.401 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.056 16.180 6.146 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.163 16.365 8.612 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.521 18.064 7.901 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.175 16.911 6.590 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.460 18.540 6.554 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.231 18.656 9.554 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.310 19.165 8.234 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.863 17.960 9.421 1.00 0.00 H new ATOM 327 N SER A 22 -3.343 16.305 8.432 1.00 0.00 N ATOM 328 CA SER A 22 -4.376 15.474 9.110 1.00 0.00 C ATOM 329 C SER A 22 -5.516 15.183 8.140 1.00 0.00 C ATOM 330 O SER A 22 -6.107 14.122 8.159 1.00 0.00 O ATOM 331 CB SER A 22 -4.864 16.316 10.289 1.00 0.00 C ATOM 332 OG SER A 22 -4.957 15.496 11.446 1.00 0.00 O ATOM 0 H SER A 22 -3.386 17.303 8.639 1.00 0.00 H new ATOM 0 HA SER A 22 -3.985 14.513 9.445 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.177 17.143 10.469 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.836 16.754 10.060 1.00 0.00 H new ATOM 0 HG SER A 22 -5.268 16.034 12.204 1.00 0.00 H new ATOM 338 N LYS A 23 -5.820 16.117 7.286 1.00 0.00 N ATOM 339 CA LYS A 23 -6.907 15.905 6.307 1.00 0.00 C ATOM 340 C LYS A 23 -6.372 15.286 5.010 1.00 0.00 C ATOM 341 O LYS A 23 -7.023 14.443 4.433 1.00 0.00 O ATOM 342 CB LYS A 23 -7.501 17.289 6.059 1.00 0.00 C ATOM 343 CG LYS A 23 -8.928 17.351 6.619 1.00 0.00 C ATOM 344 CD LYS A 23 -9.896 17.820 5.528 1.00 0.00 C ATOM 345 CE LYS A 23 -9.390 19.130 4.923 1.00 0.00 C ATOM 346 NZ LYS A 23 -10.611 19.956 4.710 1.00 0.00 N ATOM 0 H LYS A 23 -5.356 17.023 7.227 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.657 15.208 6.680 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.881 18.051 6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.510 17.505 4.991 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.227 16.369 6.985 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.965 18.033 7.468 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.982 17.059 4.753 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.892 17.962 5.948 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.689 19.628 5.592 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.865 18.954 3.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.343 20.872 4.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.257 19.460 4.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.087 20.114 5.621 1.00 0.00 H new ATOM 360 N MET A 24 -5.202 15.662 4.534 1.00 0.00 N ATOM 361 CA MET A 24 -4.725 15.016 3.273 1.00 0.00 C ATOM 362 C MET A 24 -4.455 13.541 3.549 1.00 0.00 C ATOM 363 O MET A 24 -4.738 12.707 2.717 1.00 0.00 O ATOM 364 CB MET A 24 -3.445 15.714 2.752 1.00 0.00 C ATOM 365 CG MET A 24 -2.874 16.726 3.744 1.00 0.00 C ATOM 366 SD MET A 24 -1.080 16.606 3.704 1.00 0.00 S ATOM 367 CE MET A 24 -1.052 14.921 4.342 1.00 0.00 C ATOM 0 H MET A 24 -4.583 16.359 4.947 1.00 0.00 H new ATOM 0 HA MET A 24 -5.491 15.110 2.503 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.689 14.960 2.534 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.670 16.220 1.813 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.193 17.735 3.483 1.00 0.00 H new ATOM 0 HG3 MET A 24 -3.246 16.524 4.749 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.199 14.799 5.010 1.00 0.00 H new ATOM 0 HE2 MET A 24 -1.973 14.724 4.890 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.967 14.219 3.512 1.00 0.00 H new ATOM 377 N LEU A 25 -3.935 13.186 4.708 1.00 0.00 N ATOM 378 CA LEU A 25 -3.710 11.735 4.960 1.00 0.00 C ATOM 379 C LEU A 25 -5.026 11.081 5.368 1.00 0.00 C ATOM 380 O LEU A 25 -5.331 9.980 4.953 1.00 0.00 O ATOM 381 CB LEU A 25 -2.663 11.649 6.070 1.00 0.00 C ATOM 382 CG LEU A 25 -1.257 11.958 5.516 1.00 0.00 C ATOM 383 CD1 LEU A 25 -0.254 10.951 6.083 1.00 0.00 C ATOM 384 CD2 LEU A 25 -1.220 11.862 3.984 1.00 0.00 C ATOM 0 H LEU A 25 -3.667 13.820 5.461 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.356 11.209 4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.909 12.353 6.865 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.675 10.653 6.512 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.001 12.975 5.812 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.740 11.168 5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.240 11.024 7.170 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.546 9.942 5.791 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.214 12.086 3.630 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.497 10.854 3.676 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.923 12.578 3.558 1.00 0.00 H new ATOM 396 N ALA A 26 -5.836 11.759 6.136 1.00 0.00 N ATOM 397 CA ALA A 26 -7.150 11.167 6.501 1.00 0.00 C ATOM 398 C ALA A 26 -7.978 11.062 5.221 1.00 0.00 C ATOM 399 O ALA A 26 -8.722 10.120 5.005 1.00 0.00 O ATOM 400 CB ALA A 26 -7.789 12.149 7.484 1.00 0.00 C ATOM 0 H ALA A 26 -5.647 12.684 6.521 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.073 10.177 6.950 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.764 11.771 7.794 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.147 12.258 8.358 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.912 13.119 7.001 1.00 0.00 H new ATOM 406 N SER A 27 -7.808 12.017 4.344 1.00 0.00 N ATOM 407 CA SER A 27 -8.540 11.979 3.052 1.00 0.00 C ATOM 408 C SER A 27 -7.772 11.085 2.090 1.00 0.00 C ATOM 409 O SER A 27 -8.347 10.432 1.250 1.00 0.00 O ATOM 410 CB SER A 27 -8.572 13.420 2.544 1.00 0.00 C ATOM 411 OG SER A 27 -9.265 14.234 3.481 1.00 0.00 O ATOM 0 H SER A 27 -7.193 12.820 4.471 1.00 0.00 H new ATOM 0 HA SER A 27 -9.551 11.585 3.150 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.557 13.791 2.404 1.00 0.00 H new ATOM 0 HB3 SER A 27 -9.064 13.464 1.573 1.00 0.00 H new ATOM 0 HG SER A 27 -8.633 14.575 4.148 1.00 0.00 H new ATOM 417 N PHE A 28 -6.469 11.033 2.235 1.00 0.00 N ATOM 418 CA PHE A 28 -5.639 10.157 1.356 1.00 0.00 C ATOM 419 C PHE A 28 -6.215 8.760 1.403 1.00 0.00 C ATOM 420 O PHE A 28 -6.496 8.163 0.391 1.00 0.00 O ATOM 421 CB PHE A 28 -4.239 10.210 1.968 1.00 0.00 C ATOM 422 CG PHE A 28 -3.413 8.997 1.594 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.564 7.792 2.295 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.460 9.096 0.577 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.768 6.695 1.969 1.00 0.00 C ATOM 426 CE2 PHE A 28 -1.660 8.002 0.260 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.811 6.799 0.954 1.00 0.00 C ATOM 0 H PHE A 28 -5.944 11.564 2.930 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.617 10.467 0.311 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.730 11.113 1.632 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.319 10.274 3.053 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.295 7.714 3.086 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.344 10.023 0.036 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -2.890 5.763 2.501 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -0.921 8.083 -0.524 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.190 5.951 0.707 1.00 0.00 H new ATOM 437 N GLU A 29 -6.454 8.254 2.570 1.00 0.00 N ATOM 438 CA GLU A 29 -7.072 6.924 2.637 1.00 0.00 C ATOM 439 C GLU A 29 -8.478 7.058 2.092 1.00 0.00 C ATOM 440 O GLU A 29 -8.986 6.191 1.408 1.00 0.00 O ATOM 441 CB GLU A 29 -7.116 6.545 4.102 1.00 0.00 C ATOM 442 CG GLU A 29 -7.685 5.139 4.191 1.00 0.00 C ATOM 443 CD GLU A 29 -8.981 5.149 5.006 1.00 0.00 C ATOM 444 OE1 GLU A 29 -10.002 5.522 4.454 1.00 0.00 O ATOM 445 OE2 GLU A 29 -8.928 4.785 6.169 1.00 0.00 O ATOM 0 H GLU A 29 -6.250 8.699 3.465 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.528 6.170 2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.118 6.583 4.538 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.736 7.246 4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.878 4.752 3.190 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.958 4.473 4.656 1.00 0.00 H new ATOM 452 N LYS A 30 -9.100 8.172 2.366 1.00 0.00 N ATOM 453 CA LYS A 30 -10.460 8.391 1.840 1.00 0.00 C ATOM 454 C LYS A 30 -10.389 8.443 0.321 1.00 0.00 C ATOM 455 O LYS A 30 -11.348 8.211 -0.344 1.00 0.00 O ATOM 456 CB LYS A 30 -10.927 9.728 2.404 1.00 0.00 C ATOM 457 CG LYS A 30 -12.445 9.819 2.258 1.00 0.00 C ATOM 458 CD LYS A 30 -13.003 10.801 3.290 1.00 0.00 C ATOM 459 CE LYS A 30 -13.007 10.141 4.671 1.00 0.00 C ATOM 460 NZ LYS A 30 -14.279 9.367 4.724 1.00 0.00 N ATOM 0 H LYS A 30 -8.720 8.932 2.930 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.150 7.596 2.123 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.643 9.816 3.453 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.447 10.550 1.874 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.704 10.147 1.252 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.893 8.835 2.398 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.398 11.707 3.310 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -14.015 11.099 3.015 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.143 9.489 4.800 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.965 10.887 5.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.154 8.535 5.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -15.035 9.968 5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.537 9.057 3.765 1.00 0.00 H new ATOM 474 N ILE A 31 -9.251 8.709 -0.242 1.00 0.00 N ATOM 475 CA ILE A 31 -9.170 8.721 -1.727 1.00 0.00 C ATOM 476 C ILE A 31 -8.463 7.462 -2.192 1.00 0.00 C ATOM 477 O ILE A 31 -8.723 6.944 -3.255 1.00 0.00 O ATOM 478 CB ILE A 31 -8.422 9.984 -2.141 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.236 10.278 -1.233 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.397 11.156 -2.117 1.00 0.00 C ATOM 481 CD1 ILE A 31 -5.963 9.788 -1.925 1.00 0.00 C ATOM 0 H ILE A 31 -8.382 8.916 0.251 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.158 8.732 -2.188 1.00 0.00 H new ATOM 0 HB ILE A 31 -8.024 9.832 -3.144 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.170 11.347 -1.030 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.361 9.779 -0.272 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -8.877 12.068 -2.411 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.214 10.964 -2.812 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.798 11.275 -1.110 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.102 9.991 -1.288 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.037 8.716 -2.105 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.842 10.308 -2.875 1.00 0.00 H new ATOM 493 N ILE A 32 -7.612 6.938 -1.373 1.00 0.00 N ATOM 494 CA ILE A 32 -6.929 5.671 -1.729 1.00 0.00 C ATOM 495 C ILE A 32 -7.937 4.556 -1.596 1.00 0.00 C ATOM 496 O ILE A 32 -8.238 3.845 -2.538 1.00 0.00 O ATOM 497 CB ILE A 32 -5.821 5.473 -0.701 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.842 6.655 -0.758 1.00 0.00 C ATOM 499 CG2 ILE A 32 -5.091 4.162 -1.012 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.534 6.233 -1.428 1.00 0.00 C ATOM 0 H ILE A 32 -7.356 7.331 -0.467 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.524 5.685 -2.741 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.245 5.425 0.302 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.291 7.481 -1.310 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.641 7.018 0.250 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.295 4.007 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.796 3.332 -0.961 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.662 4.213 -2.013 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.851 7.082 -1.460 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.079 5.423 -0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.738 5.893 -2.443 1.00 0.00 H new ATOM 512 N THR A 33 -8.472 4.415 -0.422 1.00 0.00 N ATOM 513 CA THR A 33 -9.474 3.367 -0.202 1.00 0.00 C ATOM 514 C THR A 33 -10.750 3.746 -0.962 1.00 0.00 C ATOM 515 O THR A 33 -11.454 2.891 -1.466 1.00 0.00 O ATOM 516 CB THR A 33 -9.661 3.306 1.323 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.236 2.038 1.794 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.120 3.514 1.701 1.00 0.00 C ATOM 0 H THR A 33 -8.252 4.987 0.393 1.00 0.00 H new ATOM 0 HA THR A 33 -9.185 2.383 -0.571 1.00 0.00 H new ATOM 0 HB THR A 33 -9.067 4.099 1.777 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.408 2.141 2.308 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.225 3.466 2.785 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.452 4.490 1.347 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.729 2.735 1.243 1.00 0.00 H new ATOM 526 N GLU A 34 -11.051 5.022 -1.068 1.00 0.00 N ATOM 527 CA GLU A 34 -12.269 5.420 -1.815 1.00 0.00 C ATOM 528 C GLU A 34 -12.040 5.336 -3.329 1.00 0.00 C ATOM 529 O GLU A 34 -12.914 4.903 -4.040 1.00 0.00 O ATOM 530 CB GLU A 34 -12.546 6.844 -1.378 1.00 0.00 C ATOM 531 CG GLU A 34 -13.074 6.825 0.070 1.00 0.00 C ATOM 532 CD GLU A 34 -14.430 6.116 0.112 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.418 6.751 -0.218 1.00 0.00 O ATOM 534 OE2 GLU A 34 -14.457 4.951 0.474 1.00 0.00 O ATOM 0 H GLU A 34 -10.508 5.789 -0.672 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.111 4.760 -1.606 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.637 7.442 -1.440 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.278 7.307 -2.041 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -12.364 6.313 0.720 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.173 7.844 0.445 1.00 0.00 H new ATOM 541 N THR A 35 -10.884 5.716 -3.854 1.00 0.00 N ATOM 542 CA THR A 35 -10.719 5.593 -5.342 1.00 0.00 C ATOM 543 C THR A 35 -10.938 4.148 -5.731 1.00 0.00 C ATOM 544 O THR A 35 -11.757 3.848 -6.576 1.00 0.00 O ATOM 545 CB THR A 35 -9.302 6.025 -5.714 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.166 7.426 -5.518 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.064 5.689 -7.195 1.00 0.00 C ATOM 0 H THR A 35 -10.086 6.088 -3.340 1.00 0.00 H new ATOM 0 HA THR A 35 -11.438 6.224 -5.865 1.00 0.00 H new ATOM 0 HB THR A 35 -8.575 5.505 -5.090 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.293 7.637 -4.570 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.056 5.991 -7.479 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.178 4.616 -7.347 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.789 6.222 -7.810 1.00 0.00 H new ATOM 555 N VAL A 36 -10.244 3.244 -5.104 1.00 0.00 N ATOM 556 CA VAL A 36 -10.475 1.815 -5.435 1.00 0.00 C ATOM 557 C VAL A 36 -11.966 1.541 -5.269 1.00 0.00 C ATOM 558 O VAL A 36 -12.573 0.807 -6.025 1.00 0.00 O ATOM 559 CB VAL A 36 -9.654 1.034 -4.413 1.00 0.00 C ATOM 560 CG1 VAL A 36 -10.287 -0.340 -4.171 1.00 0.00 C ATOM 561 CG2 VAL A 36 -8.237 0.868 -4.950 1.00 0.00 C ATOM 0 H VAL A 36 -9.539 3.427 -4.390 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.187 1.541 -6.450 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.630 1.575 -3.467 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -9.694 -0.890 -3.440 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -11.301 -0.212 -3.793 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -10.317 -0.897 -5.107 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -7.638 0.311 -4.230 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -8.267 0.324 -5.894 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -7.791 1.850 -5.111 1.00 0.00 H new ATOM 571 N ALA A 37 -12.554 2.162 -4.288 1.00 0.00 N ATOM 572 CA ALA A 37 -14.005 1.991 -4.055 1.00 0.00 C ATOM 573 C ALA A 37 -14.785 3.002 -4.895 1.00 0.00 C ATOM 574 O ALA A 37 -15.999 3.026 -4.891 1.00 0.00 O ATOM 575 CB ALA A 37 -14.190 2.255 -2.578 1.00 0.00 C ATOM 0 H ALA A 37 -12.083 2.786 -3.633 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.367 1.002 -4.336 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.243 2.149 -2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.601 1.540 -2.004 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -13.859 3.267 -2.345 1.00 0.00 H new ATOM 581 N LYS A 38 -14.092 3.816 -5.641 1.00 0.00 N ATOM 582 CA LYS A 38 -14.793 4.792 -6.519 1.00 0.00 C ATOM 583 C LYS A 38 -14.733 4.240 -7.927 1.00 0.00 C ATOM 584 O LYS A 38 -15.625 4.433 -8.729 1.00 0.00 O ATOM 585 CB LYS A 38 -14.026 6.115 -6.416 1.00 0.00 C ATOM 586 CG LYS A 38 -14.460 6.908 -5.172 1.00 0.00 C ATOM 587 CD LYS A 38 -15.986 7.019 -5.110 1.00 0.00 C ATOM 588 CE LYS A 38 -16.519 6.059 -4.041 1.00 0.00 C ATOM 589 NZ LYS A 38 -17.954 5.857 -4.388 1.00 0.00 N ATOM 0 H LYS A 38 -13.073 3.847 -5.680 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.834 4.954 -6.238 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.955 5.916 -6.370 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.201 6.712 -7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.089 6.416 -4.273 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -14.018 7.904 -5.196 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.279 8.042 -4.875 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.420 6.778 -6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.974 5.115 -4.050 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.410 6.480 -3.