USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 HIS : no HE2:sc= -0.453 K(o=0.44,f=-11!) USER MOD Set 1.2: B 69 ASN : amide:sc= 0.896 K(o=0.44,f=-13!) USER MOD Set 2.1: A 24 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Set 2.2: B 31 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: B 9 HIS : no HD1:sc= 2.01 K(o=-2,f=-12!) USER MOD Set 3.2: B 15 CYS SG : rot 124:sc= -4.02! USER MOD Set 4.1: A 69 ASN : amide:sc= 1.92 K(o=2.4,f=-14!) USER MOD Set 4.2: B 67 HIS : no HE2:sc= 0.457 K(o=2.4,f=-12!) USER MOD Set 5.1: A 37 HIS : no HD1:sc= 0.465 K(o=1.6,f=-4.3) USER MOD Set 5.2: A 40 THR OG1 : rot 53:sc= 1.1 USER MOD Single : A 1 VAL N :NH3+ -165:sc= -0.0776 (180deg=-0.442) USER MOD Single : A 3 SER OG : rot -160:sc= 1.3 USER MOD Single : A 4 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.15) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= 1.05 K(o=1,f=-5.1!) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.304 USER MOD Single : A 15 CYS SG : rot -20:sc= -4.78! USER MOD Single : A 17 SER OG : rot -73:sc= 0.626 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -129:sc= 1.27 (180deg=0.414) USER MOD Single : A 31 TYR OH : rot 20:sc= 0.0409 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ -119:sc= 0.326 (180deg=-0.0587) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 140:sc= -0.0068 USER MOD Single : A 78 LYS NZ :NH3+ -178:sc= 2.36 (180deg=2.23) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : B 1 VAL N :NH3+ -150:sc= -0.106 (180deg=-0.603) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 TYR OH : rot 180:sc= 0 USER MOD Single : B 12 CYS SG : rot 180:sc= 0.00782 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 20 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 24 ASN :FLIP amide:sc= 0.0734 F(o=-1.6!,f=0.073) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ 158:sc= 0.905 (180deg=-0.218!) USER MOD Single : B 32 THR OG1 : rot 115:sc= -0.136 USER MOD Single : B 37 HIS : no HD1:sc= 0.94 K(o=0.94,f=-6.9!) USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ -168:sc= 1.24 (180deg=1.15) USER MOD Single : B 50 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0101) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot -156:sc= 0.368 USER MOD Single : B 78 LYS NZ :NH3+ -157:sc= 2.33 (180deg=1.26!) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 25.398 18.137 -12.223 1.00 0.00 N ATOM 2 CA VAL A 1 25.206 16.749 -12.701 1.00 0.00 C ATOM 3 C VAL A 1 25.749 15.761 -11.679 1.00 0.00 C ATOM 4 O VAL A 1 24.995 15.004 -11.076 1.00 0.00 O ATOM 5 CB VAL A 1 25.907 16.510 -14.056 1.00 0.00 C ATOM 6 CG1 VAL A 1 25.659 15.093 -14.554 1.00 0.00 C ATOM 7 CG2 VAL A 1 25.441 17.526 -15.083 1.00 0.00 C ATOM 0 H1 VAL A 1 24.811 18.783 -12.788 1.00 0.00 H new ATOM 0 H2 VAL A 1 25.120 18.201 -11.223 1.00 0.00 H new ATOM 0 H3 VAL A 1 26.399 18.403 -12.322 1.00 0.00 H new ATOM 0 HA VAL A 1 24.135 16.597 -12.834 1.00 0.00 H new ATOM 0 HB VAL A 1 26.980 16.634 -13.909 1.00 0.00 H new ATOM 0 HG11 VAL A 1 26.163 14.950 -15.510 1.00 0.00 H new ATOM 0 HG12 VAL A 1 26.048 14.379 -13.828 1.00 0.00 H new ATOM 0 HG13 VAL A 1 24.588 14.934 -14.681 1.00 0.00 H new ATOM 0 HG21 VAL A 1 25.946 17.342 -16.032 1.00 0.00 H new ATOM 0 HG22 VAL A 1 24.364 17.435 -15.221 1.00 0.00 H new ATOM 0 HG23 VAL A 1 25.679 18.531 -14.734 1.00 0.00 H new ATOM 19 N ALA A 2 27.059 15.786 -11.476 1.00 0.00 N ATOM 20 CA ALA A 2 27.699 14.903 -10.517 1.00 0.00 C ATOM 21 C ALA A 2 28.072 15.681 -9.265 1.00 0.00 C ATOM 22 O ALA A 2 29.246 15.795 -8.912 1.00 0.00 O ATOM 23 CB ALA A 2 28.925 14.244 -11.133 1.00 0.00 C ATOM 0 H ALA A 2 27.699 16.411 -11.966 1.00 0.00 H new ATOM 0 HA ALA A 2 26.999 14.115 -10.240 1.00 0.00 H new ATOM 0 HB1 ALA A 2 29.391 13.586 -10.400 1.00 0.00 H new ATOM 0 HB2 ALA A 2 28.626 13.662 -12.005 1.00 0.00 H new ATOM 0 HB3 ALA A 2 29.637 15.012 -11.436 1.00 0.00 H new ATOM 29 N SER A 3 27.063 16.229 -8.608 1.00 0.00 N ATOM 30 CA SER A 3 27.272 17.041 -7.425 1.00 0.00 C ATOM 31 C SER A 3 27.300 16.175 -6.173 1.00 0.00 C ATOM 32 O SER A 3 27.171 14.950 -6.247 1.00 0.00 O ATOM 33 CB SER A 3 26.172 18.095 -7.324 1.00 0.00 C ATOM 34 OG SER A 3 24.893 17.513 -7.505 1.00 0.00 O ATOM 0 H SER A 3 26.085 16.124 -8.878 1.00 0.00 H new ATOM 0 HA SER A 3 28.237 17.541 -7.508 1.00 0.00 H new ATOM 0 HB2 SER A 3 26.219 18.583 -6.350 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.334 