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.390 5.210 -3.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.449 6.771 -4.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.026 5.449 -5.342 1.00 0.00 H new ATOM 603 N GLY A 39 -13.689 3.516 -8.216 1.00 0.00 N ATOM 604 CA GLY A 39 -13.568 2.901 -9.545 1.00 0.00 C ATOM 605 C GLY A 39 -12.285 3.356 -10.240 1.00 0.00 C ATOM 606 O GLY A 39 -12.282 3.628 -11.425 1.00 0.00 O ATOM 0 H GLY A 39 -12.915 3.329 -7.578 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.570 1.815 -9.449 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.431 3.169 -10.154 1.00 0.00 H new ATOM 610 N ASP A 40 -11.192 3.434 -9.527 1.00 0.00 N ATOM 611 CA ASP A 40 -9.922 3.865 -10.181 1.00 0.00 C ATOM 612 C ASP A 40 -8.720 3.164 -9.540 1.00 0.00 C ATOM 613 O ASP A 40 -8.467 3.296 -8.358 1.00 0.00 O ATOM 614 CB ASP A 40 -9.853 5.377 -9.965 1.00 0.00 C ATOM 615 CG ASP A 40 -10.224 6.099 -11.263 1.00 0.00 C ATOM 616 OD1 ASP A 40 -9.389 6.147 -12.151 1.00 0.00 O ATOM 617 OD2 ASP A 40 -11.337 6.590 -11.346 1.00 0.00 O ATOM 0 H ASP A 40 -11.123 3.221 -8.532 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.899 3.608 -11.240 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.533 5.672 -9.166 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.849 5.664 -9.651 1.00 0.00 H new ATOM 622 N LYS A 41 -7.979 2.423 -10.318 1.00 0.00 N ATOM 623 CA LYS A 41 -6.787 1.711 -9.776 1.00 0.00 C ATOM 624 C LYS A 41 -5.758 2.730 -9.291 1.00 0.00 C ATOM 625 O LYS A 41 -4.866 3.124 -10.017 1.00 0.00 O ATOM 626 CB LYS A 41 -6.234 0.902 -10.951 1.00 0.00 C ATOM 627 CG LYS A 41 -7.273 -0.130 -11.396 1.00 0.00 C ATOM 628 CD LYS A 41 -7.320 -0.186 -12.924 1.00 0.00 C ATOM 629 CE LYS A 41 -6.315 -1.223 -13.430 1.00 0.00 C ATOM 630 NZ LYS A 41 -6.886 -1.719 -14.712 1.00 0.00 N ATOM 0 H LYS A 41 -8.150 2.279 -11.313 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.032 1.070 -8.929 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.988 1.566 -11.779 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.311 0.401 -10.659 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.021 -1.111 -10.994 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.254 0.134 -11.001 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.325 -0.445 -13.258 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.088 0.794 -13.341 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -5.332 -0.778 -13.582 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.191 -2.035 -12.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -6.252 -2.435 -15.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -7.819 -2.143 -14.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.987 -0.926 -15.377 1.00 0.00 H new ATOM 644 N VAL A 42 -5.887 3.163 -8.072 1.00 0.00 N ATOM 645 CA VAL A 42 -4.927 4.170 -7.527 1.00 0.00 C ATOM 646 C VAL A 42 -3.538 3.550 -7.367 1.00 0.00 C ATOM 647 O VAL A 42 -3.403 2.378 -7.079 1.00 0.00 O ATOM 648 CB VAL A 42 -5.499 4.583 -6.168 1.00 0.00 C ATOM 649 CG1 VAL A 42 -5.562 3.367 -5.243 1.00 0.00 C ATOM 650 CG2 VAL A 42 -4.604 5.658 -5.543 1.00 0.00 C ATOM 0 H VAL A 42 -6.616 2.865 -7.424 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.813 5.027 -8.191 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.504 4.981 -6.305 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.970 3.665 -4.277 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.202 2.605 -5.687 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.559 2.963 -5.104 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.011 5.953 -4.576 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.598 5.261 -5.408 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.566 6.527 -6.200 1.00 0.00 H new ATOM 660 N GLN A 43 -2.503 4.328 -7.556 1.00 0.00 N ATOM 661 CA GLN A 43 -1.123 3.774 -7.417 1.00 0.00 C ATOM 662 C GLN A 43 -0.187 4.827 -6.819 1.00 0.00 C ATOM 663 O GLN A 43 -0.567 5.959 -6.605 1.00 0.00 O ATOM 664 CB GLN A 43 -0.668 3.428 -8.842 1.00 0.00 C ATOM 665 CG GLN A 43 -1.807 2.761 -9.618 1.00 0.00 C ATOM 666 CD GLN A 43 -1.234 2.015 -10.825 1.00 0.00 C ATOM 667 OE1 GLN A 43 -0.253 2.436 -11.404 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.811 0.918 -11.232 1.00 0.00 N ATOM 0 H GLN A 43 -2.553 5.317 -7.799 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.106 2.905 -6.760 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.349 4.333 -9.359 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.194 2.762 -8.804 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.345 2.068 -8.971 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.525 3.512 -9.948 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.635 0.564 -10.746 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.438 0.414 -12.037 1.00 0.00 H new ATOM 677 N LEU A 44 1.040 4.462 -6.573 1.00 0.00 N ATOM 678 CA LEU A 44 2.022 5.440 -6.019 1.00 0.00 C ATOM 679 C LEU A 44 3.246 5.472 -6.929 1.00 0.00 C ATOM 680 O LEU A 44 3.952 4.494 -7.040 1.00 0.00 O ATOM 681 CB LEU A 44 2.408 4.906 -4.636 1.00 0.00 C ATOM 682 CG LEU A 44 1.167 4.774 -3.745 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.602 4.489 -2.305 1.00 0.00 C ATOM 684 CD2 LEU A 44 0.368 6.080 -3.774 1.00 0.00 C ATOM 0 H LEU A 44 1.408 3.524 -6.732 1.00 0.00 H new ATOM 0 HA LEU A 44 1.615 6.449 -5.952 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.895 3.936 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.129 5.577 -4.169 1.00 0.00 H new ATOM 0 HG LEU A 44 0.547 3.957 -4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.721 4.395 -1.671 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.172 3.560 -2.274 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.223 5.308 -1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.513 5.982 -3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.991 6.896 -3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.057 6.293 -4.797 1.00 0.00 H new ATOM 696 N THR A 45 3.490 6.583 -7.590 1.00 0.00 N ATOM 697 CA THR A 45 4.669 6.689 -8.522 1.00 0.00 C ATOM 698 C THR A 45 4.907 5.356 -9.247 1.00 0.00 C ATOM 699 O THR A 45 4.395 5.131 -10.327 1.00 0.00 O ATOM 700 CB THR A 45 5.889 7.089 -7.664 1.00 0.00 C ATOM 701 OG1 THR A 45 7.073 6.568 -8.253 1.00 0.00 O ATOM 702 CG2 THR A 45 5.762 6.557 -6.231 1.00 0.00 C ATOM 0 H THR A 45 2.921 7.427 -7.525 1.00 0.00 H new ATOM 0 HA THR A 45 4.490 7.437 -9.295 1.00 0.00 H new ATOM 0 HB THR A 45 5.934 8.177 -7.624 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.848 6.823 -7.710 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.637 6.856 -5.653 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.864 6.967 -5.769 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.695 5.469 -6.251 1.00 0.00 H new ATOM 710 N GLY A 46 5.666 4.469 -8.660 1.00 0.00 N ATOM 711 CA GLY A 46 5.916 3.159 -9.311 1.00 0.00 C ATOM 712 C GLY A 46 6.180 2.095 -8.244 1.00 0.00 C ATOM 713 O GLY A 46 6.860 1.120 -8.498 1.00 0.00 O ATOM 0 H GLY A 46 6.122 4.599 -7.757 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.057 2.874 -9.918 1.00 0.00 H new ATOM 0 HA3 GLY A 46 6.771 3.233 -9.983 1.00 0.00 H new ATOM 717 N PHE A 47 5.652 2.260 -7.049 1.00 0.00 N ATOM 718 CA PHE A 47 5.903 1.223 -6.004 1.00 0.00 C ATOM 719 C PHE A 47 4.613 0.674 -5.398 1.00 0.00 C ATOM 720 O PHE A 47 4.565 -0.471 -4.999 1.00 0.00 O ATOM 721 CB PHE A 47 6.817 1.865 -4.951 1.00 0.00 C ATOM 722 CG PHE A 47 6.112 2.920 -4.127 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.112 2.565 -3.215 1.00 0.00 C ATOM 724 CD2 PHE A 47 6.497 4.257 -4.245 1.00 0.00 C ATOM 725 CE1 PHE A 47 4.496 3.547 -2.433 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.889 5.229 -3.461 1.00 0.00 C ATOM 727 CZ PHE A 47 4.886 4.880 -2.555 1.00 0.00 C ATOM 0 H PHE A 47 5.073 3.049 -6.762 1.00 0.00 H new ATOM 0 HA PHE A 47 6.386 0.352 -6.447 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.201 1.089 -4.288 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.677 2.314 -5.448 1.00 0.00 H new ATOM 0 HD1 PHE A 47 4.816 1.531 -3.115 1.00 0.00 H new ATOM 0 HD2 PHE A 47 7.269 4.536 -4.947 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.719 3.273 -1.735 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.194 6.261 -3.553 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.414 5.640 -1.950 1.00 0.00 H new ATOM 737 N LEU A 48 3.565 1.439 -5.331 1.00 0.00 N ATOM 738 CA LEU A 48 2.309 0.879 -4.754 1.00 0.00 C ATOM 739 C LEU A 48 1.165 0.969 -5.762 1.00 0.00 C ATOM 740 O LEU A 48 0.392 1.904 -5.758 1.00 0.00 O ATOM 741 CB LEU A 48 2.014 1.711 -3.508 1.00 0.00 C ATOM 742 CG LEU A 48 2.514 1.014 -2.219 1.00 0.00 C ATOM 743 CD1 LEU A 48 1.559 1.336 -1.078 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.581 -0.507 -2.386 1.00 0.00 C ATOM 0 H LEU A 48 3.518 2.409 -5.643 1.00 0.00 H new ATOM 0 HA LEU A 48 2.417 -0.177 -4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.490 2.687 -3.602 1.00 0.00 H new ATOM 0 HB3 LEU A 48 0.941 1.886 -3.434 1.00 0.00 H new ATOM 0 HG LEU A 48 3.518 1.381 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.904 0.849 -0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.527 2.415 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.561 0.976 -1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.936 -0.959 -1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.588 -0.891 -2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.266 -0.754 -3.197 1.00 0.00 H new ATOM 756 N ASN A 49 1.057 -0.010 -6.620 1.00 0.00 N ATOM 757 CA ASN A 49 -0.034 -0.013 -7.636 1.00 0.00 C ATOM 758 C ASN A 49 -1.273 -0.713 -7.068 1.00 0.00 C ATOM 759 O ASN A 49 -1.473 -1.896 -7.263 1.00 0.00 O ATOM 760 CB ASN A 49 0.532 -0.801 -8.817 1.00 0.00 C ATOM 761 CG ASN A 49 1.037 0.169 -9.887 1.00 0.00 C ATOM 762 OD1 ASN A 49 0.678 0.058 -11.043 1.00 0.00 O ATOM 763 ND2 ASN A 49 1.860 1.123 -9.548 1.00 0.00 N ATOM 0 H ASN A 49 1.683 -0.814 -6.660 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.338 0.993 -7.926 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.346 -1.444 -8.482 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.236 -1.451 -9.235 1.00 0.00 H new ATOM 0 HD21 ASN A 49 2.202 1.776 -10.253 1.00 0.00 H new ATOM 0 HD22 ASN A 49 2.161 1.216 -8.578 1.00 0.00 H new ATOM 770 N ILE A 50 -2.099 0.009 -6.360 1.00 0.00 N ATOM 771 CA ILE A 50 -3.322 -0.611 -5.768 1.00 0.00 C ATOM 772 C ILE A 50 -4.372 -0.827 -6.863 1.00 0.00 C ATOM 773 O ILE A 50 -4.560 0.018 -7.717 1.00 0.00 O ATOM 774 CB ILE A 50 -3.834 0.413 -4.735 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.861 0.596 -3.541 1.00 0.00 C ATOM 776 CG2 ILE A 50 -5.189 -0.052 -4.193 1.00 0.00 C ATOM 777 CD1 ILE A 50 -1.495 -0.062 -3.786 1.00 0.00 C ATOM 0 H ILE A 50 -1.980 1.003 -6.165 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.117 -1.580 -5.313 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.918 1.372 -5.247 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.719 1.660 -3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.309 0.170 -2.643 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.555 0.669 -3.462 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.902 -0.130 -5.014 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.076 -1.026 -3.717 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.854 0.097 -2.919 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.630 -1.132 -3.946 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.030 0.381 -4.667 1.00 0.00 H new ATOM 789 N LYS A 51 -5.067 -1.941 -6.853 1.00 0.00 N ATOM 790 CA LYS A 51 -6.099 -2.155 -7.915 1.00 0.00 C ATOM 791 C LYS A 51 -7.201 -3.106 -7.421 1.00 0.00 C ATOM 792 O LYS A 51 -6.920 -4.200 -6.978 1.00 0.00 O ATOM 793 CB LYS A 51 -5.344 -2.767 -9.100 1.00 0.00 C ATOM 794 CG LYS A 51 -4.610 -4.036 -8.658 1.00 0.00 C ATOM 795 CD LYS A 51 -4.020 -4.736 -9.883 1.00 0.00 C ATOM 796 CE LYS A 51 -5.002 -5.798 -10.383 1.00 0.00 C ATOM 797 NZ LYS A 51 -4.810 -5.834 -11.860 1.00 0.00 N ATOM 0 H LYS A 51 -4.968 -2.694 -6.172 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.594 -1.224 -8.190 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.042 -3.003 -9.903 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.631 -2.045 -9.499 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.818 -3.784 -7.953 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.297 -4.705 -8.139 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.821 -4.009 -10.670 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.066 -5.198 -9.628 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.795 -6.770 -9.934 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.029 -5.539 -10.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.450 -6.540 -12.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.020 -4.897 -12.