18.868 -8.076 1.00 0.00 H new ATOM 0 HG SER A 3 24.249 18.209 -7.753 1.00 0.00 H new ATOM 40 N LYS A 4 27.482 16.812 -5.028 1.00 0.00 N ATOM 41 CA LYS A 4 27.548 16.100 -3.767 1.00 0.00 C ATOM 42 C LYS A 4 26.156 15.799 -3.217 1.00 0.00 C ATOM 43 O LYS A 4 25.272 16.656 -3.209 1.00 0.00 O ATOM 44 CB LYS A 4 28.353 16.903 -2.742 1.00 0.00 C ATOM 45 CG LYS A 4 28.414 16.235 -1.381 1.00 0.00 C ATOM 46 CD LYS A 4 29.337 16.969 -0.426 1.00 0.00 C ATOM 47 CE LYS A 4 29.481 16.202 0.875 1.00 0.00 C ATOM 48 NZ LYS A 4 30.392 16.876 1.833 1.00 0.00 N ATOM 0 H LYS A 4 27.587 17.823 -4.948 1.00 0.00 H new ATOM 0 HA LYS A 4 28.049 15.150 -3.953 1.00 0.00 H new ATOM 0 HB2 LYS A 4 29.367 17.046 -3.116 1.00 0.00 H new ATOM 0 HB3 LYS A 4 27.910 17.893 -2.635 1.00 0.00 H new ATOM 0 HG2 LYS A 4 27.412 16.191 -0.954 1.00 0.00 H new ATOM 0 HG3 LYS A 4 28.757 15.207 -1.497 1.00 0.00 H new ATOM 0 HD2 LYS A 4 30.316 17.100 -0.887 1.00 0.00 H new ATOM 0 HD3 LYS A 4 28.943 17.965 -0.225 1.00 0.00 H new ATOM 0 HE2 LYS A 4 28.499 16.083 1.334 1.00 0.00 H new ATOM 0 HE3 LYS A 4 29.857 15.201 0.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 30.564 16.251 2.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 31.295 17.089 1.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 29.956 17.761 2.162 1.00 0.00 H new ATOM 62 N ALA A 5 25.978 14.568 -2.766 1.00 0.00 N ATOM 63 CA ALA A 5 24.765 14.155 -2.087 1.00 0.00 C ATOM 64 C ALA A 5 25.120 13.656 -0.692 1.00 0.00 C ATOM 65 O ALA A 5 25.758 12.616 -0.544 1.00 0.00 O ATOM 66 CB ALA A 5 24.051 13.073 -2.885 1.00 0.00 C ATOM 0 H ALA A 5 26.673 13.827 -2.862 1.00 0.00 H new ATOM 0 HA ALA A 5 24.088 15.005 -2.000 1.00 0.00 H new ATOM 0 HB1 ALA A 5 23.143 12.774 -2.361 1.00 0.00 H new ATOM 0 HB2 ALA A 5 23.791 13.459 -3.871 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.707 12.209 -2.995 1.00 0.00 H new ATOM 72 N ILE A 6 24.733 14.409 0.325 1.00 0.00 N ATOM 73 CA ILE A 6 25.150 14.109 1.690 1.00 0.00 C ATOM 74 C ILE A 6 24.051 13.370 2.444 1.00 0.00 C ATOM 75 O ILE A 6 22.990 13.927 2.707 1.00 0.00 O ATOM 76 CB ILE A 6 25.508 15.389 2.473 1.00 0.00 C ATOM 77 CG1 ILE A 6 26.007 16.485 1.526 1.00 0.00 C ATOM 78 CG2 ILE A 6 26.571 15.072 3.517 1.00 0.00 C ATOM 79 CD1 ILE A 6 26.250 17.816 2.207 1.00 0.00 C ATOM 0 H ILE A 6 24.134 15.229 0.235 1.00 0.00 H new ATOM 0 HA ILE A 6 26.036 13.479 1.614 1.00 0.00 H new ATOM 0 HB ILE A 6 24.611 15.755 2.972 1.00 0.00 H new ATOM 0 HG12 ILE A 6 26.933 16.153 1.057 1.00 0.00 H new ATOM 0 HG13 ILE A 6 25.277 16.623 0.728 1.00 0.00 H new ATOM 0 HG21 ILE A 6 26.821 15.978 4.068 1.00 0.00 H new ATOM 0 HG22 ILE A 6 26.189 14.321 4.208 1.00 0.00 H new ATOM 0 HG23 ILE A 6 27.464 14.690 3.023 1.00 0.00 H new ATOM 0 HD11 ILE A 6 26.601 18.541 1.473 1.00 0.00 H new ATOM 0 HD12 ILE A 6 25.321 18.172 2.653 1.00 0.00 H new ATOM 0 HD13 ILE A 6 27.003 17.694 2.986 1.00 0.00 H new ATOM 91 N PHE A 7 24.312 12.125 2.799 1.00 0.00 N ATOM 92 CA PHE A 7 23.323 11.308 3.484 1.00 0.00 C ATOM 93 C PHE A 7 23.612 11.258 4.981 1.00 0.00 C ATOM 94 O PHE A 7 24.581 10.640 5.417 1.00 0.00 O ATOM 95 CB PHE A 7 23.305 9.894 2.892 1.00 0.00 C ATOM 96 CG PHE A 7 22.228 9.007 3.455 1.00 0.00 C ATOM 97 CD1 PHE A 7 20.890 9.328 3.293 1.00 0.00 C ATOM 98 CD2 PHE A 7 22.555 7.846 4.136 1.00 0.00 C ATOM 99 CE1 PHE A 7 19.899 8.510 3.801 1.00 0.00 C ATOM 100 CE2 PHE A 7 21.568 7.023 4.646 1.00 0.00 C ATOM 101 CZ PHE A 7 20.239 7.356 4.478 1.00 0.00 C ATOM 0 H PHE A 7 25.201 11.656 2.625 1.00 0.00 H new ATOM 0 HA PHE A 7 22.341 11.758 3.342 1.00 0.00 H new ATOM 0 HB2 PHE A 7 23.175 9.965 1.812 1.00 0.00 H new ATOM 0 HB3 PHE A 7 24.274 9.426 3.066 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.618 10.229 2.763 1.00 0.00 H new ATOM 0 HD2 PHE A 7 23.593 7.580 4.270 1.00 0.00 H new ATOM 0 HE1 PHE A 7 18.860 8.773 3.669 1.00 0.00 H new ATOM 0 HE2 PHE A 7 21.837 6.121 5.175 1.00 0.00 H new ATOM 0 HZ PHE A 7 19.466 6.715 4.876 1.00 0.00 H new ATOM 111 N TYR A 8 22.774 11.927 5.757 1.00 0.00 N ATOM 112 CA TYR A 8 22.910 11.939 7.206 1.00 0.00 C ATOM 113 C TYR A 8 21.926 10.961 7.832 1.00 0.00 C ATOM 114 O TYR A 8 20.724 11.023 7.564 1.00 0.00 O ATOM 115 CB TYR A 8 22.651 13.344 7.766 1.00 0.00 C ATOM 116 CG TYR A 8 23.727 14.359 7.443 1.00 0.00 C ATOM 117 CD1 TYR A 8 24.836 14.501 8.265 1.00 0.00 C ATOM 118 CD2 TYR A 8 23.629 15.183 6.328 1.00 0.00 C ATOM 119 CE1 TYR A 8 25.818 15.432 7.989 1.00 0.00 C ATOM 120 CE2 TYR A 8 24.606 16.119 6.046 1.00 0.00 C ATOM 121 CZ TYR A 8 25.699 16.238 6.879 1.00 0.00 C ATOM 122 OH TYR A 8 26.678 17.168 6.603 1.00 0.00 O ATOM 0 H TYR A 8 21.987 12.472 5.405 1.00 0.00 H new ATOM 0 HA TYR A 8 23.929 11.642 7.452 1.00 0.00 H new ATOM 0 HB2 TYR A 8 21.699 13.706 7.377 1.00 0.00 H new ATOM 0 HB3 TYR A 8 22.547 13.276 8.849 1.00 0.00 H new ATOM 0 HD1 TYR A 8 24.933 13.871 9.137 1.00 0.00 H new ATOM 0 HD2 TYR A 8 22.776 15.090 5.672 1.00 0.00 H new ATOM 0 HE1 TYR A 8 26.674 15.527 8.640 1.00 0.00 H new ATOM 0 HE2 TYR A 8 24.514 16.754 5.177 1.00 0.00 H new ATOM 0 HH TYR A 8 26.445 17.655 5.785 1.00 0.00 H new ATOM 132 N HIS A 9 22.429 10.057 8.661 1.00 0.00 N ATOM 133 CA HIS A 9 21.567 9.097 9.335 1.00 0.00 C ATOM 134 C HIS A 9 22.162 8.681 10.679 1.00 0.00 C ATOM 135 O HIS A 9 23.212 9.184 11.083 1.00 0.00 O ATOM 136 CB HIS A 9 21.317 7.873 8.446 1.00 0.00 C ATOM 137 CG HIS A 9 22.489 6.951 8.286 1.00 0.00 C ATOM 138 ND1 HIS A 9 22.520 5.736 8.917 1.00 0.00 N ATOM 139 CD2 HIS A 9 23.613 7.094 7.549 1.00 0.00 C ATOM 140 CE1 HIS A 9 23.651 5.163 8.549 1.00 0.00 C ATOM 141 NE2 HIS A 9 24.349 5.947 7.718 1.00 0.00 N ATOM 0 H HIS A 9 23.421 9.968 8.882 1.00 0.00 H new ATOM 0 HA HIS A 9 20.608 9.579 9.526 1.00 0.00 H new ATOM 0 HB2 HIS A 9 20.483 7.307 8.861 1.00 0.00 H new ATOM 0 HB3 HIS A 9 21.008 8.217 7.459 1.00 0.00 H new ATOM 0 HD2 HIS A 9 23.881 7.947 6.943 1.00 0.00 H new ATOM 0 HE1 HIS A 9 23.972 4.185 8.877 1.00 0.00 H new ATOM 0 HE2 HIS A 9 25.252 5.734 7.293 1.00 0.00 H new ATOM 149 N ALA A 10 21.487 7.764 11.367 1.00 0.00 N ATOM 150 CA ALA A 10 21.911 7.344 12.698 1.00 0.00 C ATOM 151 C ALA A 10 22.057 5.826 12.794 1.00 0.00 C ATOM 152 O ALA A 10 22.098 5.270 13.889 1.00 0.00 O ATOM 153 CB ALA A 10 20.921 7.847 13.740 1.00 0.00 C ATOM 0 H ALA A 10 20.646 7.299 11.025 1.00 0.00 H new ATOM 0 HA ALA A 10 22.892 7.779 12.890 1.00 0.00 H new ATOM 0 HB1 ALA A 10 21.244 7.530 14.732 1.00 0.00 H new ATOM 0 HB2 ALA A 10 20.876 8.935 13.704 1.00 0.00 H new ATOM 0 HB3 ALA A 10 19.933 7.436 13.531 1.00 0.00 H new ATOM 159 N GLY A 11 22.142 5.163 11.648 1.00 0.00 N ATOM 160 CA GLY A 11 22.342 3.722 11.632 1.00 0.00 C ATOM 161 C GLY A 11 21.071 2.944 11.906 1.00 0.00 C ATOM 162 O GLY A 11 21.113 1.747 12.189 1.00 0.00 O ATOM 0 H GLY A 11 22.076 5.596 10.727 1.00 0.00 H new ATOM 0 HA2 GLY A 11 22.740 3.427 10.661 1.00 0.00 H new ATOM 0 HA3 GLY A 11 23.092 3.457 12.378 1.00 0.00 H new ATOM 166 N CYS A 12 19.939 3.621 11.813 1.00 0.00 N ATOM 167 CA CYS A 12 18.650 2.997 12.071 1.00 0.00 C ATOM 168 C CYS A 12 18.248 2.093 10.904 1.00 0.00 C ATOM 169 O CYS A 12 18.691 2.304 9.775 1.00 0.00 O ATOM 170 CB CYS A 12 17.595 4.084 12.287 1.00 0.00 C ATOM 171 SG CYS A 12 18.080 5.342 13.490 1.00 0.00 S ATOM 0 H CYS A 12 19.886 4.608 11.560 1.00 0.00 H new ATOM 0 HA CYS A 12 18.725 2.382 12.968 1.00 0.00 H new ATOM 0 HB2 CYS A 12 17.385 4.568 11.333 1.00 0.00 H new ATOM 0 HB3 CYS A 12 16.668 3.617 12.618 1.00 0.00 H new ATOM 0 HG CYS A 12 17.129 6.221 13.606 1.00 0.00 H new ATOM 177 N PRO A 13 17.404 1.073 11.160 1.00 0.00 N ATOM 178 CA PRO A 13 16.918 0.157 10.116 1.00 0.00 C ATOM 179 C PRO A 13 16.285 0.905 8.943 1.00 0.00 C ATOM 180 O PRO A 13 16.403 0.493 7.788 1.00 0.00 O ATOM 181 CB PRO A 13 15.867 -0.703 10.836 1.00 0.00 C ATOM 182 CG PRO A 13 15.606 -0.016 12.136 1.00 0.00 C ATOM 183 CD PRO A 13 16.869 0.714 12.481 1.00 0.00 C ATOM 0 HA PRO A 13 17.730 -0.427 9.682 1.00 0.00 H new ATOM 0 HB2 PRO A 13 14.955 -0.783 10.245 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.233 -1.717 10.995 1.00 0.00 H new ATOM 0 HG2 PRO A 13 14.767 0.675 12.050 1.00 0.00 H new ATOM 0 HG3 PRO A 13 15.347 -0.736 12.912 1.00 0.00 H new ATOM 0 HD2 PRO A 13 16.674 1.595 13.092 1.00 0.00 H new ATOM 0 HD3 PRO A 13 17.561 0.085 13.041 1.00 0.00 H new ATOM 191 N VAL A 14 15.630 2.018 9.252 1.00 0.00 N ATOM 192 CA VAL A 14 15.023 2.869 8.235 1.00 0.00 C ATOM 193 C VAL A 14 16.091 3.410 7.285 1.00 0.00 C ATOM 194 O VAL A 14 15.890 3.480 6.071 1.00 0.00 O ATOM 195 CB VAL A 14 14.270 4.052 8.884 1.00 0.00 C ATOM 196 CG1 VAL A 14 13.592 4.911 7.828 1.00 0.00 C ATOM 197 CG2 VAL A 14 13.254 3.548 9.897 1.00 0.00 C ATOM 0 H VAL A 14 15.505 2.354 10.207 1.00 0.00 H new ATOM 0 HA VAL A 14 14.312 2.262 7.674 1.00 0.00 H new ATOM 0 HB VAL A 14 14.999 4.671 