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.825 -6.090 -12.076 1.00 0.00 H new ATOM 811 N PRO A 52 -8.430 -2.653 -7.508 1.00 0.00 N ATOM 812 CA PRO A 52 -9.570 -3.481 -7.057 1.00 0.00 C ATOM 813 C PRO A 52 -9.966 -4.502 -8.119 1.00 0.00 C ATOM 814 O PRO A 52 -9.927 -4.238 -9.305 1.00 0.00 O ATOM 815 CB PRO A 52 -10.691 -2.475 -6.859 1.00 0.00 C ATOM 816 CG PRO A 52 -10.359 -1.328 -7.761 1.00 0.00 C ATOM 817 CD PRO A 52 -8.870 -1.348 -8.014 1.00 0.00 C ATOM 0 HA PRO A 52 -9.336 -4.051 -6.158 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.658 -2.909 -7.114 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.751 -2.153 -5.819 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.906 -1.411 -8.700 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.655 -0.385 -7.302 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.646 -1.237 -9.075 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.368 -0.531 -7.495 1.00 0.00 H new ATOM 825 N VAL A 53 -10.368 -5.662 -7.688 1.00 0.00 N ATOM 826 CA VAL A 53 -10.795 -6.714 -8.651 1.00 0.00 C ATOM 827 C VAL A 53 -12.050 -7.420 -8.141 1.00 0.00 C ATOM 828 O VAL A 53 -12.045 -8.072 -7.118 1.00 0.00 O ATOM 829 CB VAL A 53 -9.622 -7.679 -8.757 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.387 -6.920 -9.248 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.329 -8.288 -7.383 1.00 0.00 C ATOM 0 H VAL A 53 -10.420 -5.929 -6.705 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.047 -6.297 -9.626 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.870 -8.475 -9.459 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.544 -7.607 -9.325 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.592 -6.486 -10.226 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.144 -6.126 -8.542 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.489 -8.978 -7.463 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.081 -7.494 -6.679 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.208 -8.826 -7.028 1.00 0.00 H new ATOM 841 N ALA A 54 -13.130 -7.269 -8.845 1.00 0.00 N ATOM 842 CA ALA A 54 -14.417 -7.894 -8.409 1.00 0.00 C ATOM 843 C ALA A 54 -14.247 -9.379 -8.077 1.00 0.00 C ATOM 844 O ALA A 54 -13.585 -10.122 -8.775 1.00 0.00 O ATOM 845 CB ALA A 54 -15.384 -7.714 -9.579 1.00 0.00 C ATOM 0 H ALA A 54 -13.184 -6.736 -9.713 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.785 -7.423 -7.497 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.349 -8.152 -9.324 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.511 -6.651 -9.786 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.983 -8.211 -10.462 1.00 0.00 H new ATOM 1164 N VAL A 75 -15.153 -6.844 -4.044 1.00 0.00 N ATOM 1165 CA VAL A 75 -14.004 -6.638 -4.979 1.00 0.00 C ATOM 1166 C VAL A 75 -12.707 -7.027 -4.272 1.00 0.00 C ATOM 1167 O VAL A 75 -12.686 -7.253 -3.077 1.00 0.00 O ATOM 1168 CB VAL A 75 -14.028 -5.141 -5.359 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.686 -4.468 -5.040 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -14.304 -5.003 -6.859 1.00 0.00 C ATOM 0 HA VAL A 75 -14.074 -7.253 -5.876 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.812 -4.654 -4.778 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.732 -3.415 -5.318 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.481 -4.553 -3.973 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.891 -4.957 -5.602 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -14.322 -3.947 -7.130 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -13.519 -5.509 -7.421 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -15.268 -5.454 -7.095 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.630 -7.109 -4.996 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.341 -7.487 -4.358 1.00 0.00 C ATOM 1182 C GLY A 76 -9.354 -6.338 -4.508 1.00 0.00 C ATOM 1183 O GLY A 76 -8.579 -6.291 -5.442 1.00 0.00 O ATOM 0 H GLY A 76 -11.585 -6.931 -5.999 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.496 -7.714 -3.303 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.942 -8.389 -4.823 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.379 -5.410 -3.591 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.441 -4.252 -3.665 1.00 0.00 C ATOM 1189 C VAL A 77 -7.003 -4.748 -3.612 1.00 0.00 C ATOM 1190 O VAL A 77 -6.344 -4.669 -2.594 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.775 -3.388 -2.440 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -8.706 -4.242 -1.166 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.777 -2.228 -2.330 1.00 0.00 C ATOM 0 H VAL A 77 -10.011 -5.403 -2.790 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.545 -3.686 -4.591 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.782 -2.988 -2.555 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.944 -3.624 -0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.424 -5.059 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.701 -4.650 -1.055 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -8.021 -1.620 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.767 -2.625 -2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.833 -1.613 -3.229 1.00 0.00 H new ATOM 1203 N SER A 78 -6.510 -5.256 -4.706 1.00 0.00 N ATOM 1204 CA SER A 78 -5.110 -5.752 -4.716 1.00 0.00 C ATOM 1205 C SER A 78 -4.154 -4.592 -4.439 1.00 0.00 C ATOM 1206 O SER A 78 -4.564 -3.460 -4.303 1.00 0.00 O ATOM 1207 CB SER A 78 -4.880 -6.313 -6.122 1.00 0.00 C ATOM 1208 OG SER A 78 -6.131 -6.597 -6.737 1.00 0.00 O ATOM 0 H SER A 78 -7.014 -5.348 -5.588 1.00 0.00 H new ATOM 0 HA SER A 78 -4.936 -6.511 -3.953 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.323 -5.595 -6.724 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.277 -7.219 -6.068 1.00 0.00 H new ATOM 0 HG SER A 78 -6.451 -5.801 -7.211 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.890 -4.886 -4.378 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.845 -3.847 -4.120 1.00 0.00 C ATOM 1216 C VAL A 79 -0.473 -4.534 -4.197 1.00 0.00 C ATOM 1217 O VAL A 79 -0.392 -5.745 -4.251 1.00 0.00 O ATOM 1218 CB VAL A 79 -2.117 -3.377 -2.664 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -0.841 -2.823 -2.016 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -3.185 -2.283 -2.636 1.00 0.00 C ATOM 0 H VAL A 79 -2.521 -5.829 -4.499 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.864 -3.017 -4.826 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.463 -4.247 -2.106 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.060 -2.501 -0.998 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -0.077 -3.600 -1.995 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.478 -1.973 -2.595 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.358 -1.970 -1.606 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -2.847 -1.429 -3.223 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.112 -2.669 -3.059 1.00 0.00 H new ATOM 1230 N LYS A 80 0.599 -3.788 -4.129 1.00 0.00 N ATOM 1231 CA LYS A 80 1.950 -4.415 -4.121 1.00 0.00 C ATOM 1232 C LYS A 80 3.030 -3.332 -4.098 1.00 0.00 C ATOM 1233 O LYS A 80 2.754 -2.179 -4.331 1.00 0.00 O ATOM 1234 CB LYS A 80 2.046 -5.214 -5.428 1.00 0.00 C ATOM 1235 CG LYS A 80 1.736 -4.297 -6.615 1.00 0.00 C ATOM 1236 CD LYS A 80 1.839 -5.094 -7.918 1.00 0.00 C ATOM 1237 CE LYS A 80 1.215 -4.290 -9.060 1.00 0.00 C ATOM 1238 NZ LYS A 80 2.366 -3.634 -9.741 1.00 0.00 N ATOM 0 H LYS A 80 0.595 -2.769 -4.079 1.00 0.00 H new ATOM 0 HA LYS A 80 2.094 -5.048 -3.245 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.044 -5.638 -5.534 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.346 -6.049 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.736 -3.877 -6.512 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.433 -3.459 -6.633 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.883 -5.312 -8.141 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.329 -6.051 -7.812 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.667 -4.937 -9.745 1.00 0.00 H new ATOM 0 HE3 LYS A 80 0.507 -3.552 -8.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 2.018 -3.063 -10.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.864 -3.020 -9.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.020 -4.361 -10.095 1.00 0.00 H new ATOM 1252 N PRO A 81 4.237 -3.764 -3.871 1.00 0.00 N ATOM 1253 CA PRO A 81 5.406 -2.873 -3.861 1.00 0.00 C ATOM 1254 C PRO A 81 6.129 -2.912 -5.209 1.00 0.00 C ATOM 1255 O PRO A 81 6.267 -3.954 -5.819 1.00 0.00 O ATOM 1256 CB PRO A 81 6.290 -3.506 -2.796 1.00 0.00 C ATOM 1257 CG PRO A 81 5.897 -4.960 -2.759 1.00 0.00 C ATOM 1258 CD PRO A 81 4.623 -5.121 -3.558 1.00 0.00 C ATOM 0 HA PRO A 81 5.149 -1.830 -3.674 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.345 -3.391 -3.043 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.136 -3.033 -1.826 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.690 -5.580 -3.178 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.746 -5.288 -1.730 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.789 -5.708 -4.461 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.852 -5.633 -2.982 1.00 0.00 H new ATOM 1266 N GLY A 82 6.615 -1.794 -5.663 1.00 0.00 N ATOM 1267 CA GLY A 82 7.362 -1.771 -6.955 1.00 0.00 C ATOM 1268 C GLY A 82 8.858 -1.821 -6.649 1.00 0.00 C ATOM 1269 O GLY A 82 9.264 -2.295 -5.607 1.00 0.00 O ATOM 0 H GLY A 82 6.529 -0.891 -5.196 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.073 -2.620 -7.575 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.120 -0.869 -7.517 1.00 0.00 H new ATOM 1273 N GLU A 83 9.683 -1.328 -7.533 1.00 0.00 N ATOM 1274 CA GLU A 83 11.148 -1.349 -7.257 1.00 0.00 C ATOM 1275 C GLU A 83 11.587 -0.033 -6.619 1.00 0.00 C ATOM 1276 O GLU A 83 12.662 0.066 -6.062 1.00 0.00 O ATOM 1277 CB GLU A 83 11.834 -1.534 -8.608 1.00 0.00 C ATOM 1278 CG GLU A 83 11.409 -0.421 -9.571 1.00 0.00 C ATOM 1279 CD GLU A 83 10.429 -0.982 -10.605 1.00 0.00 C ATOM 1280 OE1 GLU A 83 9.418 -1.529 -10.198 1.00 0.00 O ATOM 1281 OE2 GLU A 83 10.708 -0.854 -11.786 1.00 0.00 O ATOM 0 H GLU A 83 9.410 -0.916 -8.425 1.00 0.00 H new ATOM 0 HA GLU A 83 11.409 -2.150 -6.565 1.00 0.00 H new ATOM 0 HB2 GLU A 83 12.916 -1.521 -8.480 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.574 -2.506 -9.026 1.00 0.00 H new ATOM 0 HG2 GLU A 83 10.942 0.394 -9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.284 -0.006 -10.072 1.00 0.00 H new ATOM 1288 N SER A 84 10.763 0.981 -6.692 1.00 0.00 N ATOM 1289 CA SER A 84 11.141 2.289 -6.081 1.00 0.00 C ATOM 1290 C SER A 84 11.532 2.077 -4.617 1.00 0.00 C ATOM 1291 O SER A 84 12.417 2.730 -4.097 1.00 0.00 O ATOM 1292 CB SER A 84 9.890 3.159 -6.189 1.00 0.00 C ATOM 1293 OG SER A 84 10.256 4.454 -6.648 1.00 0.00 O ATOM 0 H SER A 84 9.850 0.960 -7.146 1.00 0.00 H new ATOM 0 HA SER A 84 11.993 2.754 -6.578 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.176 2.705 -6.876 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.398 3.230 -5.219 1.00 0.00 H new ATOM 0 HG SER A 84 9.455 5.014 -6.720 1.00 0.00 H new ATOM 1299 N LEU A 85 10.892 1.147 -3.957 1.00 0.00 N ATOM 1300 CA LEU A 85 11.244 0.877 -2.530 1.00 0.00 C ATOM 1301 C LEU A 85 12.368 -0.152 -2.486 1.00 0.00 C ATOM 1302 O LEU A 85 13.131 -0.209 -1.543 1.00 0.00 O ATOM 1303 CB LEU A 85 9.997 0.311 -1.815 1.00 0.00 C ATOM 1304 CG LEU A 85 8.723 0.484 -2.649 1.00 0.00 C ATOM 1305 CD1 LEU A 85 8.466 -0.793 -3.456 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.536 0.744 -1.714 1.00 0.00 C ATOM 0 H LEU A 85 10.146 0.566 -4.340 1.00 0.00 H new ATOM 0 HA LEU A 85 11.569 1.793 -2.037 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.150 -0.747 -1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.872 0.812 -0.855 1.00 0.00 H new ATOM 0 HG LEU A 85 8.843 1.327 -3.330 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.560 -0.672 -4.050 1.00 0.00 H new ATOM 0 HD12 LEU A 85 9.311 -0.981 -4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.343 -1.635 -2.775 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.628 0.868 -2.304 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.416 -0.100 -1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 85 7.719 1.650 -1.137 1.00 0.00 H new ATOM 1318 N LYS A 86 12.480 -0.967 -3.503 1.00 0.00 N ATOM 1319 CA LYS A 86 13.564 -1.983 -3.512 1.00 0.00 C ATOM 1320 C LYS A 86 14.880 -1.305 -3.844 1.00 0.00 C ATOM 1321 O LYS A 86 15.917 -1.635 -3.301 1.00 0.00 O ATOM 1322 CB LYS A 86 13.173 -3.002 -4.582 1.00 0.00 C ATOM 1323 CG LYS A 86 12.598 -4.256 -3.916 1.00 0.00 C ATOM 1324 CD LYS A 86 11.225 -4.574 -4.515 1.00 0.00 C ATOM 1325 CE LYS A 86 11.390 -5.011 -5.974 1.00 0.00 C ATOM 1326 NZ LYS A 86 10.755 -6.357 -6.047 1.00 0.00 N ATOM 0 H LYS A 86 11.870 -0.970 -4.321 1.00 0.00 H new ATOM 0 HA LYS A 86 13.689 -2.474 -2.547 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.437 -2.568 -5.259 1.00 0.00 H new ATOM 0 HB3 LYS A 86 14.044 -3.265 -5.183 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.273 -5.099 -4.062 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.509 -4.101 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 86 10.741 -5.364 -3.941 1.00 0.00 H new ATOM 0 HD3 LYS A 86 10.580 -3.697 -4.458 1.00 0.00 H new ATOM 0 HE2 LYS A 86 10.907 -4.309 -6.653 1.00 0.00 H new ATOM 0 HE3 LYS A 86 12.442 -5.055 -6.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 10.828 -6.723 -7.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.240 -7.006 -5.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 9.753 -6.283 -5.780 1.00 0.00 H new ATOM 1340 N LYS A 87 14.844 -0.327 -4.694 1.00 0.00 N ATOM 1341 CA LYS A 87 16.090 0.404 -5.000 1.00 0.00 C ATOM 1342 C LYS A 87 16.396 1.254 -3.774 1.00 0.00 C ATOM 1343 O LYS A 87 17.524 1.335 -3.290 1.00 0.00 O ATOM 1344 CB LYS A 87 15.768 1.256 -6.233 1.00 0.00 C ATOM 1345 CG LYS A 87 16.897 2.261 -6.480 1.00 0.00 C ATOM 1346 CD LYS A 87 16.686 2.947 -7.831 1.00 0.00 C ATOM 1347 CE LYS A 87 17.119 4.413 -7.733 1.00 0.00 C ATOM 1348 NZ LYS A 87 18.600 4.368 -7.578 1.00 0.00 N ATOM 0 H LYS A 87 14.011 -0.005 -5.186 1.00 0.00 H new ATOM 0 HA LYS A 87 16.956 -0.224 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.642 0.615 -7.106 1.00 0.00 H new ATOM 0 HB3 LYS A 87 14.825 1.783 -6.086 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.917 3.004 -5.683 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.861 1.752 -6.466 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.262 2.437 -8.603 1.00 0.00 H new ATOM 0 HD3 LYS A 87 15.637 2.885 -8.122 1.00 0.00 H new ATOM 0 HE2 LYS A 87 16.832 4.970 -8.625 1.00 0.00 H new ATOM 0 HE3 LYS A 87 16.648 4.908 -6.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 19.000 5.304 -7.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 18.839 4.103 -6.