9.406 1.00 0.00 H new ATOM 0 HG11 VAL A 14 13.069 5.736 8.311 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.343 5.307 7.144 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.877 4.306 7.270 1.00 0.00 H new ATOM 0 HG21 VAL A 14 12.734 4.396 10.343 1.00 0.00 H new ATOM 0 HG22 VAL A 14 12.532 2.901 9.398 1.00 0.00 H new ATOM 0 HG23 VAL A 14 13.766 2.985 10.677 1.00 0.00 H new ATOM 207 N CYS A 15 17.238 3.758 7.850 1.00 0.00 N ATOM 208 CA CYS A 15 18.343 4.309 7.082 1.00 0.00 C ATOM 209 C CYS A 15 18.947 3.239 6.176 1.00 0.00 C ATOM 210 O CYS A 15 19.380 3.530 5.061 1.00 0.00 O ATOM 211 CB CYS A 15 19.404 4.856 8.035 1.00 0.00 C ATOM 212 SG CYS A 15 18.735 5.892 9.361 1.00 0.00 S ATOM 0 H CYS A 15 17.428 3.667 8.848 1.00 0.00 H new ATOM 0 HA CYS A 15 17.972 5.120 6.455 1.00 0.00 H new ATOM 0 HB2 CYS A 15 19.946 4.020 8.478 1.00 0.00 H new ATOM 0 HB3 CYS A 15 20.127 5.437 7.463 1.00 0.00 H new ATOM 0 HG CYS A 15 17.556 6.322 9.023 1.00 0.00 H new ATOM 218 N VAL A 16 18.955 2.000 6.663 1.00 0.00 N ATOM 219 CA VAL A 16 19.475 0.870 5.897 1.00 0.00 C ATOM 220 C VAL A 16 18.693 0.697 4.600 1.00 0.00 C ATOM 221 O VAL A 16 19.275 0.556 3.525 1.00 0.00 O ATOM 222 CB VAL A 16 19.398 -0.442 6.707 1.00 0.00 C ATOM 223 CG1 VAL A 16 20.049 -1.589 5.947 1.00 0.00 C ATOM 224 CG2 VAL A 16 20.041 -0.266 8.070 1.00 0.00 C ATOM 0 H VAL A 16 18.606 1.753 7.589 1.00 0.00 H new ATOM 0 HA VAL A 16 20.519 1.086 5.672 1.00 0.00 H new ATOM 0 HB VAL A 16 18.347 -0.690 6.854 1.00 0.00 H new ATOM 0 HG11 VAL A 16 19.982 -2.502 6.539 1.00 0.00 H new ATOM 0 HG12 VAL A 16 19.535 -1.734 4.997 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.097 -1.354 5.761 1.00 0.00 H new ATOM 0 HG21 VAL A 16 19.977 -1.201 8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 16 21.088 0.011 7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 16 19.521 0.519 8.619 1.00 0.00 H new ATOM 234 N SER A 17 17.371 0.722 4.714 1.00 0.00 N ATOM 235 CA SER A 17 16.498 0.594 3.556 1.00 0.00 C ATOM 236 C SER A 17 16.769 1.723 2.562 1.00 0.00 C ATOM 237 O SER A 17 16.879 1.492 1.355 1.00 0.00 O ATOM 238 CB SER A 17 15.031 0.608 4.005 1.00 0.00 C ATOM 239 OG SER A 17 14.150 0.350 2.926 1.00 0.00 O ATOM 0 H SER A 17 16.879 0.830 5.601 1.00 0.00 H new ATOM 0 HA SER A 17 16.701 -0.355 3.059 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.882 -0.140 4.784 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.794 1.577 4.444 1.00 0.00 H new ATOM 0 HG SER A 17 14.114 1.134 2.339 1.00 0.00 H new ATOM 245 N ALA A 18 16.908 2.940 3.080 1.00 0.00 N ATOM 246 CA ALA A 18 17.187 4.101 2.245 1.00 0.00 C ATOM 247 C ALA A 18 18.523 3.948 1.521 1.00 0.00 C ATOM 248 O ALA A 18 18.641 4.274 0.341 1.00 0.00 O ATOM 249 CB ALA A 18 17.181 5.369 3.086 1.00 0.00 C ATOM 0 H ALA A 18 16.832 3.147 4.076 1.00 0.00 H new ATOM 0 HA ALA A 18 16.402 4.175 1.492 1.00 0.00 H new ATOM 0 HB1 ALA A 18 17.391 6.229 2.450 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.203 5.492 3.552 1.00 0.00 H new ATOM 0 HB3 ALA A 18 17.945 5.296 3.860 1.00 0.00 H new ATOM 255 N GLU A 19 19.518 3.438 2.229 1.00 0.00 N ATOM 256 CA GLU A 19 20.845 3.246 1.660 1.00 0.00 C ATOM 257 C GLU A 19 20.830 2.172 0.573 1.00 0.00 C ATOM 258 O GLU A 19 21.319 2.386 -0.535 1.00 0.00 O ATOM 259 CB GLU A 19 21.834 2.855 2.757 1.00 0.00 C ATOM 260 CG GLU A 19 23.256 2.670 2.257 1.00 0.00 C ATOM 261 CD GLU A 19 24.175 2.105 3.318 1.00 0.00 C ATOM 262 OE1 GLU A 19 24.702 2.882 4.138 1.00 0.00 O ATOM 263 OE2 GLU A 19 24.382 0.875 3.333 1.00 0.00 O ATOM 0 H GLU A 19 19.432 3.148 3.203 1.00 0.00 H new ATOM 0 HA GLU A 19 21.156 4.188 1.208 1.00 0.00 H new ATOM 0 HB2 GLU A 19 21.827 3.622 3.531 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.499 1.929 3.224 1.00 0.00 H new ATOM 0 HG2 GLU A 19 23.250 2.004 1.394 1.00 0.00 H new ATOM 0 HG3 GLU A 19 23.646 3.629 1.917 1.00 0.00 H new ATOM 270 N GLN A 20 20.247 1.026 0.887 1.00 0.00 N ATOM 271 CA GLN A 20 20.300 -0.127 -0.005 1.00 0.00 C ATOM 272 C GLN A 20 19.327 -0.005 -1.178 1.00 0.00 C ATOM 273 O GLN A 20 19.381 -0.805 -2.109 1.00 0.00 O ATOM 274 CB GLN A 20 20.028 -1.413 0.777 1.00 0.00 C ATOM 275 CG GLN A 20 21.097 -1.725 1.813 1.00 0.00 C ATOM 276 CD GLN A 20 20.817 -2.999 2.586 1.00 0.00 C ATOM 277 OE1 GLN A 20 19.663 -3.372 2.800 1.00 0.00 O ATOM 278 NE2 GLN A 20 21.872 -3.677 3.010 1.00 0.00 N ATOM 0 H GLN A 20 19.731 0.867 1.752 1.00 0.00 H new ATOM 0 HA GLN A 20 21.305 -0.162 -0.425 1.00 0.00 H new ATOM 0 HB2 GLN A 20 19.062 -1.329 1.275 1.00 0.00 H new ATOM 0 HB3 GLN A 20 19.955 -2.246 0.078 1.00 0.00 H new ATOM 0 HG2 GLN A 20 22.063 -1.813 1.316 1.00 0.00 H new ATOM 0 HG3 GLN A 20 21.173 -0.892 2.511 1.00 0.00 H new ATOM 0 HE21 GLN A 20 22.812 -3.334 2.812 1.00 0.00 H new ATOM 0 HE22 GLN A 20 21.745 -4.542 3.535 1.00 0.00 H new ATOM 287 N ALA A 21 18.442 0.985 -1.141 1.00 0.00 N ATOM 288 CA ALA A 21 17.485 1.172 -2.228 1.00 0.00 C ATOM 289 C ALA A 21 17.634 2.538 -2.894 1.00 0.00 C ATOM 290 O ALA A 21 17.876 2.624 -4.097 1.00 0.00 O ATOM 291 CB ALA A 21 16.066 0.977 -1.723 1.00 0.00 C ATOM 0 H ALA A 21 18.366 1.662 -0.382 1.00 0.00 H new ATOM 0 HA ALA A 21 17.699 0.418 -2.985 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.364 1.120 -2.545 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.957 -0.031 -1.324 1.00 0.00 H new ATOM 0 HB3 ALA A 21 15.857 1.703 -0.937 1.00 0.00 H new ATOM 297 N VAL A 22 17.503 3.606 -2.116 1.00 0.00 N ATOM 298 CA VAL A 22 17.566 4.958 -2.663 1.00 0.00 C ATOM 299 C VAL A 22 18.979 5.283 -3.138 1.00 0.00 C ATOM 300 O VAL A 22 19.172 5.769 -4.252 1.00 0.00 O ATOM 301 CB VAL A 22 17.112 6.017 -1.636 1.00 0.00 C ATOM 302 CG1 VAL A 22 17.109 7.407 -2.257 1.00 0.00 C ATOM 303 CG2 VAL A 22 15.736 5.676 -1.087 1.00 0.00 C ATOM 0 H VAL A 22 17.353 3.564 -1.108 1.00 0.00 H new ATOM 0 HA VAL A 22 16.881 4.989 -3.510 1.00 0.00 H new ATOM 0 HB VAL A 22 17.823 6.014 -0.810 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.786 8.137 -1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 22 18.114 7.656 -2.597 1.00 0.00 H new ATOM 0 HG13 VAL A 22 16.425 7.425 -3.105 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.434 6.435 -0.365 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.015 5.646 -1.904 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.770 4.703 -0.598 1.00 0.00 H new ATOM 313 N ALA A 23 19.967 4.981 -2.303 1.00 0.00 N ATOM 314 CA ALA A 23 21.364 5.211 -2.659 1.00 0.00 C ATOM 315 C ALA A 23 21.848 4.155 -3.650 1.00 0.00 C ATOM 316 O ALA A 23 22.987 4.188 -4.113 1.00 0.00 O ATOM 317 CB ALA A 23 22.240 5.227 -1.414 1.00 0.00 C ATOM 0 H ALA A 23 19.828 4.577 -1.377 1.00 0.00 H new ATOM 0 HA ALA A 23 21.439 6.187 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA A 23 23.277 5.400 -1.701 1.00 0.00 H new ATOM 0 HB2 ALA A 23 21.910 6.024 -0.747 1.00 0.00 H new ATOM 0 HB3 ALA A 23 22.160 4.269 -0.901 1.00 0.00 H new ATOM 323 N ASN A 24 20.971 3.208 -3.955 1.00 0.00 N ATOM 324 CA ASN A 24 21.236 2.220 -4.987 1.00 0.00 C ATOM 325 C ASN A 24 20.755 2.760 -6.328 1.00 0.00 C ATOM 326 O ASN A 24 21.359 2.511 -7.373 1.00 0.00 O ATOM 327 CB ASN A 24 20.521 0.906 -4.662 1.00 0.00 C ATOM 328 CG ASN A 24 20.857 -0.207 -5.637 1.00 0.00 C ATOM 329 OD1 ASN A 24 20.209 -0.359 -6.675 1.00 0.00 O ATOM 330 ND2 ASN A 24 21.863 -0.999 -5.298 1.00 0.00 N ATOM 0 H ASN A 24 20.065 3.105 -3.498 1.00 0.00 H new ATOM 0 HA ASN A 24 22.307 2.025 -5.034 1.00 0.00 H new ATOM 0 HB2 ASN A 24 20.790 0.592 -3.653 1.00 0.00 H new ATOM 0 HB3 ASN A 24 19.444 1.074 -4.667 1.00 0.00 H new ATOM 0 HD21 ASN A 24 22.130 -1.773 -5.906 1.00 0.00 H new ATOM 0 HD22 ASN A 24 22.371 -0.835 -4.429 1.00 0.00 H new ATOM 337 N ALA A 25 19.661 3.510 -6.279 1.00 0.00 N ATOM 338 CA ALA A 25 19.111 4.147 -7.465 1.00 0.00 C ATOM 339 C ALA A 25 19.951 5.356 -7.860 1.00 0.00 C ATOM 340 O ALA A 25 20.094 5.665 -9.043 1.00 0.00 O ATOM 341 CB ALA A 25 17.668 4.558 -7.219 1.00 0.00 C ATOM 0 H ALA A 25 19.136 3.692 -5.424 1.00 0.00 H new ATOM 0 HA ALA A 25 19.134 3.431 -8.287 1.00 0.00 H new ATOM 0 HB1 ALA A 25 17.268 5.034 -8.114 1.00 0.00 H new ATOM 0 HB2 ALA A 25 17.074 3.676 -6.980 1.00 0.00 H new ATOM 0 HB3 ALA A 25 17.627 5.260 -6.386 1.00 0.00 H new ATOM 347 N ILE A 26 20.495 6.035 -6.863 1.00 0.00 N ATOM 348 CA ILE A 26 21.388 7.158 -7.102 1.00 0.00 C ATOM 349 C ILE A 26 22.831 6.668 -7.134 1.00 0.00 C ATOM 350 O ILE A 26 23.467 6.512 -6.091 1.00 0.00 O ATOM 351 CB ILE A 26 21.236 8.248 -6.017 1.00 0.00 C ATOM 352 CG1 ILE A 26 19.768 8.665 -5.884 1.00 0.00 C ATOM 353 CG2 ILE A 26 22.103 9.456 -6.352 1.00 0.00 C ATOM 354 CD1 ILE A 26 19.510 9.641 -4.755 1.00 0.00 C ATOM 0 H ILE A 26 20.333 5.827 -5.878 1.00 0.00 H new ATOM 0 HA ILE A 26 21.122 7.599 -8.063 1.00 0.00 H new ATOM 0 HB ILE A 26 21.568 7.838 -5.064 1.00 0.00 H new ATOM 0 