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.996 3.665 -8.234 1.00 0.00 H new ATOM 1362 N ALA A 88 15.371 1.819 -3.199 1.00 0.00 N ATOM 1363 CA ALA A 88 15.583 2.586 -1.961 1.00 0.00 C ATOM 1364 C ALA A 88 16.042 1.588 -0.910 1.00 0.00 C ATOM 1365 O ALA A 88 16.893 1.864 -0.081 1.00 0.00 O ATOM 1366 CB ALA A 88 14.216 3.170 -1.602 1.00 0.00 C ATOM 0 H ALA A 88 14.409 1.779 -3.535 1.00 0.00 H new ATOM 0 HA ALA A 88 16.321 3.384 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.300 3.756 -0.687 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.870 3.811 -2.413 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.503 2.360 -1.451 1.00 0.00 H new ATOM 1372 N ALA A 89 15.481 0.402 -0.962 1.00 0.00 N ATOM 1373 CA ALA A 89 15.861 -0.652 0.016 1.00 0.00 C ATOM 1374 C ALA A 89 17.358 -0.880 -0.062 1.00 0.00 C ATOM 1375 O ALA A 89 18.020 -1.035 0.946 1.00 0.00 O ATOM 1376 CB ALA A 89 15.068 -1.892 -0.387 1.00 0.00 C ATOM 0 H ALA A 89 14.775 0.124 -1.644 1.00 0.00 H new ATOM 0 HA ALA A 89 15.636 -0.382 1.048 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.301 -2.710 0.294 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.001 -1.673 -0.340 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.335 -2.180 -1.404 1.00 0.00 H new ATOM 1382 N GLU A 90 17.915 -0.834 -1.245 1.00 0.00 N ATOM 1383 CA GLU A 90 19.390 -0.972 -1.351 1.00 0.00 C ATOM 1384 C GLU A 90 19.975 0.111 -0.441 1.00 0.00 C ATOM 1385 O GLU A 90 20.996 -0.061 0.196 1.00 0.00 O ATOM 1386 CB GLU A 90 19.723 -0.735 -2.835 1.00 0.00 C ATOM 1387 CG GLU A 90 20.324 0.661 -3.045 1.00 0.00 C ATOM 1388 CD GLU A 90 20.555 0.900 -4.537 1.00 0.00 C ATOM 1389 OE1 GLU A 90 19.677 0.560 -5.314 1.00 0.00 O ATOM 1390 OE2 GLU A 90 21.604 1.420 -4.879 1.00 0.00 O ATOM 0 H GLU A 90 17.418 -0.709 -2.127 1.00 0.00 H new ATOM 0 HA GLU A 90 19.790 -1.940 -1.049 1.00 0.00 H new ATOM 0 HB2 GLU A 90 20.426 -1.494 -3.180 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.820 -0.841 -3.436 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.653 1.421 -2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 90 21.265 0.748 -2.502 1.00 0.00 H new ATOM 1397 N GLY A 91 19.278 1.219 -0.360 1.00 0.00 N ATOM 1398 CA GLY A 91 19.716 2.331 0.531 1.00 0.00 C ATOM 1399 C GLY A 91 19.778 1.837 1.990 1.00 0.00 C ATOM 1400 O GLY A 91 20.729 2.114 2.695 1.00 0.00 O ATOM 0 H GLY A 91 18.418 1.399 -0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.695 2.695 0.219 1.00 0.00 H new ATOM 0 HA3 GLY A 91 19.023 3.169 0.450 1.00 0.00 H new ATOM 1404 N LEU A 92 18.784 1.101 2.456 1.00 0.00 N ATOM 1405 CA LEU A 92 18.824 0.595 3.868 1.00 0.00 C ATOM 1406 C LEU A 92 19.913 -0.472 4.023 1.00 0.00 C ATOM 1407 O LEU A 92 19.907 -1.236 4.964 1.00 0.00 O ATOM 1408 CB LEU A 92 17.426 -0.014 4.108 1.00 0.00 C ATOM 1409 CG LEU A 92 17.411 -1.522 3.810 1.00 0.00 C ATOM 1410 CD1 LEU A 92 17.674 -2.312 5.097 1.00 0.00 C ATOM 1411 CD2 LEU A 92 16.042 -1.921 3.260 1.00 0.00 C ATOM 0 H LEU A 92 17.957 0.834 1.922 1.00 0.00 H new ATOM 0 HA LEU A 92 19.056 1.383 4.584 1.00 0.00 H new ATOM 0 HB2 LEU A 92 17.126 0.157 5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 92 16.695 0.490 3.476 1.00 0.00 H new ATOM 0 HG LEU A 92 18.187 -1.744 3.078 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.662 -3.380 4.878 1.00 0.00 H new ATOM 0 HD12 LEU A 92 18.648 -2.036 5.501 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.900 -2.083 5.829 1.00 0.00 H new ATOM 0 HD21 LEU A 92 16.032 -2.990 3.049 1.00 0.00 H new ATOM 0 HD22 LEU A 92 15.272 -1.689 3.996 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.844 -1.368 2.342 1.00 0.00 H new ATOM 1423 N LYS A 93 20.813 -0.565 3.080 1.00 0.00 N ATOM 1424 CA LYS A 93 21.860 -1.623 3.138 1.00 0.00 C ATOM 1425 C LYS A 93 21.166 -2.957 3.005 1.00 0.00 C ATOM 1426 O LYS A 93 21.028 -3.692 3.979 1.00 0.00 O ATOM 1427 CB LYS A 93 22.548 -1.553 4.511 1.00 0.00 C ATOM 1428 CG LYS A 93 23.320 -2.863 4.765 1.00 0.00 C ATOM 1429 CD LYS A 93 24.679 -2.547 5.394 1.00 0.00 C ATOM 1430 CE LYS A 93 24.492 -2.199 6.875 1.00 0.00 C ATOM 1431 NZ LYS A 93 25.320 -3.194 7.612 1.00 0.00 N ATOM 0 H LYS A 93 20.867 0.050 2.268 1.00 0.00 H new ATOM 0 HA LYS A 93 22.598 -1.491 2.347 1.00 0.00 H new ATOM 0 HB2 LYS A 93 23.230 -0.704 4.545 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.806 -1.398 5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 93 22.745 -3.513 5.425 1.00 0.00 H new ATOM 0 HG3 LYS A 93 23.459 -3.402 3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 93 25.346 -3.403 5.293 1.00 0.00 H new ATOM 0 HD3 LYS A 93 25.148 -1.714 4.871 1.00 0.00 H new ATOM 0 HE2 LYS A 93 24.818 -1.181 7.085 1.00 0.00 H new ATOM 0 HE3 LYS A 93 23.444 -2.264 7.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 25.243 -3.020 8.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 24.982 -4.154 7.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 26.314 -3.104 7.319 1.00 0.00 H new ATOM 1445 N TYR A 94 20.709 -3.308 1.836 1.00 0.00 N ATOM 1446 CA TYR A 94 20.047 -4.614 1.758 1.00 0.00 C ATOM 1447 C TYR A 94 20.946 -5.592 2.461 1.00 0.00 C ATOM 1448 O TYR A 94 20.556 -6.198 3.457 1.00 0.00 O ATOM 1449 CB TYR A 94 19.888 -5.020 0.306 1.00 0.00 C ATOM 1450 CG TYR A 94 19.444 -6.468 0.309 1.00 0.00 C ATOM 1451 CD1 TYR A 94 18.180 -6.812 0.814 1.00 0.00 C ATOM 1452 CD2 TYR A 94 20.300 -7.466 -0.163 1.00 0.00 C ATOM 1453 CE1 TYR A 94 17.775 -8.153 0.833 1.00 0.00 C ATOM 1454 CE2 TYR A 94 19.893 -8.805 -0.144 1.00 0.00 C ATOM 1455 CZ TYR A 94 18.630 -9.146 0.349 1.00 0.00 C ATOM 1456 OH TYR A 94 18.231 -10.466 0.368 1.00 0.00 O ATOM 0 H TYR A 94 20.765 -2.767 0.973 1.00 0.00 H new ATOM 0 HA TYR A 94 19.058 -4.585 2.215 1.00 0.00 H new ATOM 0 HB2 TYR A 94 19.153 -4.390 -0.194 1.00 0.00 H new ATOM 0 HB3 TYR A 94 20.828 -4.904 -0.234 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.520 -6.043 1.188 1.00 0.00 H new ATOM 0 HD2 TYR A 94 21.277 -7.204 -0.543 1.00 0.00 H new ATOM 0 HE1 TYR A 94 16.803 -8.419 1.221 1.00 0.00 H new ATOM 0 HE2 TYR A 94 20.555 -9.575 -0.510 1.00 0.00 H new ATOM 0 HH TYR A 94 18.942 -11.028 -0.005 1.00 0.00 H new ATOM 1466 N GLU A 95 22.181 -5.740 2.030 1.00 0.00 N ATOM 1467 CA GLU A 95 23.019 -6.705 2.774 1.00 0.00 C ATOM 1468 C GLU A 95 22.034 -7.347 3.679 1.00 0.00 C ATOM 1469 O GLU A 95 22.281 -7.541 4.853 1.00 0.00 O ATOM 1470 CB GLU A 95 24.059 -5.903 3.553 1.00 0.00 C ATOM 1471 CG GLU A 95 24.834 -4.996 2.594 1.00 0.00 C ATOM 1472 CD GLU A 95 25.642 -5.853 1.618 1.00 0.00 C ATOM 1473 OE1 GLU A 95 26.414 -6.676 2.082 1.00 0.00 O ATOM 1474 OE2 GLU A 95 25.473 -5.673 0.423 1.00 0.00 O ATOM 0 H GLU A 95 22.615 -5.260 1.241 1.00 0.00 H new ATOM 0 HA GLU A 95 23.557 -7.435 2.169 1.00 0.00 H new ATOM 0 HB2 GLU A 95 23.570 -5.303 4.321 1.00 0.00 H new ATOM 0 HB3 GLU A 95 24.745 -6.578 4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 95 24.144 -4.355 2.046 1.00 0.00 H new ATOM 0 HG3 GLU A 95 25.500 -4.340 3.155 1.00 0.00 H new ATOM 1547 N MET B 1 -4.633 6.987 -11.211 1.00 0.00 N ATOM 1548 CA MET B 1 -3.874 8.109 -10.577 1.00 0.00 C ATOM 1549 C MET B 1 -2.558 7.614 -10.002 1.00 0.00 C ATOM 1550 O MET B 1 -2.269 6.433 -10.011 1.00 0.00 O ATOM 1551 CB MET B 1 -4.737 8.622 -9.425 1.00 0.00 C ATOM 1552 CG MET B 1 -5.160 7.465 -8.526 1.00 0.00 C ATOM 1553 SD MET B 1 -6.838 7.754 -7.918 1.00 0.00 S ATOM 1554 CE MET B 1 -6.489 9.271 -6.996 1.00 0.00 C ATOM 0 H1 MET B 1 -5.652 7.130 -11.063 1.00 0.00 H new ATOM 0 H2 MET B 1 -4.431 6.964 -12.231 1.00 0.00 H new ATOM 0 H3 MET B 1 -4.344 6.086 -10.780 1.00 0.00 H new ATOM 0 HA MET B 1 -3.659 8.881 -11.316 1.00 0.00 H new ATOM 0 HB2 MET B 1 -4.181 9.358 -8.845 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.619 9.127 -9.819 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.119 6.527 -9.080 1.00 0.00 H new ATOM 0 HG3 MET B 1 -4.470 7.371 -7.688 1.00 0.00 H new ATOM 0 HE1 MET B 1 -6.596 9.080 -5.928 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.471 9.598 -7.206 1.00 0.00 H new ATOM 0 HE3 MET B 1 -7.190 10.049 -7.297 1.00 0.00 H new ATOM 1566 N ASN B 2 -1.775 8.509 -9.462 1.00 0.00 N ATOM 1567 CA ASN B 2 -0.495 8.088 -8.843 1.00 0.00 C ATOM 1568 C ASN B 2 0.224 9.278 -8.186 1.00 0.00 C ATOM 1569 O ASN B 2 -0.400 10.124 -7.580 1.00 0.00 O ATOM 1570 CB ASN B 2 0.340 7.484 -9.983 1.00 0.00 C ATOM 1571 CG ASN B 2 0.664 8.568 -11.013 1.00 0.00 C ATOM 1572 OD1 ASN B 2 -0.226 9.180 -11.569 1.00 0.00 O ATOM 1573 ND2 ASN B 2 1.912 8.833 -11.293 1.00 0.00 N ATOM 0 H ASN B 2 -1.970 9.510 -9.425 1.00 0.00 H new ATOM 0 HA ASN B 2 -0.656 7.363 -8.045 1.00 0.00 H new ATOM 0 HB2 ASN B 2 1.262 7.058 -9.586 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.209 6.670 -10.457 1.00 0.00 H new ATOM 0 HD21 ASN B 2 2.139 9.554 -11.978 1.00 0.00 H new ATOM 0 HD22 ASN B 2 2.660 8.319 -10.826 1.00 0.00 H new ATOM 1580 N LYS B 3 1.534 9.351 -8.297 1.00 0.00 N ATOM 1581 CA LYS B 3 2.282 10.487 -7.667 1.00 0.00 C ATOM 1582 C LYS B 3 1.769 11.843 -8.193 1.00 0.00 C ATOM 1583 O LYS B 3 2.252 12.883 -7.793 1.00 0.00 O ATOM 1584 CB LYS B 3 3.756 10.276 -8.061 1.00 0.00 C ATOM 1585 CG LYS B 3 4.621 10.101 -6.801 1.00 0.00 C ATOM 1586 CD LYS B 3 6.042 10.628 -7.059 1.00 0.00 C ATOM 1587 CE LYS B 3 7.065 9.857 -6.201 1.00 0.00 C ATOM 1588 NZ LYS B 3 8.150 9.479 -7.149 1.00 0.00 N ATOM 0 H LYS B 3 2.113 8.675 -8.795 1.00 0.00 H new ATOM 0 HA LYS B 3 2.149 10.504 -6.585 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.848 9.397 -8.699 1.00 0.00 H new ATOM 0 HB3 LYS B 3 4.111 11.129 -8.640 1.00 0.00 H new ATOM 0 HG2 LYS B 3 4.172 10.637 -5.965 1.00 0.00 H new ATOM 0 HG3 LYS B 3 4.660 9.048 -6.521 1.00 0.00 H new ATOM 0 HD2 LYS B 3 6.290 10.522 -8.115 1.00 0.00 H new ATOM 0 HD3 LYS B 3 6.090 11.692 -6.826 1.00 0.00 H new ATOM 0 HE2 LYS B 3 7.447 10.476 -5.389 1.00 0.00 H new ATOM 0 HE3 LYS B 3 6.614 8.976 -5.744 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 8.698 8.689 -6.752 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 7.733 9.190 -8.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 8.778 10.294 -7.301 1.00 0.00 H new ATOM 1602 N THR B 4 0.801 11.845 -9.083 1.00 0.00 N ATOM 1603 CA THR B 4 0.267 13.135 -9.622 1.00 0.00 C ATOM 1604 C THR B 4 -1.233 13.264 -9.313 1.00 0.00 C ATOM 1605 O THR B 4 -1.657 14.082 -8.510 1.00 0.00 O ATOM 1606 CB THR B 4 0.501 13.056 -11.136 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.876 13.282 -11.411 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.345 14.113 -11.853 1.00 0.00 C ATOM 0 H THR B 4 0.359 11.006 -9.458 1.00 0.00 H new ATOM 0 HA THR B 4 0.755 14.002 -9.177 1.00 0.00 H new ATOM 0 HB THR B 4 0.212 12.068 -11.493 1.00 0.00 H new ATOM 0 HG1 THR B 4 2.029 13.230 -12.378 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.173 14.050 -12.927 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.400 13.938 -11.644 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.065 15.105 -11.498 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.042 12.462 -9.947 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.510 12.539 -9.694 1.00 0.00 C ATOM 1618 C GLU B 5 -3.764 12.536 -8.190 1.00 0.00 C ATOM 1619 O GLU B 5 -4.651 13.206 -7.698 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.106 11.303 -10.358 1.00 0.00 C ATOM 1621 CG GLU B 5 -4.465 11.623 -11.812 1.00 0.00 C ATOM 1622 CD GLU B 5 -5.977 11.822 -11.935 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -6.708 11.025 -11.370 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -6.380 12.769 -12.592 1.00 0.00 O ATOM 0 H GLU B 5 -1.753 11.759 -10.627 1.00 0.00 H new ATOM 0 HA GLU B 5 -3.959 13.448 -10.095 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.393 10.479 -10.322 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -4.995 10.980 -9.816 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -3.942 12.522 -12.137 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -4.140 10.812 -12.464 1.00 0.00 H new ATOM 1631 N LEU B 6 -2.983 11.802 -7.446 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.186 11.803 -5.973 1.00 0.00 C ATOM 1633 C LEU B 6 -2.784 13.164 -5.389 1.00 0.00 C ATOM 1634 O LEU B 6 -3.332 13.591 -4.392 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.301 10.684 -5.421 1.00 0.00 C ATOM 1636 CG LEU B 6 -2.825 9.327 -5.899 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -1.795 8.242 -5.583 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -4.136 9.000 -5.176 1.00 0.00 C ATOM 0 H LEU B 6 -2.225 11.211 -7.788 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.230 11.638 -5.707 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.272 10.824 -5.752 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.293 10.718 -4.332 1.00 0.00 H new ATOM 0 HG LEU B 6 -2.999 9.367 -6.974 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.168 7.276 -5.923 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -0.859 8.469 -6.093 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.623 8.206 -4.507 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.508 8.034 -5.517 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.959 8.962 -4.101 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.874 9.771 -5.395 1.00 0.00 H new ATOM 1650 N ILE B 7 -1.851 13.873 -5.997 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.483 15.208 -5.435 1.00 0.00 C ATOM 1652 C ILE B 7 -2.702 16.108 -5.529 1.00 0.00 C ATOM 1653 O ILE B 7 -3.080 16.755 -4.576 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.290 15.763 -6.249 1.00 0.00 C ATOM 1655 CG1 ILE B 7 -0.727 16.300 -7.619 1.00 0.00 C ATOM 1656 CG2 ILE B 7 0.768 14.678 -6.439 1.00 0.00 C ATOM 1657 CD1 ILE B 7 -0.993 17.804 -7.518 1.00 0.00 C ATOM 0 H ILE B 7 -1.344 13.589 -6.835 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.181 15.145 -4.389 1.00 0.00 H new ATOM 0 HB ILE B 7 0.129 16.594 -5.682 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.047 16.106 -8.361 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -1.626 15.783 -7.954 1.00 0.00 H new ATOM 0 HG21 ILE B 7 1.603 15.080 -7.013 1.00 0.00 H new ATOM 0 HG22 ILE B 7 1.125 14.344 -5.465 1.00 0.00 H new ATOM 0 HG23 ILE B 7 0.332 13.835 -6.975 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.303 18.185 -8.491 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -1.782 17.986 -6.789 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -0.083 18.314 -7.202 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.353 16.108 -6.656 1.00 0.00 N ATOM 1670 CA LYS B 8 -4.585 16.927 -6.786 1.00 0.00 C ATOM 1671 C LYS B 8 -5.711 16.238 -6.015 1.00 0.00 C ATOM 1672 O LYS B 8 -6.680 16.859 -5.625 1.00 0.00 O ATOM 1673 CB LYS B 8 -4.901 17.028 -8.289 1.00 0.00 C ATOM 1674 CG LYS B 8 -4.941 15.640 -8.936 1.00 0.00 C ATOM 1675 CD LYS B 8 -6.357 15.066 -8.850 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.457 13.824 -9.738 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.863 13.814 -10.230 1.00 0.00 N ATOM 0 H LYS B 8 -3.087 15.580 -7.487 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.465 17.929 -6.374 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -5.860 17.527 -8.430 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -4.147 17.642 -8.782 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -4.629 15.706 -9.978 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -4.238 14.975 -8.434 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -6.595 14.809 -7.818 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -7.084 15.813 -9.168 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.750 13.873 -10.566 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.229 12.918 -9.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -8.085 12.879 -10.