HG12 ILE A 26 19.441 9.114 -6.822 1.00 0.00 H new ATOM 0 HG13 ILE A 26 19.160 7.774 -5.728 1.00 0.00 H new ATOM 0 HG21 ILE A 26 21.985 10.215 -5.578 1.00 0.00 H new ATOM 0 HG22 ILE A 26 23.148 9.151 -6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 26 21.797 9.868 -7.314 1.00 0.00 H new ATOM 0 HD11 ILE A 26 18.449 9.889 -4.724 1.00 0.00 H new ATOM 0 HD12 ILE A 26 19.805 9.188 -3.808 1.00 0.00 H new ATOM 0 HD13 ILE A 26 20.090 10.549 -4.919 1.00 0.00 H new ATOM 366 N ASP A 27 23.328 6.396 -8.334 1.00 0.00 N ATOM 367 CA ASP A 27 24.675 5.857 -8.508 1.00 0.00 C ATOM 368 C ASP A 27 25.730 6.807 -7.964 1.00 0.00 C ATOM 369 O ASP A 27 25.653 8.020 -8.172 1.00 0.00 O ATOM 370 CB ASP A 27 24.969 5.573 -9.983 1.00 0.00 C ATOM 371 CG ASP A 27 24.164 4.415 -10.530 1.00 0.00 C ATOM 372 OD1 ASP A 27 24.377 3.270 -10.081 1.00 0.00 O ATOM 373 OD2 ASP A 27 23.308 4.641 -11.408 1.00 0.00 O ATOM 0 H ASP A 27 22.818 6.540 -9.206 1.00 0.00 H new ATOM 0 HA ASP A 27 24.716 4.924 -7.946 1.00 0.00 H new ATOM 0 HB2 ASP A 27 24.756 6.467 -10.570 1.00 0.00 H new ATOM 0 HB3 ASP A 27 26.031 5.359 -10.102 1.00 0.00 H new ATOM 378 N PRO A 28 26.744 6.261 -7.274 1.00 0.00 N ATOM 379 CA PRO A 28 27.865 7.046 -6.746 1.00 0.00 C ATOM 380 C PRO A 28 28.707 7.665 -7.861 1.00 0.00 C ATOM 381 O PRO A 28 29.509 8.567 -7.622 1.00 0.00 O ATOM 382 CB PRO A 28 28.693 6.024 -5.954 1.00 0.00 C ATOM 383 CG PRO A 28 27.786 4.859 -5.745 1.00 0.00 C ATOM 384 CD PRO A 28 26.869 4.836 -6.931 1.00 0.00 C ATOM 0 HA PRO A 28 27.521 7.885 -6.141 1.00 0.00 H new ATOM 0 HB2 PRO A 28 29.588 5.732 -6.504 1.00 0.00 H new ATOM 0 HB3 PRO A 28 29.025 6.440 -5.003 1.00 0.00 H new ATOM 0 HG2 PRO A 28 28.353 3.931 -5.671 1.00 0.00 H new ATOM 0 HG3 PRO A 28 27.223 4.963 -4.818 1.00 0.00 H new ATOM 0 HD2 PRO A 28 27.287 4.257 -7.754 1.00 0.00 H new ATOM 0 HD3 PRO A 28 25.904 4.392 -6.687 1.00 0.00 H new ATOM 392 N SER A 29 28.527 7.165 -9.077 1.00 0.00 N ATOM 393 CA SER A 29 29.196 7.725 -10.241 1.00 0.00 C ATOM 394 C SER A 29 28.348 8.834 -10.858 1.00 0.00 C ATOM 395 O SER A 29 28.852 9.681 -11.599 1.00 0.00 O ATOM 396 CB SER A 29 29.468 6.627 -11.270 1.00 0.00 C ATOM 397 OG SER A 29 30.250 5.587 -10.707 1.00 0.00 O ATOM 0 H SER A 29 27.921 6.370 -9.282 1.00 0.00 H new ATOM 0 HA SER A 29 30.148 8.153 -9.926 1.00 0.00 H new ATOM 0 HB2 SER A 29 28.524 6.221 -11.633 1.00 0.00 H new ATOM 0 HB3 SER A 29 29.985 7.050 -12.131 1.00 0.00 H new ATOM 0 HG SER A 29 30.410 4.895 -11.383 1.00 0.00 H new ATOM 403 N LYS A 30 27.062 8.831 -10.536 1.00 0.00 N ATOM 404 CA LYS A 30 26.147 9.841 -11.041 1.00 0.00 C ATOM 405 C LYS A 30 26.143 11.039 -10.096 1.00 0.00 C ATOM 406 O LYS A 30 26.154 12.186 -10.532 1.00 0.00 O ATOM 407 CB LYS A 30 24.738 9.252 -11.186 1.00 0.00 C ATOM 408 CG LYS A 30 23.760 10.153 -11.929 1.00 0.00 C ATOM 409 CD LYS A 30 22.381 9.511 -12.025 1.00 0.00 C ATOM 410 CE LYS A 30 21.375 10.431 -12.701 1.00 0.00 C ATOM 411 NZ LYS A 30 21.634 10.591 -14.159 1.00 0.00 N ATOM 0 H LYS A 30 26.629 8.138 -9.926 1.00 0.00 H new ATOM 0 HA LYS A 30 26.476 10.173 -12.026 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.807 8.299 -11.710 1.00 0.00 H new ATOM 0 HB3 LYS A 30 24.340 9.042 -10.193 1.00 0.00 H new ATOM 0 HG2 LYS A 30 23.683 11.111 -11.415 1.00 0.00 H new ATOM 0 HG3 LYS A 30 24.139 10.358 -12.930 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.453 8.578 -12.584 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.028 9.258 -11.025 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.370 10.034 -12.556 1.00 0.00 H new ATOM 0 HE3 LYS A 30 21.403 11.409 -12.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.657 11.603 -14.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 22.548 10.158 -14.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.878 10.124 -14.699 1.00 0.00 H new ATOM 425 N TYR A 31 26.137 10.753 -8.799 1.00 0.00 N ATOM 426 CA TYR A 31 26.240 11.784 -7.773 1.00 0.00 C ATOM 427 C TYR A 31 27.252 11.364 -6.715 1.00 0.00 C ATOM 428 O TYR A 31 27.391 10.178 -6.417 1.00 0.00 O ATOM 429 CB TYR A 31 24.880 12.043 -7.113 1.00 0.00 C ATOM 430 CG TYR A 31 23.901 12.798 -7.986 1.00 0.00 C ATOM 431 CD1 TYR A 31 23.093 12.131 -8.898 1.00 0.00 C ATOM 432 CD2 TYR A 31 23.788 14.180 -7.897 1.00 0.00 C ATOM 433 CE1 TYR A 31 22.200 12.820 -9.694 1.00 0.00 C ATOM 434 CE2 TYR A 31 22.897 14.876 -8.690 1.00 0.00 C ATOM 435 CZ TYR A 31 22.107 14.190 -9.588 1.00 0.00 C ATOM 436 OH TYR A 31 21.220 14.879 -10.384 1.00 0.00 O ATOM 0 H TYR A 31 26.061 9.805 -8.430 1.00 0.00 H new ATOM 0 HA TYR A 31 26.572 12.706 -8.250 1.00 0.00 H new ATOM 0 HB2 TYR A 31 24.437 11.087 -6.832 1.00 0.00 H new ATOM 0 HB3 TYR A 31 25.037 12.605 -6.192 1.00 0.00 H new ATOM 0 HD1 TYR A 31 23.164 11.057 -8.986 1.00 0.00 H new ATOM 0 HD2 TYR A 31 24.408 14.719 -7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 31 21.577 12.287 -10.397 1.00 0.00 H new ATOM 0 HE2 TYR A 31 22.820 15.950 -8.607 1.00 0.00 H new ATOM 0 HH TYR A 31 20.536 14.263 -10.720 1.00 0.00 H new ATOM 446 N THR A 32 27.956 12.331 -6.151 1.00 0.00 N ATOM 447 CA THR A 32 28.953 12.048 -5.132 1.00 0.00 C ATOM 448 C THR A 32 28.287 11.904 -3.767 1.00 0.00 C ATOM 449 O THR A 32 28.079 12.887 -3.054 1.00 0.00 O ATOM 450 CB THR A 32 30.024 13.155 -5.077 1.00 0.00 C ATOM 451 OG1 THR A 32 30.522 13.409 -6.398 1.00 0.00 O ATOM 452 CG2 THR A 32 31.179 12.755 -4.167 1.00 0.00 C ATOM 0 H THR A 32 27.856 13.320 -6.382 1.00 0.00 H new ATOM 0 HA THR A 32 29.443 11.110 -5.395 1.00 0.00 H new ATOM 0 HB THR A 32 29.564 14.057 -4.674 1.00 0.00 H new ATOM 0 HG1 THR A 32 31.202 14.114 -6.361 1.00 0.00 H new ATOM 0 HG21 THR A 32 31.920 13.554 -4.147 1.00 0.00 H new ATOM 0 HG22 THR A 32 30.804 12.582 -3.158 1.00 0.00 H new ATOM 0 HG23 THR A 32 31.640 11.842 -4.544 1.00 0.00 H new ATOM 460 N VAL A 33 27.925 10.678 -3.426 1.00 0.00 N ATOM 461 CA VAL A 33 27.217 10.408 -2.184 1.00 0.00 C ATOM 462 C VAL A 33 28.184 10.272 -1.010 1.00 0.00 C ATOM 463 O VAL A 33 29.020 9.366 -0.979 1.00 0.00 O ATOM 464 CB VAL A 33 26.362 9.125 -2.291 1.00 0.00 C ATOM 465 CG1 VAL A 33 25.546 8.908 -1.025 1.00 0.00 C ATOM 466 CG2 VAL A 33 25.454 9.186 -3.510 1.00 0.00 C ATOM 0 H VAL A 33 28.110 9.851 -3.994 1.00 0.00 H new ATOM 0 HA VAL A 33 26.560 11.259 -2.005 1.00 0.00 H new ATOM 0 HB VAL A 33 27.037 8.277 -2.407 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.953 7.999 -1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 33 26.217 8.811 -0.172 1.00 0.00 H new ATOM 0 HG13 VAL A 33 24.882 9.759 -0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 33 24.860 8.274 -3.568 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.790 10.046 -3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 33 26.060 9.282 -4.411 1.00 0.00 H new ATOM 476 N GLU A 34 28.068 11.190 -0.059 1.00 0.00 N ATOM 477 CA GLU A 34 28.839 11.134 1.175 1.00 0.00 C ATOM 478 C GLU A 34 27.902 10.827 2.333 1.00 0.00 C ATOM 479 O GLU A 34 26.982 11.592 2.616 1.00 0.00 O ATOM 480 CB GLU A 34 29.569 12.459 1.429 1.00 0.00 C ATOM 481 CG GLU A 34 30.337 12.490 2.745 1.00 0.00 C ATOM 482 CD GLU A 34 31.000 13.828 3.015 1.00 0.00 C ATOM 483 OE1 GLU A 34 30.320 14.751 3.512 1.00 0.00 O ATOM 484 OE2 GLU A 34 32.204 13.969 2.726 1.00 0.00 O ATOM 0 H GLU A 34 27.439 11.991 -0.121 1.00 0.00 H new ATOM 0 HA GLU A 34 29.590 10.349 1.086 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.262 12.645 0.609 1.00 0.00 H new ATOM 0 HB3 GLU A 34 28.842 13.271 1.423 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.655 12.258 3.563 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.098 11.710 2.733 1.00 0.00 H new ATOM 491 N ILE A 35 28.118 9.698 2.983 1.00 0.00 N ATOM 492 CA ILE A 35 27.265 9.286 4.083 1.00 0.00 C ATOM 493 C ILE A 35 27.911 9.627 5.422 1.00 0.00 C ATOM 494 O ILE A 35 29.056 9.252 5.684 1.00 0.00 O ATOM 495 CB ILE A 35 26.958 7.776 4.024 1.00 0.00 C ATOM 496 CG1 ILE A 35 26.289 7.421 2.692 1.00 0.00 C ATOM 497 CG2 ILE A 35 26.070 7.376 5.190 1.00 0.00 C ATOM 498 CD1 ILE A 35 25.980 5.946 2.535 1.00 0.00 C ATOM 0 H ILE A 35 28.876 9.050 2.769 1.00 0.00 H new ATOM 0 HA ILE A 35 26.326 9.832 3.988 1.00 0.00 H new ATOM 0 HB ILE A 35 27.895 7.224 4.096 1.00 0.00 H new ATOM 0 HG12 ILE A 35 25.363 7.988 2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 35 26.939 7.735 1.875 1.00 0.00 H new ATOM 0 HG21 ILE A 35 25.860 6.308 5.138 1.00 0.00 H new ATOM 0 HG22 ILE A 35 26.578 7.600 6.128 1.00 0.00 H new ATOM 0 HG23 ILE A 35 25.134 7.932 5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 35 25.508 5.774 1.568 1.00 0.00 H new ATOM 0 HD12 ILE A 35 26.905 5.372 2.595 1.00 0.00 H new ATOM 0 HD13 ILE A 35 25.305 5.629 3.330 1.00 0.00 H new ATOM 510 N VAL A 36 27.175 10.344 6.258 1.00 0.00 N ATOM 511 CA VAL A 36 27.670 10.753 7.564 1.00 0.00 C ATOM 512 C VAL