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.509 14.016 -9.440 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -7.979 14.540 -10.965 1.00 0.00 H new ATOM 1691 N ALA B 9 -5.572 14.958 -5.760 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.612 14.241 -4.979 1.00 0.00 C ATOM 1693 C ALA B 9 -6.569 14.741 -3.541 1.00 0.00 C ATOM 1694 O ALA B 9 -7.581 14.856 -2.876 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.210 12.774 -5.037 1.00 0.00 C ATOM 0 H ALA B 9 -4.783 14.386 -6.061 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.620 14.396 -5.365 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -6.932 12.177 -4.481 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.189 12.443 -6.075 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.221 12.650 -4.596 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.396 15.077 -3.068 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.270 15.604 -1.704 1.00 0.00 C ATOM 1703 C ILE B 10 -5.306 17.114 -1.817 1.00 0.00 C ATOM 1704 O ILE B 10 -5.857 17.786 -0.986 1.00 0.00 O ATOM 1705 CB ILE B 10 -3.909 15.086 -1.204 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.105 14.298 0.091 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -2.940 16.245 -0.944 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.817 12.978 -0.215 1.00 0.00 C ATOM 0 H ILE B 10 -4.520 15.003 -3.585 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.056 15.298 -1.014 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.485 14.443 -1.975 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.140 14.103 0.559 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.691 14.883 0.800 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -1.987 15.850 -0.592 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -2.783 16.802 -1.868 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.360 16.908 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.956 12.417 0.709 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.789 13.184 -0.664 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.214 12.392 -0.908 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.755 17.641 -2.881 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.785 19.116 -3.081 1.00 0.00 C ATOM 1722 C ALA B 11 -6.235 19.583 -3.062 1.00 0.00 C ATOM 1723 O ALA B 11 -6.535 20.711 -2.722 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.156 19.338 -4.447 1.00 0.00 C ATOM 0 H ALA B 11 -4.287 17.112 -3.617 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.252 19.670 -2.308 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.140 20.405 -4.671 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.137 18.952 -4.445 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.740 18.817 -5.205 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.138 18.704 -3.397 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.575 19.071 -3.370 1.00 0.00 C ATOM 1732 C GLN B 12 -9.135 18.694 -2.007 1.00 0.00 C ATOM 1733 O GLN B 12 -9.809 19.477 -1.366 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.227 18.256 -4.489 1.00 0.00 C ATOM 1735 CG GLN B 12 -8.914 18.901 -5.840 1.00 0.00 C ATOM 1736 CD GLN B 12 -9.988 19.939 -6.172 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -10.353 20.741 -5.337 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -10.512 19.957 -7.367 1.00 0.00 N ATOM 0 H GLN B 12 -6.939 17.747 -3.688 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.756 20.135 -3.522 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -8.857 17.231 -4.469 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -10.305 18.209 -4.338 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -7.933 19.375 -5.810 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -8.877 18.139 -6.619 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -10.205 19.283 -8.069 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -11.228 20.645 -7.599 1.00 0.00 H new ATOM 1747 N ASP B 13 -8.815 17.520 -1.528 1.00 0.00 N ATOM 1748 CA ASP B 13 -9.286 17.136 -0.170 1.00 0.00 C ATOM 1749 C ASP B 13 -8.663 18.124 0.817 1.00 0.00 C ATOM 1750 O ASP B 13 -9.190 18.395 1.876 1.00 0.00 O ATOM 1751 CB ASP B 13 -8.765 15.717 0.063 1.00 0.00 C ATOM 1752 CG ASP B 13 -9.462 14.751 -0.899 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -9.879 15.194 -1.957 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -9.565 13.583 -0.563 1.00 0.00 O ATOM 0 H ASP B 13 -8.254 16.820 -2.014 1.00 0.00 H new ATOM 0 HA ASP B 13 -10.369 17.160 -0.053 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -7.686 15.685 -0.091 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -8.949 15.416 1.094 1.00 0.00 H new ATOM 1759 N THR B 14 -7.545 18.689 0.430 1.00 0.00 N ATOM 1760 CA THR B 14 -6.861 19.696 1.275 1.00 0.00 C ATOM 1761 C THR B 14 -7.368 21.079 0.881 1.00 0.00 C ATOM 1762 O THR B 14 -8.147 21.693 1.583 1.00 0.00 O ATOM 1763 CB THR B 14 -5.372 19.575 0.933 1.00 0.00 C ATOM 1764 OG1 THR B 14 -5.213 19.519 -0.468 1.00 0.00 O ATOM 1765 CG2 THR B 14 -4.784 18.325 1.580 1.00 0.00 C ATOM 0 H THR B 14 -7.076 18.486 -0.453 1.00 0.00 H new ATOM 0 HA THR B 14 -7.041 19.546 2.340 1.00 0.00 H new ATOM 0 HB THR B 14 -4.843 20.446 1.319 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.511 18.645 -0.796 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.726 18.249 1.330 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.898 18.388 2.662 1.00 0.00 H new ATOM 0 HG23 THR B 14 -5.308 17.443 1.211 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.930 21.567 -0.252 1.00 0.00 N ATOM 1774 CA GLY B 15 -7.389 22.913 -0.711 1.00 0.00 C ATOM 1775 C GLY B 15 -7.017 23.976 0.328 1.00 0.00 C ATOM 1776 O GLY B 15 -7.537 25.075 0.317 1.00 0.00 O ATOM 0 H GLY B 15 -6.277 21.094 -0.877 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -6.932 23.155 -1.670 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -8.468 22.905 -0.865 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.110 23.662 1.214 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.688 24.666 2.243 1.00 0.00 C ATOM 1782 C LEU B 16 -4.636 25.573 1.640 1.00 0.00 C ATOM 1783 O LEU B 16 -4.807 26.770 1.518 1.00 0.00 O ATOM 1784 CB LEU B 16 -5.061 23.876 3.398 1.00 0.00 C ATOM 1785 CG LEU B 16 -6.043 22.833 3.918 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -5.686 21.474 3.332 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.955 22.748 5.447 1.00 0.00 C ATOM 0 H LEU B 16 -5.642 22.757 1.273 1.00 0.00 H new ATOM 0 HA LEU B 16 -6.531 25.267 2.583 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.147 23.388 3.060 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.781 24.556 4.203 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.054 23.118 3.626 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -6.385 20.724 3.701 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -5.743 21.520 2.244 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -4.673 21.204 3.631 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.660 22.000 5.811 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.943 22.465 5.738 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.199 23.718 5.880 1.00 0.00 H new ATOM 1799 N THR B 17 -3.544 24.989 1.259 1.00 0.00 N ATOM 1800 CA THR B 17 -2.446 25.770 0.654 1.00 0.00 C ATOM 1801 C THR B 17 -1.836 24.988 -0.507 1.00 0.00 C ATOM 1802 O THR B 17 -0.849 25.398 -1.087 1.00 0.00 O ATOM 1803 CB THR B 17 -1.430 25.943 1.791 1.00 0.00 C ATOM 1804 OG1 THR B 17 -0.849 27.237 1.714 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.328 24.881 1.693 1.00 0.00 C ATOM 0 H THR B 17 -3.364 23.988 1.343 1.00 0.00 H new ATOM 0 HA THR B 17 -2.774 26.728 0.251 1.00 0.00 H new ATOM 0 HB THR B 17 -1.946 25.826 2.744 1.00 0.00 H new ATOM 0 HG1 THR B 17 -0.201 27.349 2.441 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.384 25.019 2.507 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.772 23.888 1.764 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.189 24.980 0.739 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.379 23.837 -0.818 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.772 23.012 -1.895 1.00 0.00 C ATOM 1815 C GLN B 18 -0.324 22.768 -1.505 1.00 0.00 C ATOM 1816 O GLN B 18 0.538 22.597 -2.342 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.873 23.840 -3.182 1.00 0.00 C ATOM 1818 CG GLN B 18 -3.268 24.460 -3.282 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.605 24.743 -4.748 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -2.934 24.266 -5.641 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -4.626 25.503 -5.034 1.00 0.00 N ATOM 0 H GLN B 18 -3.208 23.440 -0.375 1.00 0.00 H new ATOM 0 HA GLN B 18 -2.265 22.051 -2.041 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -1.115 24.623 -3.184 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.681 23.208 -4.049 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -4.008 23.784 -2.853 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.308 25.384 -2.705 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -5.190 25.904 -4.284 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -4.861 25.697 -6.008 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.079 22.768 -0.208 1.00 0.00 N ATOM 1831 CA VAL B 19 1.294 22.557 0.353 1.00 0.00 C ATOM 1832 C VAL B 19 2.265 22.203 -0.775 1.00 0.00 C ATOM 1833 O VAL B 19 2.701 23.052 -1.529 1.00 0.00 O ATOM 1834 CB VAL B 19 1.116 21.414 1.401 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.245 20.284 0.834 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.468 20.818 1.827 1.00 0.00 C ATOM 0 H VAL B 19 -0.799 22.910 0.501 1.00 0.00 H new ATOM 0 HA VAL B 19 1.720 23.442 0.827 1.00 0.00 H new ATOM 0 HB VAL B 19 0.631 21.859 2.270 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.135 19.499 1.582 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.738 20.678 0.574 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.718 19.872 -0.057 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.303 20.026 2.557 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.976 20.407 0.954 1.00 0.00 H new ATOM 0 HG23 VAL B 19 3.086 21.598 2.272 1.00 0.00 H new ATOM 1846 N SER B 20 2.556 20.965 -0.918 1.00 0.00 N ATOM 1847 CA SER B 20 3.419 20.494 -1.991 1.00 0.00 C ATOM 1848 C SER B 20 2.714 19.287 -2.575 1.00 0.00 C ATOM 1849 O SER B 20 3.339 18.415 -3.114 1.00 0.00 O ATOM 1850 CB SER B 20 4.743 20.144 -1.322 1.00 0.00 C ATOM 1851 OG SER B 20 4.884 18.740 -1.233 1.00 0.00 O ATOM 0 H SER B 20 2.212 20.227 -0.303 1.00 0.00 H new ATOM 0 HA SER B 20 3.611 21.207 -2.793 1.00 0.00 H new ATOM 0 HB2 SER B 20 5.571 20.565 -1.893 1.00 0.00 H new ATOM 0 HB3 SER B 20 4.785 20.586 -0.326 1.00 0.00 H new ATOM 0 HG SER B 20 5.810 18.518 -1.000 1.00 0.00 H new ATOM 1857 N VAL B 21 1.402 19.216 -2.411 1.00 0.00 N ATOM 1858 CA VAL B 21 0.596 18.054 -2.900 1.00 0.00 C ATOM 1859 C VAL B 21 1.366 17.276 -3.938 1.00 0.00 C ATOM 1860 O VAL B 21 1.345 16.061 -3.985 1.00 0.00 O ATOM 1861 CB VAL B 21 -0.656 18.668 -3.523 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -1.533 19.278 -2.427 1.00 0.00 C ATOM 1863 CG2 VAL B 21 -0.262 19.759 -4.527 1.00 0.00 C ATOM 0 H VAL B 21 0.852 19.938 -1.946 1.00 0.00 H new ATOM 0 HA VAL B 21 0.356 17.360 -2.095 1.00 0.00 H new ATOM 0 HB VAL B 21 -1.212 17.887 -4.041 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -2.425 19.715 -2.876 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.826 18.501 -1.721 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.974 20.053 -1.903 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -1.161 20.191 -4.966 1.00 0.00 H new ATOM 0 HG22 VAL B 21 0.302 20.538 -4.015 1.00 0.00 H new ATOM 0 HG23 VAL B 21 0.353 19.324 -5.314 1.00 0.00 H new ATOM 1873 N SER B 22 2.078 17.990 -4.741 1.00 0.00 N ATOM 1874 CA SER B 22 2.907 17.332 -5.785 1.00 0.00 C ATOM 1875 C SER B 22 4.164 16.768 -5.134 1.00 0.00 C ATOM 1876 O SER B 22 4.566 15.650 -5.393 1.00 0.00 O ATOM 1877 CB SER B 22 3.254 18.433 -6.784 1.00 0.00 C ATOM 1878 OG SER B 22 4.380 18.031 -7.554 1.00 0.00 O ATOM 0 H SER B 22 2.127 19.009 -4.726 1.00 0.00 H new ATOM 0 HA SER B 22 2.393 16.507 -6.279 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.404 18.629 -7.437 1.00 0.00 H new ATOM 0 HB3 SER B 22 3.472 19.362 -6.258 1.00 0.00 H new ATOM 0 HG SER B 22 4.604 18.735 -8.198 1.00 0.00 H new ATOM 1884 N LYS B 23 4.764 17.526 -4.264 1.00 0.00 N ATOM 1885 CA LYS B 23 5.971 17.040 -3.562 1.00 0.00 C ATOM 1886 C LYS B 23 5.566 16.378 -2.247 1.00 0.00 C ATOM 1887 O LYS B 23 6.314 15.608 -1.685 1.00 0.00 O ATOM 1888 CB LYS B 23 6.819 18.285 -3.316 1.00 0.00 C ATOM 1889 CG LYS B 23 7.408 18.766 -4.642 1.00 0.00 C ATOM 1890 CD LYS B 23 6.662 20.017 -5.113 1.00 0.00 C ATOM 1891 CE LYS B 23 6.852 21.146 -4.094 1.00 0.00 C ATOM 1892 NZ LYS B 23 7.762 22.118 -4.762 1.00 0.00 N ATOM 0 H LYS B 23 4.465 18.468 -4.010 1.00 0.00 H new ATOM 0 HA LYS B 23 6.522 16.295 -4.136 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.210 19.071 -2.869 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.619 18.061 -2.610 1.00 0.00 H new ATOM 0 HG2 LYS B 23 8.469 18.987 -4.521 1.00 0.00 H new ATOM 0 HG3 LYS B 23 7.330 17.980 -5.393 1.00 0.00 H new ATOM 0 HD2 LYS B 23 7.034 20.328 -6.089 1.00 0.00 H new ATOM 0 HD3 LYS B 23 5.601 19.796 -5.232 1.00 0.00 H new ATOM 0 HE2 LYS B 23 5.900 21.610 -3.836 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.286 20.772 -3.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 7.940 22.921 -4.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 8.663 21.650 -4.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 7.320 22.462 -5.638 1.00 0.00 H new ATOM 1906 N MET B 24 4.381 16.658 -1.751 1.00 0.00 N ATOM 1907 CA MET B 24 3.935 16.044 -0.507 1.00 0.00 C ATOM 1908 C MET B 24 3.716 14.557 -0.770 1.00 0.00 C ATOM 1909 O MET B 24 4.169 13.716 -0.020 1.00 0.00 O ATOM 1910 CB MET B 24 2.653 16.812 -0.221 1.00 0.00 C ATOM 1911 CG MET B 24 2.040 16.333 1.072 1.00 0.00 C ATOM 1912 SD MET B 24 1.015 14.869 0.779 1.00 0.00 S ATOM 1913 CE MET B 24 0.349 15.395 -0.813 1.00 0.00 C ATOM 0 H MET B 24 3.712 17.298 -2.179 1.00 0.00 H new ATOM 0 HA MET B 24 4.621 16.093 0.339 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.865 17.879 -0.159 1.00 0.00 H new ATOM 0 HB3 MET B 24 1.947 16.675 -1.040 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.826 16.097 1.789 1.00 0.00 H new ATOM 0 HG3 MET B 24 1.435 17.126 1.511 1.00 0.00 H new ATOM 0 HE1 MET B 24 -0.490 14.755 -1.086 1.00 0.00 H new ATOM 0 HE2 MET B 24 0.009 16.428 -0.742 1.00 0.00 H new ATOM 0 HE3 MET B 24 1.125 15.321 -1.575 1.00 0.00 H new ATOM 1923 N LEU B 25 3.077 14.216 -1.863 1.00 0.00 N ATOM 1924 CA LEU B 25 2.911 12.775 -2.174 1.00 0.00 C ATOM 1925 C LEU B 25 4.235 12.259 -2.710 1.00 0.00 C ATOM 1926 O LEU B 25 4.712 11.218 -2.304 1.00 0.00 O ATOM 1927 CB LEU B 25 1.823 12.694 -3.228 1.00 0.00 C ATOM 1928 CG LEU B 25 0.483 12.570 -2.516 1.00 0.00 C ATOM 1929 CD1 LEU B 25 -0.645 12.985 -3.454 1.00 0.00 C ATOM 1930 CD2 LEU B 25 0.276 11.120 -2.071 1.00 0.00 C ATOM 0 H LEU B 25 2.672 14.865 -2.538 1.00 0.00 H new ATOM 0 HA LEU B 25 2.635 12.176 -1.306 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.838 13.582 -3.859 1.00 0.00 H new ATOM 0 HB3 LEU B 25 1.988 11.837 -3.880 1.00 0.00 H new ATOM 0 HG LEU B 25 0.477 13.224 -1.644 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.600 12.893 -2.937 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.498 14.019 -3.764 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.644 12.339 -4.332 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -0.683 11.029 -1.561 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.286 10.467 -2.943 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.077 10.830 -1.391 1.00 0.00 H new ATOM 1942 N ALA B 26 4.867 13.002 -3.589 1.00 0.00 N ATOM 1943 CA ALA B 26 6.193 12.559 -4.098 1.00 0.00 C ATOM 1944 C ALA B 26 7.092 12.326 -2.888 1.00 0.00 C ATOM 1945 O ALA B 26 7.908 11.427 -2.866 1.00 0.00 O ATOM 1946 CB ALA B 26 6.719 13.710 -4.956 1.00 0.00 C ATOM 0 H ALA B 26 4.523 13.884 -3.968 1.00 0.00 H new ATOM 0 HA ALA B 26 6.150 11.641 -4.685 1.00 0.00 H new ATOM 0 HB1 ALA B 26 7.696 13.445 -5.361 1.00 0.00 H new ATOM 0 HB2 ALA B 26 6.026 13.899 -5.775 1.00 0.00 H new ATOM 0 HB3 ALA B 26 6.811 14.607 -4.344 1.00 0.00 H new ATOM 1952 N SER B 27 6.900 13.111 -1.856 1.00 0.00 N ATOM 1953 CA SER B 27 7.691 12.919 -0.615 1.00 0.00 C ATOM 1954 C SER B 27 7.139 11.697 0.105 1.00 0.00 C ATOM 1955 O SER B 27 7.875 10.879 0.607 1.00 0.00 O ATOM 1956 CB SER B 27 7.478 14.180 0.222 1.00 0.00 C ATOM 1957 OG SER B 27 8.291 15.228 -0.291 1.00 0.00 O ATOM 0 H SER B 27 6.226 13.876 -1.826 1.00 0.00 H new ATOM 0 HA SER B 27 8.753 12.764 -0.804 1.00 0.00 H new ATOM 0 HB2 SER B 27 6.429 14.473 0.198 1.00 0.00 H new ATOM 0 HB3 SER B 27 7.731 13.985 1.264 1.00 0.00 H new ATOM 0 HG SER B 27 7.731 15.868 -0.778 1.00 0.00 H new ATOM 1963 N PHE B 28 5.835 11.558 0.128 1.00 0.00 N ATOM 1964 CA PHE B 28 5.218 10.368 0.787 1.00 0.00 C ATOM 1965 C PHE B 28 5.632 9.117 0.025 1.00 0.00 C ATOM 1966 O PHE B 28 5.806 8.066 0.585 1.00 0.00 O ATOM 1967 CB PHE B 28 3.705 10.599 0.708 1.00 0.00 C ATOM 1968 CG PHE B 28 2.979 9.364 0.210 1.00 0.00 C ATOM 1969 CD1 PHE B 28 2.630 8.339 1.104 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.614 9.263 -1.138 1.00 0.00 C ATOM 1971 CE1 PHE B 28 1.923 7.227 0.645 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.897 8.156 -1.589 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.551 7.137 -0.698 1.00 0.00 C ATOM 0 H PHE B 28 5.173 12.218 -0.281 1.00 0.00 H new ATOM 0 HA PHE B 28 5.533 10.237 1.822 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.326 10.873 1.693 1.00 0.00 H new ATOM 0 HB3 PHE B 28 3.498 11.437 0.042 1.00 0.00 H new ATOM 0 HD1 PHE B 28 2.908 8.411 2.145 1.00 0.00 H new ATOM 0 HD2 PHE B 28 2.889 10.045 -1.830 1.00 0.00 H new ATOM 0 HE1 PHE B 28 1.663 6.434 1.330 1.00 0.00 H new ATOM 0 HE2 PHE B 28 1.609 8.086 -2.627 1.00 0.00 H new ATOM 0 HZ PHE B 28 0.996 6.279 -1.048 1.00 0.00 H new ATOM 1983 N GLU B 29 5.829 9.242 -1.245 1.00 0.00 N ATOM 1984 CA GLU B 29 6.269 8.087 -2.043 1.00 0.00 C ATOM 1985 C GLU B 29 7.766 8.009 -1.922 1.00 0.00 C ATOM 1986 O GLU B 29 8.355 6.948 -1.878 1.00 0.00 O ATOM 1987 CB GLU B 29 5.799 8.418 -3.448 1.00 0.00 C ATOM 1988 CG GLU B 29 4.381 7.888 -3.567 1.00 0.00 C ATOM 1989 CD GLU B 29 3.512 8.848 -4.379 1.00 0.00 C ATOM 1990 OE1 GLU B 29 3.437 10.006 -4.008 1.00 0.00 O ATOM 1991 OE2 GLU B 29 2.931 8.406 -5.356 1.00 0.00 O ATOM 0 H GLU B 29 5.702 10.107 -1.770 1.00 0.00 H new ATOM 0 HA GLU B 29 5.875 7.118 -1.735 1.00 0.00 H new ATOM 0 HB2 GLU B 29 5.827 9.494 -3.622 1.00 0.00 H new ATOM 0 HB3 GLU B 29 6.449 7.958 -4.192 1.00 0.00 H new ATOM 0 HG2 GLU B 29 4.393 6.908 -4.044 1.00 0.00 H new ATOM 0 HG3 GLU B 29 3.953 7.754 -2.574 1.00 0.00 H new ATOM 1998 N LYS B 30 8.372 9.141 -1.793 1.00 0.00 N ATOM 1999 CA LYS B 30 9.828 9.168 -1.586 1.00 0.00 C ATOM 2000 C LYS B 30 10.099 8.660 -0.172 1.00 0.00 C ATOM 2001 O LYS B 30 11.114 8.079 0.080 1.00 0.00 O ATOM 2002 CB LYS B 30 10.253 10.629 -1.730 1.00 0.00 C ATOM 2003 CG LYS B 30 11.754 10.749 -1.461 1.00 0.00 C ATOM 2004 CD LYS B 30 12.197 12.199 -1.668 1.00 0.00 C ATOM 2005 CE LYS B 30 13.725 12.265 -1.725 1.00 0.00 C ATOM 2006 NZ LYS B 30 14.091 13.439 -0.885 1.00 0.00 N ATOM 0 H LYS B 30 7.918 10.054 -1.822 1.00 0.00 H new ATOM 0 HA LYS B 30 10.376 8.548 -2.295 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.022 10.990 -2.732 1.00 0.00 H new ATOM 0 HB3 LYS B 30 9.696 11.252 -1.031 1.00 0.00 H new ATOM 0 HG2 LYS B 30 11.978 10.431 -0.443 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.308 10.090 -2.130 1.00 0.00 H new ATOM 0 HD2 LYS B 30 11.771 12.592 -2.591 1.00 0.00 H new ATOM 0 HD3 LYS B 30 11.826 12.823 -0.855 1.00 0.00 H new ATOM 0 HE2 LYS B 30 14.174 11.349 -1.341 1.00 0.00 H new ATOM 0 HE3 LYS B 30 14.077 12.387 -2.749 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 15.125 13.550 -0.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 13.655 14.297 -1.279 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 13.749 13.291 0.086 1.00 0.00 H new ATOM 2020 N ILE B 31 9.175 8.853 0.749 1.00 0.00 N ATOM 2021 CA ILE B 31 9.391 8.351 2.138 1.00 0.00 C ATOM 2022 C ILE B 31 8.767 6.972 2.289 1.00 0.00 C ATOM 2023 O ILE B 31 9.256 6.142 3.012 1.00 0.00 O ATOM 2024 CB ILE B 31 8.740 9.353 3.078 1.00 0.00 C ATOM 2025 CG1 ILE B 31 7.264 9.517 2.771 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.450 10.700 2.963 1.00 0.00 C ATOM 2027 CD1 ILE B 31 6.445 8.986 3.950 1.00 0.00 C ATOM 0 H ILE B 31 8.289 9.334 0.593 1.00 0.00 H new ATOM 0 HA ILE B 31 10.452 8.255 2.368 1.00 0.00 H new ATOM 0 HB ILE B 31 8.831 8.976 4.097 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.031 10.567 2.594 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.007 8.976 1.860 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.982 11.417 3.638 1.00 0.00 H new ATOM 0 HG22 ILE B 31 10.500 10.582 3.231 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.376 11.064 1.938 1.00 0.00 H new ATOM 0 HD11 ILE B 31 5.382 9.101 3.736 1.00 0.00 H new ATOM 0 HD12 ILE B 31 6.672 7.931 4.105 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.697 9.547 4.850 1.00 0.00 H new ATOM 2039 N ILE B 32 7.711 6.706 1.585 1.00 0.00 N ATOM 2040 CA ILE B 32 7.098 5.345 1.658 1.00 0.00 C ATOM 2041 C ILE B 32 8.136 4.366 1.166 1.00 0.00 C ATOM 2042 O ILE B 32 8.505 3.420 1.831 1.00 0.00 O ATOM 2043 CB ILE B 32 5.916 5.338 0.684 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.709 6.017 1.338 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.554 3.891 0.317 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.996 5.041 2.273 1.00 0.00 C ATOM 0 H ILE B 32 7.242 7.364 0.962 1.00 0.00 H new ATOM 0 HA ILE B 32 6.773 5.088 2.666 1.00 0.00 H new ATOM 0 HB ILE B 32 6.193 5.880 -0.220 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.035 6.895 1.896 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.019 6.366 0.570 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.713 3.891 -0.376 1.00 0.00 H new ATOM 0 HG22 ILE B 32 6.411 3.410 -0.153 1.00 0.00 H new ATOM 0 HG23 ILE B 32 5.281 3.344 1.219 1.00 0.00 H new ATOM 0 HD11 ILE B 32 3.140 5.536 2.732 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.654 4.177 1.704 1.00 0.00 H new ATOM 0 HD13 ILE B 32 4.685 4.713 3.051 1.00 0.00 H new ATOM 2058 N THR B 33 8.611 4.616 -0.015 1.00 0.00 N ATOM 2059 CA THR B 33 9.636 3.738 -0.593 1.00 0.00 C ATOM 2060 C THR B 33 10.898 3.838 0.265 1.00 0.00 C ATOM 2061 O THR B 33 11.573 2.861 0.539 1.00 0.00 O ATOM 2062 CB THR B 33 9.849 4.266 -2.018 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.766 3.191 -2.933 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.208 4.946 -2.155 1.00 0.00 C ATOM 0 H THR B 33 8.326 5.399 -0.604 1.00 0.00 H new ATOM 0 HA THR B 33 9.358 2.684 -0.620 1.00 0.00 H new ATOM 0 HB THR B 33 9.074 5.002 -2.232 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.873 3.172 -3.335 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.331 5.310 -3.175 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.267 5.784 -1.461 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.998 4.230 -1.927 1.00 0.00 H new ATOM 2072 N GLU B 34 11.209 5.031 0.695 1.00 0.00 N ATOM 2073 CA GLU B 34 12.414 5.235 1.537 1.00 0.00 C ATOM 2074 C GLU B 34 12.230 4.603 2.918 1.00 0.00 C ATOM 2075 O GLU B 34 13.122 3.954 3.405 1.00 0.00 O ATOM 2076 CB GLU B 34 12.566 6.747 1.648 1.00 0.00 C ATOM 2077 CG GLU B 34 13.294 7.272 0.401 1.00 0.00 C ATOM 2078 CD GLU B 34 14.770 6.876 0.463 1.00 0.00 C ATOM 2079 OE1 GLU B 34 15.513 7.544 1.162 1.00 0.00 O ATOM 2080 OE2 GLU B 34 15.132 5.911 -0.190 1.00 0.00 O ATOM 0 H GLU B 34 10.674 5.876 0.496 1.00 0.00 H new ATOM 0 HA GLU B 34 13.297 4.766 1.104 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.587 7.218 1.738 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.127 7.004 2.547 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.835 6.863 -0.499 1.00 0.00 H new ATOM 0 HG3 GLU B 34 13.200 8.356 0.342 1.00 0.00 H new ATOM 2087 N THR B 35 11.089 4.771 3.559 1.00 0.00 N ATOM 2088 CA THR B 35 10.912 4.148 4.910 1.00 0.00 C ATOM 2089 C THR B 35 11.211 2.669 4.813 1.00 0.00 C ATOM 2090 O THR B 35 12.022 2.148 5.554 1.00 0.00 O ATOM 2091 CB THR B 35 9.463 4.352 5.338 1.00 0.00 C ATOM 2092 OG1 THR B 35 9.187 5.742 5.444 1.00 0.00 O ATOM 2093 CG2 THR B 35 9.273 3.676 6.704 1.00 0.00 C ATOM 0 H THR B 35 10.291 5.302 3.210 1.00 0.00 H new ATOM 0 HA THR B 35 11.585 4.603 5.637 1.00 0.00 H new ATOM 0 HB THR B 35 8.784 3.918 4.604 1.00 0.00 H new ATOM 0 HG1 THR B 35 8.721 6.046 4.637 1.00 0.00 H new ATOM 0 HG21 THR B 35 8.243 3.807 7.035 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.494 2.612 6.617 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.948 4.128 7.431 1.00 0.00 H new ATOM 2101 N VAL B 36 10.591 1.985 3.891 1.00 0.00 N ATOM 2102 CA VAL B 36 10.900 0.537 3.749 1.00 0.00 C ATOM 2103 C VAL B 36 12.417 0.398 3.661 1.00 0.00 C ATOM 2104 O VAL B 36 13.015 -0.517 4.191 1.00 0.00 O ATOM 2105 CB VAL B 36 10.225 0.094 2.441 1.00 0.00 C ATOM 2106 CG1 VAL B 36 11.279 -0.170 1.355 1.00 0.00 C ATOM 2107 CG2 VAL B 36 9.427 -1.184 2.696 1.00 0.00 C ATOM 0 H VAL B 36 9.898 2.358 3.242 1.00 0.00 H new ATOM 0 HA VAL B 36 10.545 -0.071 4.581 1.00 0.00 H new ATOM 0 HB VAL B 36 9.561 0.887 2.098 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.784 -0.483 0.436 1.00 0.00 H new ATOM 0 HG12 VAL B 36 11.846 0.742 1.169 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.956 -0.957 1.688 1.00 0.00 H new ATOM 0 HG21 VAL B 36 8.946 -1.503 1.771 1.00 0.00 H new ATOM 0 HG22 VAL B 36 10.098 -1.969 3.045 1.00 0.00 H new ATOM 0 HG23 VAL B 36 8.667 -0.993 3.454 1.00 0.00 H new ATOM 2117 N ALA B 37 13.032 1.335 2.998 1.00 0.00 N ATOM 2118 CA ALA B 37 14.504 1.314 2.866 1.00 0.00 C ATOM 2119 C ALA B 37 15.141 2.210 3.932 1.00 0.00 C ATOM 2120 O ALA B 37 16.346 2.324 4.035 1.00 0.00 O ATOM 2121 CB ALA B 37 14.768 1.844 1.481 1.00 0.00 C ATOM 0 H ALA B 37 12.569 2.120 2.539 1.00 0.00 H new ATOM 0 HA ALA B 37 14.927 0.319 3.006 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.842 1.863 1.297 1.00 0.00 H new ATOM 0 HB2 ALA B 37 14.286 1.199 0.747 1.00 0.00 H new ATOM 0 HB3 ALA B 37 14.367 2.854 1.395 1.00 0.00 H new ATOM 2127 N LYS B 38 14.338 2.806 4.754 1.00 0.00 N ATOM 2128 CA LYS B 38 14.883 3.636 5.857 1.00 0.00 C ATOM 2129 C LYS B 38 14.919 2.736 7.070 1.00 0.00 C ATOM 2130 O LYS B 38 15.689 2.920 7.991 1.00 0.00 O ATOM 2131 CB LYS B 38 13.915 4.803 6.059 1.00 0.00 C ATOM 2132 CG LYS B 38 14.683 6.023 6.575 1.00 0.00 C ATOM 2133 CD LYS B 38 14.827 7.055 5.453 1.00 0.00 C ATOM 2134 CE LYS B 38 15.672 6.467 4.319 1.00 0.00 C ATOM 2135 NZ LYS B 38 17.074 6.512 4.820 1.00 0.00 N ATOM 0 H LYS B 38 13.320 2.756 4.712 1.00 0.00 H new ATOM 0 HA LYS B 38 15.878 4.036 5.662 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.419 5.044 5.119 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.136 4.524 6.769 1.00 0.00 H new ATOM 0 HG2 LYS B 38 14.158 6.464 7.422 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.667 5.721 6.933 1.00 0.00 H new ATOM 0 HD2 LYS B 38 13.844 7.339 5.078 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.295 7.961 5.837 1.00 0.00 H new ATOM 0 HE2 LYS B 38 15.368 5.446 4.089 1.00 0.00 H new ATOM 0 HE3 LYS B 38 15.561 7.047 3.403 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 17.712 6.777 4.043 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 17.147 7.214 5.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.343 5.576 5.184 1.00 0.00 H new ATOM 2149 N GLY B 39 14.101 1.721 7.036 1.00 0.00 N ATOM 2150 CA GLY B 39 14.082 0.750 8.130 1.00 0.00 C ATOM 2151 C GLY B 39 12.748 0.790 8.873 1.00 0.00 C ATOM 2152 O GLY B 39 12.717 0.777 10.087 1.00 0.00 O ATOM 0 H GLY B 39 13.442 1.533 6.281 1.00 0.00 H new ATOM 0 HA2 GLY B 39 14.253 -0.252 7.735 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.895 0.962 8.824 1.00 0.00 H new ATOM 2156 N ASP B 40 11.643 0.832 8.170 1.00 0.00 N ATOM 2157 CA ASP B 40 10.338 0.862 8.894 1.00 0.00 C ATOM 2158 C ASP B 40 9.205 0.314 8.025 1.00 0.00 C ATOM 2159 O ASP B 40 9.333 0.161 6.826 1.00 0.00 O ATOM 2160 CB ASP B 40 10.101 2.336 9.229 1.00 0.00 C ATOM 2161 CG ASP B 40 10.267 2.551 10.736 1.00 0.00 C ATOM 2162 OD1 ASP B 40 9.695 1.780 11.491 1.00 0.00 O ATOM 2163 OD2 ASP B 40 10.962 3.481 11.109 1.00 0.00 O ATOM 0 H ASP B 40 11.588 0.846 7.152 1.00 0.00 H new ATOM 0 HA ASP B 40 10.361 0.236 9.786 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.806 2.962 8.682 1.00 0.00 H new ATOM 0 HB3 ASP B 40 9.100 2.635 8.916 1.00 0.00 H new ATOM 2168 N LYS B 41 8.089 0.033 8.639 1.00 0.00 N ATOM 2169 CA LYS B 41 6.912 -0.490 7.901 1.00 0.00 C ATOM 2170 C LYS B 41 5.757 0.479 8.131 1.00 0.00 C ATOM 2171 O LYS B 41 5.279 0.622 9.240 1.00 0.00 O ATOM 2172 CB LYS B 41 6.596 -1.853 8.534 1.00 0.00 C ATOM 2173 CG LYS B 41 7.863 -2.715 8.614 1.00 0.00 C ATOM 2174 CD LYS B 41 7.736 -3.700 9.778 1.00 0.00 C ATOM 2175 CE LYS B 41 8.677 -4.886 9.549 1.00 0.00 C ATOM 2176 NZ LYS B 41 7.891 -6.083 9.955 1.00 0.00 N ATOM 0 H LYS B 41 7.944 0.147 9.642 1.00 0.00 H new ATOM 0 HA LYS B 41 7.084 -0.591 6.829 1.00 0.00 H new ATOM 0 HB2 LYS B 41 6.183 -1.710 9.532 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.836 -2.367 7.945 1.00 0.00 H new ATOM 0 HG2 LYS B 41 8.007 -3.257 7.679 1.00 0.00 H new ATOM 0 HG3 LYS B 41 8.739 -2.081 8.753 1.00 0.00 H new ATOM 0 HD2 LYS B 41 7.981 -3.203 10.717 1.00 0.00 H new ATOM 0 HD3 LYS B 41 6.707 -4.050 9.862 1.00 0.00 H new ATOM 0 HE2 LYS B 41 8.984 -4.951 8.505 1.00 0.00 H new ATOM 0 HE3 LYS B 41 9.586 -4.790 10.143 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.469 -6.938 9.827 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 7.618 -5.996 10.955 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.036 -6.152 9.368 1.00 0.00 H new ATOM 2190 N VAL B 42 5.319 1.165 7.117 1.00 0.00 N ATOM 2191 CA VAL B 42 4.206 2.143 7.338 1.00 0.00 C ATOM 2192 C VAL B 42 2.866 1.409 7.393 1.00 0.00 C ATOM 2193 O VAL B 42 2.668 0.407 6.734 1.00 0.00 O ATOM 2194 CB VAL B 42 4.250 3.172 6.184 1.00 0.00 C ATOM 2195 CG1 VAL B 42 5.681 3.350 5.664 1.00 0.00 C ATOM 2196 CG2 VAL B 42 3.335 2.745 5.027 1.00 0.00 C ATOM 0 H VAL B 42 5.670 1.099 6.161 1.00 0.00 H new ATOM 0 HA VAL B 42 4.323 2.662 8.289 1.00 0.00 H new ATOM 0 HB VAL B 42 3.895 4.122 6.582 1.00 0.00 H new ATOM 0 HG11 VAL B 42 5.685 4.078 4.853 1.00 0.00 H new ATOM 0 HG12 VAL B 42 6.321 3.703 6.473 1.00 0.00 H new ATOM 0 HG13 VAL B 42 6.056 2.395 5.296 1.00 0.00 H new ATOM 0 HG21 VAL B 42 3.386 3.487 4.230 1.00 0.00 H new ATOM 0 HG22 VAL B 42 3.660 1.778 4.644 1.00 0.00 H new ATOM 0 HG23 VAL B 42 2.308 2.667 5.385 1.00 0.00 H new ATOM 2206 N GLN B 43 1.948 1.901 8.176 1.00 0.00 N ATOM 2207 CA GLN B 43 0.619 1.237 8.279 1.00 0.00 C ATOM 2208 C GLN B 43 -0.474 2.243 7.934 1.00 0.00 C ATOM 2209 O GLN B 43 -1.029 2.890 8.797 1.00 0.00 O ATOM 2210 CB GLN B 43 0.495 0.789 9.740 1.00 0.00 C ATOM 2211 CG GLN B 43 1.791 0.108 10.189 1.00 0.00 C ATOM 2212 CD GLN B 43 1.460 -1.082 11.093 1.00 0.00 C ATOM 2213 OE1 GLN B 43 2.045 -2.139 10.964 1.00 0.00 O ATOM 2214 NE2 GLN B 43 0.540 -0.953 12.010 1.00 0.00 N ATOM 0 H GLN B 43 2.061 2.736 8.751 1.00 0.00 H new ATOM 0 HA GLN B 43 0.521 0.393 7.597 1.00 0.00 H new ATOM 0 HB2 GLN B 43 0.287 1.649 10.377 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -0.344 0.101 9.849 1.00 0.00 H new ATOM 0 HG2 GLN B 43 2.356 -0.229 9.320 1.00 0.00 H new ATOM 0 HG3 GLN B 43 2.421 0.819 10.723 1.00 0.00 H new ATOM 0 HE21 GLN B 43 0.049 -0.066 12.118 1.00 0.00 H new ATOM 0 HE22 GLN B 43 0.312 -1.740 12.618 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.776 2.388 6.675 1.00 0.00 N ATOM 2224 CA LEU B 44 -1.822 3.366 6.265 1.00 0.00 C ATOM 2225 C LEU B 44 -3.158 3.037 6.926 1.00 0.00 C ATOM 2226 O LEU B 44 -3.958 2.296 6.393 1.00 0.00 O ATOM 2227 CB LEU B 44 -1.931 3.212 4.755 1.00 0.00 C ATOM 2228 CG LEU B 44 -0.953 4.163 4.068 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -0.994 3.937 2.555 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.356 5.604 4.376 1.00 0.00 C ATOM 0 H LEU B 44 -0.343 1.871 5.910 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.566 4.383 6.562 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.714 2.183 4.468 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.949 3.426 4.431 1.00 0.00 H new ATOM 0 HG LEU B 44 0.057 3.975 4.434 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.296 4.616 2.067 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.714 2.907 2.333 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.002 4.126 2.186 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.662 6.288 3.888 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.365 5.787 4.006 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.329 5.767 5.453 1.00 0.00 H new ATOM 2242 N THR B 45 -3.395 3.604 8.082 1.00 0.00 N ATOM 2243 CA THR B 45 -4.676 3.378 8.833 1.00 0.00 C ATOM 2244 C THR B 45 -5.214 1.941 8.686 1.00 0.00 C ATOM 2245 O THR B 45 -6.397 1.706 8.833 1.00 0.00 O ATOM 2246 CB THR B 45 -5.670 4.405 8.271 1.00 0.00 C ATOM 2247 OG1 THR B 45 -6.970 4.120 8.769 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.691 4.352 6.743 1.00 0.00 C ATOM 0 H THR B 45 -2.740 4.230 8.551 1.00 0.00 H new ATOM 0 HA THR B 45 -4.516 3.504 9.904 1.00 0.00 H new ATOM 0 HB THR B 45 -5.360 5.402 8.583 1.00 0.00 H new ATOM 0 HG1 THR B 45 -7.226 3.209 8.514 1.00 0.00 H new ATOM 0 HG21 THR B 45 -6.401 5.087 6.363 1.00 0.00 H new ATOM 0 HG22 THR B 45 -4.696 4.576 6.357 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.991 3.356 6.418 1.00 0.00 H new ATOM 2256 N GLY B 46 -4.361 0.976 8.449 1.00 0.00 N ATOM 2257 CA GLY B 46 -4.842 -0.436 8.358 1.00 0.00 C ATOM 2258 C GLY B 46 -5.056 -0.902 6.908 1.00 0.00 C ATOM 2259 O GLY B 46 -5.015 -2.087 6.640 1.00 0.00 O ATOM 0 H GLY B 46 -3.358 1.104 8.315 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -4.120 -1.093 8.843 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -5.779 -0.532 8.907 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.310 -0.021 5.969 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.545 -0.513 4.574 1.00 0.00 C ATOM 2265 C PHE B 47 -4.237 -0.675 3.794 1.00 0.00 C ATOM 2266 O PHE B 47 -4.141 -1.525 2.932 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.533 0.472 3.930 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.825 1.616 3.260 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.282 1.467 1.983 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.730 2.833 3.917 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.640 2.542 1.374 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -5.092 3.913 3.312 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.544 3.768 2.040 1.00 0.00 C ATOM 0 H PHE B 47 -5.364 0.989 6.101 1.00 0.00 H new ATOM 0 HA PHE B 47 -5.972 -1.516 4.571 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.146 -0.054 3.198 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.209 0.859 4.692 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.360 0.521 1.469 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -6.153 2.944 4.904 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.216 2.429 0.387 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -5.022 4.860 3.827 1.00 0.00 H new ATOM 0 HZ PHE B 47 -4.045 4.602 1.568 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.220 0.081 4.096 1.00 0.00 N ATOM 2284 CA LEU B 48 -1.935 -0.119 3.364 1.00 0.00 C ATOM 2285 C LEU B 48 -0.772 -0.248 4.353 1.00 0.00 C ATOM 2286 O LEU B 48 -0.194 0.726 4.793 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.773 1.092 2.449 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.220 0.745 1.023 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -1.713 1.816 0.065 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -1.660 -0.621 0.602 1.00 0.00 C ATOM 0 H LEU B 48 -3.218 0.816 4.804 1.00 0.00 H new ATOM 0 HA LEU B 48 -1.940 -1.039 2.779 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.363 1.926 2.830 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.732 1.415 2.443 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.309 0.702 0.994 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.028 1.575 -0.950 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -2.123 2.784 0.352 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -0.625 1.856 0.107 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -1.987 -0.851 -0.412 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -0.571 -0.593 0.635 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -2.024 -1.389 1.284 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.433 -1.462 4.705 1.00 0.00 N ATOM 2303 CA ASN B 49 0.683 -1.697 5.669 1.00 0.00 C ATOM 2304 C ASN B 49 1.922 -2.201 4.928 1.00 0.00 C ATOM 2305 O ASN B 49 2.062 -3.379 4.672 1.00 0.00 O ATOM 2306 CB ASN B 49 0.155 -2.777 6.618 1.00 0.00 C ATOM 2307 CG ASN B 49 0.380 -2.346 8.069 1.00 0.00 C ATOM 2308 OD1 ASN B 49 1.504 -2.183 8.499 1.00 0.00 O ATOM 2309 ND2 ASN B 49 -0.650 -2.154 8.846 1.00 0.00 N ATOM 0 H ASN B 49 -0.887 -2.309 4.362 1.00 0.00 H new ATOM 0 HA ASN B 49 0.975 -0.789 6.197 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.907 -2.944 6.439 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.663 -3.722 6.427 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -0.511 -1.867 9.815 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -1.594 -2.291 8.485 1.00 0.00 H new ATOM 2316 N ILE B 50 2.818 -1.317 4.582 1.00 0.00 N ATOM 2317 CA ILE B 50 4.053 -1.749 3.848 1.00 0.00 C ATOM 2318 C ILE B 50 5.146 -2.174 4.832 1.00 0.00 C ATOM 2319 O ILE B 50 5.267 -1.619 5.907 1.00 0.00 O ATOM 2320 CB ILE B 50 4.519 -0.525 3.046 1.00 0.00 C ATOM 2321 CG1 ILE B 50 5.067 0.541 3.989 1.00 0.00 C ATOM 2322 CG2 ILE B 50 3.360 0.059 2.231 1.00 0.00 C ATOM 2323 CD1 ILE B 50 6.586 0.381 4.100 1.00 0.00 C ATOM 0 H ILE B 50 2.753 -0.317 4.773 1.00 0.00 H new ATOM 0 HA ILE B 50 3.848 -2.603 3.203 1.00 0.00 H new ATOM 0 HB ILE B 50 5.306 -0.843 2.362 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.820 1.535 3.616 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.606 0.446 4.972 1.00 0.00 H new ATOM 0 HG21 ILE B 50 3.710 0.925 1.670 1.00 0.00 H new ATOM 0 HG22 ILE B 50 2.986 -0.695 1.538 1.00 0.00 H new ATOM 0 HG23 ILE B 50 2.558 0.363 2.904 1.00 0.00 H new ATOM 0 HD11 ILE B 50 6.984 1.141 4.773 1.00 0.00 H new ATOM 0 HD12 ILE B 50 6.820 -0.609 4.491 1.00 0.00 H new ATOM 0 HD13 ILE B 50 7.037 0.497 3.115 1.00 0.00 H new ATOM 2335 N LYS B 51 5.958 -3.139 4.473 1.00 0.00 N ATOM 2336 CA LYS B 51 7.048 -3.558 5.408 1.00 0.00 C ATOM 2337 C LYS B 51 8.209 -4.199 4.627 1.00 0.00 C ATOM 2338 O LYS B 51 7.994 -5.085 3.828 1.00 0.00 O ATOM 2339 CB LYS B 51 6.400 -4.576 6.355 1.00 0.00 C ATOM 2340 CG LYS B 51 5.779 -5.719 5.548 1.00 0.00 C ATOM 2341 CD LYS B 51 5.246 -6.792 6.503 1.00 0.00 C ATOM 2342 CE LYS B 51 6.047 -8.084 6.321 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.048 -9.180 6.463 1.00 0.00 N ATOM 0 H LYS B 51 5.915 -3.647 3.589 1.00 0.00 H new ATOM 0 HA LYS B 51 7.467 -2.712 5.953 1.00 0.00 H new ATOM 0 HB2 LYS B 51 7.146 -4.970 7.045 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.635 -4.088 6.959 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.970 -5.339 4.924 1.00 0.00 H new ATOM 0 HG3 LYS B 51 6.523 -6.151 4.878 1.00 0.00 H new ATOM 0 HD2 LYS B 51 5.323 -6.447 7.534 1.00 0.00 H new ATOM 0 HD3 LYS B 51 4.190 -6.976 6.307 1.00 0.00 H new ATOM 0 HE2 LYS B 51 6.530 -8.115 5.344 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.835 -8.169 7.069 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.522 -10.099 6.350 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.609 -9.130 7.405 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.314 -9.078 5.733 1.00 0.00 H new ATOM 2357 N PRO B 52 9.410 -3.723 4.873 1.00 0.00 N ATOM 2358 CA PRO B 52 10.591 -4.263 4.164 1.00 0.00 C ATOM 2359 C PRO B 52 11.122 -5.511 4.861 1.00 0.00 C ATOM 2360 O PRO B 52 11.166 -5.588 6.073 1.00 0.00 O ATOM 2361 CB PRO B 52 11.616 -3.147 4.272 1.00 0.00 C ATOM 2362 CG PRO B 52 11.243 -2.389 5.507 1.00 0.00 C ATOM 2363 CD PRO B 52 9.784 -2.656 5.806 1.00 0.00 C ATOM 0 HA PRO B 52 10.362 -4.550 3.138 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.627 -3.547 4.346 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.591 -2.503 3.393 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.866 -2.700 6.346 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.412 -1.322 5.363 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.641 -2.965 6.841 1.00 0.00 H new ATOM 0 HD3 PRO B 52 9.177 -1.764 5.653 1.00 0.00 H new ATOM 2371 N VAL B 53 11.540 -6.478 4.100 1.00 0.00 N ATOM 2372 CA VAL B 53 12.089 -7.720 4.716 1.00 0.00 C ATOM 2373 C VAL B 53 13.236 -8.294 3.881 1.00 0.00 C ATOM 2374 O VAL B 53 13.064 -8.693 2.749 1.00 0.00 O ATOM 2375 CB VAL B 53 10.919 -8.690 4.794 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.788 -8.059 5.612 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.412 -8.992 3.386 1.00 0.00 C ATOM 0 H VAL B 53 11.527 -6.466 3.080 1.00 0.00 H new ATOM 0 HA VAL B 53 12.510 -7.525 5.702 1.00 0.00 H new ATOM 0 HB VAL B 53 11.246 -9.614 5.271 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.949 -8.753 5.669 1.00 0.00 H new ATOM 0 HG12 VAL B 53 10.146 -7.839 6.618 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.463 -7.136 5.132 1.00 0.00 H new ATOM 0 HG21 VAL B 53 9.574 -9.687 3.442 1.00 0.00 H new ATOM 0 HG22 VAL B 53 10.085 -8.067 2.911 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.214 -9.438 2.798 1.00 0.00 H new ATOM 2387 N ALA B 54 14.406 -8.324 4.448 1.00 0.00 N ATOM 2388 CA ALA B 54 15.598 -8.850 3.712 1.00 0.00 C ATOM 2389 C ALA B 54 15.445 -10.342 3.397 1.00 0.00 C ATOM 2390 O ALA B 54 15.376 -11.163 4.290 1.00 0.00 O ATOM 2391 CB ALA B 54 16.789 -8.627 4.656 1.00 0.00 C ATOM 0 H ALA B 54 14.595 -8.005 5.398 1.00 0.00 H new ATOM 0 HA ALA B 54 15.727 -8.344 2.755 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.701 -8.990 4.183 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.889 -7.563 4.870 1.00 0.00 H new ATOM 0 HB3 ALA B 54 16.623 -9.170 5.586 1.00 0.00 H new ATOM 2710 N VAL B 75 15.888 -6.316 -0.559 1.00 0.00 N ATOM 2711 CA VAL B 75 14.959 -6.394 0.610 1.00 0.00 C ATOM 2712 C VAL B 75 13.564 -6.801 0.134 1.00 0.00 C ATOM 2713 O VAL B 75 13.313 -6.899 -1.052 1.00 0.00 O ATOM 2714 CB VAL B 75 14.963 -4.995 1.245 1.00 0.00 C ATOM 2715 CG1 VAL B 75 13.706 -4.212 0.847 1.00 0.00 C ATOM 2716 CG2 VAL B 75 15.002 -5.139 2.769 1.00 0.00 C ATOM 0 HA VAL B 75 15.269 -7.142 1.340 1.00 0.00 H new ATOM 0 HB VAL B 75 15.839 -4.452 0.891 1.00 0.00 H new ATOM 0 HG11 VAL B 75 13.731 -3.225 1.308 1.00 0.00 H new ATOM 0 HG12 VAL B 75 13.672 -4.105 -0.237 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.820 -4.749 1.187 1.00 0.00 H new ATOM 0 HG21 VAL B 75 15.005 -4.150 3.228 1.00 0.00 H new ATOM 0 HG22 VAL B 75 14.125 -5.692 3.105 1.00 0.00 H new ATOM 0 HG23 VAL B 75 15.904 -5.677 3.061 1.00 0.00 H new ATOM 2726 N GLY B 76 12.659 -7.049 1.037 1.00 0.00 N ATOM 2727 CA GLY B 76 11.295 -7.461 0.610 1.00 0.00 C ATOM 2728 C GLY B 76 10.289 -6.388 1.004 1.00 0.00 C ATOM 2729 O GLY B 76 9.460 -6.593 1.865 1.00 0.00 O ATOM 0 H GLY B 76 12.803 -6.985 2.045 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.272 -7.616 -0.469 1.00 0.00 H new ATOM 0 HA3 GLY B 76 11.029 -8.411 1.074 1.00 0.00 H new ATOM 2733 N VAL B 77 10.350 -5.245 0.375 1.00 0.00 N ATOM 2734 CA VAL B 77 9.381 -4.160 0.713 1.00 0.00 C ATOM 2735 C VAL B 77 7.960 -4.666 0.502 1.00 0.00 C ATOM 2736 O VAL B 77 7.310 -4.341 -0.470 1.00 0.00 O ATOM 2737 CB VAL B 77 9.703 -3.000 -0.248 1.00 0.00 C ATOM 2738 CG1 VAL B 77 9.807 -3.523 -1.689 1.00 0.00 C ATOM 2739 CG2 VAL B 77 8.591 -1.942 -0.174 1.00 0.00 C ATOM 0 H VAL B 77 11.025 -5.015 -0.355 1.00 0.00 H new ATOM 0 HA VAL B 77 9.460 -3.839 1.752 1.00 0.00 H new ATOM 0 HB VAL B 77 10.654 -2.555 0.044 1.00 0.00 H new ATOM 0 HG11 VAL B 77 10.035 -2.695 -2.361 1.00 0.00 H new ATOM 0 HG12 VAL B 77 10.600 -4.268 -1.749 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.860 -3.977 -1.981 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.822 -1.123 -0.855 1.00 0.00 H new ATOM 0 HG22 VAL B 77 7.640 -2.393 -0.458 1.00 0.00 H new ATOM 0 HG23 VAL B 77 8.521 -1.559 0.844 1.00 0.00 H new ATOM 2749 N SER B 78 7.479 -5.468 1.405 1.00 0.00 N ATOM 2750 CA SER B 78 6.104 -6.006 1.251 1.00 0.00 C ATOM 2751 C SER B 78 5.061 -4.946 1.619 1.00 0.00 C ATOM 2752 O SER B 78 5.379 -3.849 2.032 1.00 0.00 O ATOM 2753 CB SER B 78 6.031 -7.192 2.211 1.00 0.00 C ATOM 2754 OG SER B 78 4.670 -7.517 2.458 1.00 0.00 O ATOM 0 H SER B 78 7.977 -5.774 2.241 1.00 0.00 H new ATOM 0 HA SER B 78 5.895 -6.300 0.222 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.550 -8.051 1.785 1.00 0.00 H new ATOM 0 HB3 SER B 78 6.534 -6.948 3.147 1.00 0.00 H new ATOM 0 HG SER B 78 4.622 -8.279 3.072 1.00 0.00 H new ATOM 2760 N VAL B 79 3.817 -5.293 1.465 1.00 0.00 N ATOM 2761 CA VAL B 79 2.688 -4.368 1.783 1.00 0.00 C ATOM 2762 C VAL B 79 1.377 -5.074 1.420 1.00 0.00 C ATOM 2763 O VAL B 79 1.394 -6.167 0.885 1.00 0.00 O ATOM 2764 CB VAL B 79 2.909 -3.136 0.884 1.00 0.00 C ATOM 2765 CG1 VAL B 79 3.040 -3.580 -0.576 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.727 -2.170 1.012 1.00 0.00 C ATOM 0 H VAL B 79 3.523 -6.207 1.121 1.00 0.00 H new ATOM 0 HA VAL B 79 2.643 -4.083 2.834 1.00 0.00 H new ATOM 0 HB VAL B 79 3.822 -2.631 1.199 1.00 0.00 H new ATOM 0 HG11 VAL B 79 3.196 -2.707 -1.209 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.888 -4.257 -0.676 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.129 -4.093 -0.884 1.00 0.00 H new ATOM 0 HG21 VAL B 79 1.894 -1.303 0.372 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.810 -2.674 0.707 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.634 -1.844 2.048 1.00 0.00 H new ATOM 2776 N LYS B 80 0.243 -4.467 1.661 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.033 -5.122 1.276 1.00 0.00 C ATOM 2778 C LYS B 80 -2.214 -4.165 1.477 1.00 0.00 C ATOM 2779 O LYS B 80 -2.065 -3.093 2.026 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.155 -6.326 2.217 1.00 0.00 C ATOM 2781 CG LYS B 80 -1.209 -5.841 3.670 1.00 0.00 C ATOM 2782 CD LYS B 80 -1.380 -7.043 4.605 1.00 0.00 C ATOM 2783 CE LYS B 80 -0.063 -7.314 5.337 1.00 0.00 C ATOM 2784 NZ LYS B 80 0.030 -8.798 5.419 1.00 0.00 N ATOM 0 H LYS B 80 0.150 -3.553 2.105 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.043 -5.415 0.226 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.053 -6.896 1.980 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.307 -6.996 2.078 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.295 -5.301 3.918 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -2.037 -5.144 3.801 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -2.174 -6.847 5.325 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -1.678 -7.922 4.033 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.784 -6.894 4.795 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -0.062 -6.862 6.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 0.908 -9.064 5.909 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -0.786 -9.168 5.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 0.034 -9.199 4.459 1.00 0.00 H new ATOM 2798 N PRO B 81 -3.355 -4.615 1.038 1.00 0.00 N ATOM 2799 CA PRO B 81 -4.606 -3.853 1.164 1.00 0.00 C ATOM 2800 C PRO B 81 -5.402 -4.327 2.382 1.00 0.00 C ATOM 2801 O PRO B 81 -5.596 -5.511 2.581 1.00 0.00 O ATOM 2802 CB PRO B 81 -5.349 -4.236 -0.110 1.00 0.00 C ATOM 2803 CG PRO B 81 -4.804 -5.585 -0.505 1.00 0.00 C ATOM 2804 CD PRO B 81 -3.588 -5.868 0.348 1.00 0.00 C ATOM 0 HA PRO B 81 -4.450 -2.781 1.289 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -6.424 -4.282 0.062 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -5.183 -3.500 -0.897 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -5.559 -6.358 -0.360 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -4.538 -5.593 -1.562 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -3.771 -6.683 1.048 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -2.730 -6.156 -0.260 1.00 0.00 H new ATOM 2812 N GLY B 82 -5.885 -3.421 3.181 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.693 -3.834 4.365 1.00 0.00 C ATOM 2814 C GLY B 82 -8.161 -3.910 3.945 1.00 0.00 C ATOM 2815 O GLY B 82 -8.473 -3.931 2.770 1.00 0.00 O ATOM 0 H GLY B 82 -5.758 -2.415 3.069 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.354 -4.801 4.736 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.568 -3.119 5.178 1.00 0.00 H new ATOM 2819 N GLU B 83 -9.067 -3.948 4.882 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.510 -4.018 4.508 1.00 0.00 C ATOM 2821 C GLU B 83 -11.054 -2.618 4.219 1.00 0.00 C ATOM 2822 O GLU B 83 -12.081 -2.463 3.587 1.00 0.00 O ATOM 2823 CB GLU B 83 -11.223 -4.630 5.712 1.00 0.00 C ATOM 2824 CG GLU B 83 -10.968 -3.780 6.962 1.00 0.00 C ATOM 2825 CD GLU B 83 -10.049 -4.540 7.920 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -8.854 -4.561 7.673 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -10.555 -5.088 8.885 1.00 0.00 O ATOM 0 H GLU B 83 -8.875 -3.934 5.884 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.663 -4.613 3.608 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -12.294 -4.693 5.517 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -10.869 -5.648 5.876 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.513 -2.830 6.682 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -11.912 -3.548 7.455 1.00 0.00 H new ATOM 2834 N SER B 84 -10.373 -1.594 4.670 1.00 0.00 N ATOM 2835 CA SER B 84 -10.856 -0.204 4.409 1.00 0.00 C ATOM 2836 C SER B 84 -11.109 -0.026 2.911 1.00 0.00 C ATOM 2837 O SER B 84 -12.061 0.609 2.501 1.00 0.00 O ATOM 2838 CB SER B 84 -9.725 0.714 4.872 1.00 0.00 C ATOM 2839 OG SER B 84 -9.074 0.135 5.997 1.00 0.00 O ATOM 0 H SER B 84 -9.507 -1.660 5.205 1.00 0.00 H new ATOM 0 HA SER B 84 -11.788 0.017 4.930 1.00 0.00 H new ATOM 0 HB2 SER B 84 -9.010 0.865 4.063 1.00 0.00 H new ATOM 0 HB3 SER B 84 -10.122 1.695 5.133 1.00 0.00 H new ATOM 0 HG SER B 84 -8.583 0.829 6.484 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.268 -0.602 2.095 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.461 -0.488 0.622 1.00 0.00 C ATOM 2847 C LEU B 85 -11.548 -1.467 0.186 1.00 0.00 C ATOM 2848 O LEU B 85 -12.288 -1.216 -0.744 1.00 0.00 O ATOM 2849 CB LEU B 85 -9.126 -0.887 -0.025 1.00 0.00 C ATOM 2850 CG LEU B 85 -7.936 -0.269 0.724 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -6.889 -1.354 0.987 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -7.311 0.843 -0.126 1.00 0.00 C ATOM 0 H LEU B 85 -9.456 -1.146 2.385 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.756 0.520 0.331 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -9.032 -1.973 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -9.112 -0.562 -1.065 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.280 0.150 1.669 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.042 -0.921 1.519 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -7.330 -2.146 1.592 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.548 -1.769 0.038 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -6.467 1.279 0.409 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -6.965 0.427 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -8.056 1.615 -0.320 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.636 -2.590 0.849 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.662 -3.603 0.473 1.00 0.00 C ATOM 2866 C LYS B 86 -14.047 -3.141 0.893 1.00 0.00 C ATOM 2867 O LYS B 86 -14.989 -3.202 0.128 1.00 0.00 O ATOM 2868 CB LYS B 86 -12.267 -4.880 1.218 1.00 0.00 C ATOM 2869 CG LYS B 86 -12.043 -6.015 0.215 1.00 0.00 C ATOM 2870 CD LYS B 86 -11.202 -7.114 0.867 1.00 0.00 C ATOM 2871 CE LYS B 86 -11.516 -8.459 0.208 1.00 0.00 C ATOM 2872 NZ LYS B 86 -12.707 -8.976 0.938 1.00 0.00 N ATOM 0 H LYS B 86 -11.040 -2.848 1.636 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.699 -3.762 -0.605 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.359 -4.709 1.797 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -13.049 -5.156 1.926 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -13.001 -6.421 -0.111 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.539 -5.635 -0.673 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -10.142 -6.885 0.762 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -11.414 -7.163 1.935 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -11.726 -8.339 -0.855 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -10.673 -9.146 0.291 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -12.983 -9.897 0.543 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -12.475 -9.087 1.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -13.495 -8.305 0.836 1.00 0.00 H new ATOM 2886 N LYS B 87 -14.178 -2.651 2.087 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.504 -2.156 2.526 1.00 0.00 C ATOM 2888 C LYS B 87 -15.867 -0.994 1.612 1.00 0.00 C ATOM 2889 O LYS B 87 -16.990 -0.853 1.139 1.00 0.00 O ATOM 2890 CB LYS B 87 -15.309 -1.700 3.975 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.570 -0.981 4.470 1.00 0.00 C ATOM 2892 CD LYS B 87 -16.328 0.532 4.490 1.00 0.00 C ATOM 2893 CE LYS B 87 -17.546 1.253 3.908 1.00 0.00 C ATOM 2894 NZ LYS B 87 -17.707 2.475 4.745 1.00 0.00 N ATOM 0 H LYS B 87 -13.429 -2.572 2.775 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.302 -2.897 2.476 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -15.097 -2.560 4.611 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.449 -1.033 4.043 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -17.413 -1.216 3.820 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -16.831 -1.330 5.469 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -16.147 0.868 5.511 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -15.437 0.776 3.911 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -17.389 1.510 2.860 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -18.435 0.624 3.952 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -18.524 3.022 4.407 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -17.862 2.199 5.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -16.848 3.057 4.678 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.888 -0.199 1.296 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.139 0.908 0.360 1.00 0.00 C ATOM 2910 C ALA B 88 -15.447 0.279 -0.994 1.00 0.00 C ATOM 2911 O ALA B 88 -16.255 0.769 -1.759 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.837 1.711 0.329 1.00 0.00 C ATOM 0 H ALA B 88 -13.933 -0.273 1.647 1.00 0.00 H new ATOM 0 HA ALA B 88 -15.970 1.557 0.636 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -13.947 2.556 -0.350 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.611 2.077 1.331 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -13.024 1.072 -0.016 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.819 -0.837 -1.281 1.00 0.00 N ATOM 2919 CA ALA B 89 -15.081 -1.522 -2.578 1.00 0.00 C ATOM 2920 C ALA B 89 -16.567 -1.808 -2.695 1.00 0.00 C ATOM 2921 O ALA B 89 -17.179 -1.541 -3.711 1.00 0.00 O ATOM 2922 CB ALA B 89 -14.270 -2.816 -2.540 1.00 0.00 C ATOM 0 H ALA B 89 -14.141 -1.298 -0.674 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.795 -0.917 -3.438 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.420 -3.367 -3.468 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -13.212 -2.579 -2.426 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.598 -3.426 -1.699 1.00 0.00 H new ATOM 2928 N GLU B 90 -17.167 -2.300 -1.644 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.634 -2.536 -1.689 1.00 0.00 C ATOM 2930 C GLU B 90 -19.280 -1.218 -2.109 1.00 0.00 C ATOM 2931 O GLU B 90 -20.279 -1.182 -2.800 1.00 0.00 O ATOM 2932 CB GLU B 90 -19.035 -2.918 -0.263 1.00 0.00 C ATOM 2933 CG GLU B 90 -19.059 -4.441 -0.130 1.00 0.00 C ATOM 2934 CD GLU B 90 -19.812 -4.829 1.144 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -19.673 -4.123 2.129 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -20.516 -5.826 1.112 1.00 0.00 O ATOM 0 H GLU B 90 -16.709 -2.546 -0.767 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.939 -3.318 -2.385 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.330 -2.491 0.451 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -20.016 -2.506 -0.027 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -19.542 -4.885 -1.000 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -18.041 -4.830 -0.097 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.674 -0.129 -1.703 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.198 1.213 -2.084 1.00 0.00 C ATOM 2945 C GLY B 91 -19.099 1.410 -3.609 1.00 0.00 C ATOM 2946 O GLY B 91 -19.955 2.029 -4.208 1.00 0.00 O ATOM 0 H GLY B 91 -17.836 -0.115 -1.122 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.235 1.311 -1.764 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -18.632 1.991 -1.572 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.065 0.898 -4.250 1.00 0.00 N ATOM 2951 CA LEU B 92 -17.938 1.077 -5.731 1.00 0.00 C ATOM 2952 C LEU B 92 -18.902 0.154 -6.483 1.00 0.00 C ATOM 2953 O LEU B 92 -18.775 -0.035 -7.676 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.476 0.704 -6.045 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.341 -0.788 -6.400 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -16.343 -0.960 -7.923 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.025 -1.332 -5.832 1.00 0.00 C ATOM 0 H LEU B 92 -17.312 0.369 -3.811 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.185 2.092 -6.041 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.114 1.311 -6.875 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -15.848 0.933 -5.184 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.180 -1.336 -5.972 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -16.247 -2.017 -8.170 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -17.277 -0.575 -8.331 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -15.506 -0.410 -8.352 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -14.929 -2.388 -6.083 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.188 -0.780 -6.260 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -15.021 -1.215 -4.748 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.838 -0.457 -5.802 1.00 0.00 N ATOM 2970 CA LYS B 93 -20.758 -1.403 -6.499 1.00 0.00 C ATOM 2971 C LYS B 93 -19.901 -2.525 -7.078 1.00 0.00 C ATOM 2972 O LYS B 93 -20.098 -2.985 -8.186 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.454 -0.602 -7.609 1.00 0.00 C ATOM 2974 CG LYS B 93 -22.082 0.667 -7.019 1.00 0.00 C ATOM 2975 CD LYS B 93 -21.439 1.902 -7.655 1.00 0.00 C ATOM 2976 CE LYS B 93 -21.974 2.085 -9.078 1.00 0.00 C ATOM 2977 NZ LYS B 93 -20.766 2.321 -9.917 1.00 0.00 N ATOM 0 H LYS B 93 -20.004 -0.343 -4.802 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.509 -1.839 -5.840 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -20.735 -0.336 -8.384 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -22.223 -1.212 -8.083 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.157 0.671 -7.200 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -21.940 0.686 -5.938 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -21.657 2.787 -7.057 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -20.355 1.790 -7.675 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -22.519 1.202 -9.411 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -22.664 2.926 -9.135 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -21.052 2.456 -10.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -20.271 3.172 -9.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -20.130 1.501 -9.849 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.924 -2.941 -6.312 1.00 0.00 N ATOM 2992 CA TYR B 94 -17.989 -4.017 -6.750 1.00 0.00 C ATOM 2993 C TYR B 94 -18.728 -5.104 -7.547 1.00 0.00 C ATOM 2994 O TYR B 94 -18.217 -5.631 -8.516 1.00 0.00 O ATOM 2995 CB TYR B 94 -17.408 -4.564 -5.437 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.925 -5.950 -5.177 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -17.319 -7.041 -5.802 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -19.021 -6.135 -4.335 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -17.813 -8.331 -5.586 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -19.515 -7.424 -4.112 1.00 0.00 C ATOM 3001 CZ TYR B 94 -18.913 -8.523 -4.739 1.00 0.00 C ATOM 3002 OH TYR B 94 -19.408 -9.791 -4.523 1.00 0.00 O ATOM 0 H TYR B 94 -18.733 -2.570 -5.381 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.211 -3.653 -7.421 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -16.319 -4.579 -5.491 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -17.677 -3.907 -4.610 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.470 -6.889 -6.452 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -19.487 -5.286 -3.857 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -17.348 -9.177 -6.070 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -20.360 -7.572 -3.457 1.00 0.00 H new ATOM 0 HH TYR B 94 -20.171 -9.744 -3.909 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.926 -5.438 -7.145 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.694 -6.485 -7.884 1.00 0.00 C ATOM 3014 C GLU B 95 -20.942 -6.030 -9.322 1.00 0.00 C ATOM 3015 O GLU B 95 -20.782 -6.790 -10.258 1.00 0.00 O ATOM 3016 CB GLU B 95 -22.012 -6.650 -7.123 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.784 -5.328 -7.112 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.912 -5.403 -6.082 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -24.585 -6.420 -6.042 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -24.083 -4.443 -5.349 1.00 0.00 O ATOM 0 H GLU B 95 -20.405 -5.033 -6.340 1.00 0.00 H new ATOM 0 HA GLU B 95 -20.154 -7.430 -7.938 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.615 -7.428 -7.590 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -21.813 -6.972 -6.101 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -22.112 -4.504 -6.871 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -23.194 -5.126 -8.102 1.00 0.00 H new ATOM 3027 N ASP B 96 -21.303 -4.788 -9.509 1.00 0.00 N ATOM 3028 CA ASP B 96 -21.527 -4.282 -10.893 1.00 0.00 C ATOM 3029 C ASP B 96 -20.232 -4.456 -11.683 1.00 0.00 C ATOM 3030 O ASP B 96 -20.238 -4.740 -12.865 1.00 0.00 O ATOM 3031 CB ASP B 96 -21.871 -2.799 -10.737 1.00 0.00 C ATOM 3032 CG ASP B 96 -23.370 -2.649 -10.476 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -24.137 -3.347 -11.118 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -23.727 -1.836 -9.639 1.00 0.00 O ATOM 0 H ASP B 96 -21.452 -4.105 -8.766 1.00 0.00 H new ATOM 0 HA ASP B 96 -22.321 -4.811 -11.420 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -21.302 -2.367 -9.913 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -21.591 -2.253 -11.638 1.00 0.00 H new ATOM 3039 N PHE B 97 -19.120 -4.315 -11.013 1.00 0.00 N ATOM 3040 CA PHE B 97 -17.806 -4.500 -11.690 1.00 0.00 C ATOM 3041 C PHE B 97 -17.602 -5.988 -11.983 1.00 0.00 C ATOM 3042 O PHE B 97 -16.906 -6.365 -12.906 1.00 0.00 O ATOM 3043 CB PHE B 97 -16.769 -4.002 -10.679 1.00 0.00 C ATOM 3044 CG PHE B 97 -15.820 -3.039 -11.348 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -16.271 -1.778 -11.753 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -14.485 -3.405 -11.558 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -15.388 -0.883 -12.371 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -13.601 -2.513 -12.173 1.00 0.00 C ATOM 3049 CZ PHE B 97 -14.052 -1.251 -12.580 1.00 0.00 C ATOM 0 H PHE B 97 -19.066 -4.079 -10.022 1.00 0.00 H new ATOM 0 HA PHE B 97 -17.733 -3.964 -12.636 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -17.269 -3.512 -9.844 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -16.215 -4.846 -10.268 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -17.300 -1.494 -11.589 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.137 -4.378 -11.244 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -15.736 0.089 -12.686 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.571 -2.797 -12.334 1.00 0.00 H new ATOM 0 HZ PHE B 97 -13.370 -0.561 -13.055 1.00 0.00 H new