A 36 26.807 10.152 8.669 1.00 0.00 C ATOM 513 O VAL A 36 25.577 10.242 8.631 1.00 0.00 O ATOM 514 CB VAL A 36 27.688 12.292 7.710 1.00 0.00 C ATOM 515 CG1 VAL A 36 28.287 12.704 9.048 1.00 0.00 C ATOM 516 CG2 VAL A 36 28.451 12.936 6.561 1.00 0.00 C ATOM 0 H VAL A 36 26.226 10.657 6.053 1.00 0.00 H new ATOM 0 HA VAL A 36 28.693 10.387 7.654 1.00 0.00 H new ATOM 0 HB VAL A 36 26.657 12.644 7.676 1.00 0.00 H new ATOM 0 HG11 VAL A 36 28.289 13.791 9.127 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.692 12.282 9.858 1.00 0.00 H new ATOM 0 HG13 VAL A 36 29.310 12.334 9.118 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.450 14.019 6.685 1.00 0.00 H new ATOM 0 HG22 VAL A 36 29.478 12.572 6.557 1.00 0.00 H new ATOM 0 HG23 VAL A 36 27.972 12.679 5.616 1.00 0.00 H new ATOM 526 N HIS A 37 27.454 9.535 9.644 1.00 0.00 N ATOM 527 CA HIS A 37 26.747 8.901 10.744 1.00 0.00 C ATOM 528 C HIS A 37 26.655 9.860 11.930 1.00 0.00 C ATOM 529 O HIS A 37 27.645 10.110 12.621 1.00 0.00 O ATOM 530 CB HIS A 37 27.463 7.615 11.156 1.00 0.00 C ATOM 531 CG HIS A 37 26.607 6.662 11.930 1.00 0.00 C ATOM 532 ND1 HIS A 37 26.280 6.886 13.246 1.00 0.00 N ATOM 533 CD2 HIS A 37 26.047 5.497 11.530 1.00 0.00 C ATOM 534 CE1 HIS A 37 25.537 5.856 13.613 1.00 0.00 C ATOM 535 NE2 HIS A 37 25.371 4.988 12.608 1.00 0.00 N ATOM 0 H HIS A 37 28.470 9.460 9.696 1.00 0.00 H new ATOM 0 HA HIS A 37 25.738 8.650 10.418 1.00 0.00 H new ATOM 0 HB2 HIS A 37 27.830 7.113 10.261 1.00 0.00 H new ATOM 0 HB3 HIS A 37 28.335 7.873 11.756 1.00 0.00 H new ATOM 0 HD2 HIS A 37 26.119 5.053 10.548 1.00 0.00 H new ATOM 0 HE1 HIS A 37 25.117 5.731 14.600 1.00 0.00 H new ATOM 0 HE2 HIS A 37 24.843 4.116 12.638 1.00 0.00 H new ATOM 543 N LEU A 38 25.463 10.392 12.160 1.00 0.00 N ATOM 544 CA LEU A 38 25.247 11.382 13.212 1.00 0.00 C ATOM 545 C LEU A 38 25.261 10.737 14.592 1.00 0.00 C ATOM 546 O LEU A 38 25.460 11.411 15.602 1.00 0.00 O ATOM 547 CB LEU A 38 23.918 12.108 12.992 1.00 0.00 C ATOM 548 CG LEU A 38 23.834 12.938 11.710 1.00 0.00 C ATOM 549 CD1 LEU A 38 22.443 13.529 11.548 1.00 0.00 C ATOM 550 CD2 LEU A 38 24.880 14.042 11.721 1.00 0.00 C ATOM 0 H LEU A 38 24.624 10.154 11.630 1.00 0.00 H new ATOM 0 HA LEU A 38 26.064 12.102 13.164 1.00 0.00 H new ATOM 0 HB2 LEU A 38 23.116 11.369 12.981 1.00 0.00 H new ATOM 0 HB3 LEU A 38 23.735 12.764 13.843 1.00 0.00 H new ATOM 0 HG LEU A 38 24.032 12.282 10.862 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.402 14.116 10.631 1.00 0.00 H new ATOM 0 HD12 LEU A 38 21.709 12.724 11.497 1.00 0.00 H new ATOM 0 HD13 LEU A 38 22.219 14.171 12.400 1.00 0.00 H new ATOM 0 HD21 LEU A 38 24.806 14.623 10.801 1.00 0.00 H new ATOM 0 HD22 LEU A 38 24.711 14.695 12.577 1.00 0.00 H new ATOM 0 HD23 LEU A 38 25.874 13.601 11.792 1.00 0.00 H new ATOM 562 N GLY A 39 25.067 9.428 14.629 1.00 0.00 N ATOM 563 CA GLY A 39 25.011 8.724 15.894 1.00 0.00 C ATOM 564 C GLY A 39 26.384 8.331 16.400 1.00 0.00 C ATOM 565 O GLY A 39 26.506 7.642 17.412 1.00 0.00 O ATOM 0 H GLY A 39 24.947 8.839 13.805 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.521 9.354 16.636 1.00 0.00 H new ATOM 0 HA3 GLY A 39 24.399 7.829 15.781 1.00 0.00 H new ATOM 569 N THR A 40 27.419 8.765 15.699 1.00 0.00 N ATOM 570 CA THR A 40 28.782 8.438 16.082 1.00 0.00 C ATOM 571 C THR A 40 29.467 9.625 16.762 1.00 0.00 C ATOM 572 O THR A 40 30.336 9.444 17.619 1.00 0.00 O ATOM 573 CB THR A 40 29.605 8.001 14.851 1.00 0.00 C ATOM 574 OG1 THR A 40 28.932 6.932 14.172 1.00 0.00 O ATOM 575 CG2 THR A 40 31.001 7.541 15.251 1.00 0.00 C ATOM 0 H THR A 40 27.341 9.344 14.863 1.00 0.00 H new ATOM 0 HA THR A 40 28.733 7.612 16.791 1.00 0.00 H new ATOM 0 HB THR A 40 29.702 8.862 14.190 1.00 0.00 H new ATOM 0 HG1 THR A 40 28.006 7.194 13.986 1.00 0.00 H new ATOM 0 HG21 THR A 40 31.554 7.240 14.361 1.00 0.00 H new ATOM 0 HG22 THR A 40 31.526 8.359 15.745 1.00 0.00 H new ATOM 0 HG23 THR A 40 30.924 6.695 15.933 1.00 0.00 H new ATOM 583 N ASP A 41 29.053 10.835 16.406 1.00 0.00 N ATOM 584 CA ASP A 41 29.738 12.037 16.870 1.00 0.00 C ATOM 585 C ASP A 41 28.751 13.120 17.302 1.00 0.00 C ATOM 586 O ASP A 41 27.651 13.222 16.761 1.00 0.00 O ATOM 587 CB ASP A 41 30.654 12.568 15.765 1.00 0.00 C ATOM 588 CG ASP A 41 31.309 13.880 16.134 1.00 0.00 C ATOM 589 OD1 ASP A 41 32.135 13.895 17.069 1.00 0.00 O ATOM 590 OD2 ASP A 41 31.006 14.899 15.490 1.00 0.00 O ATOM 0 H ASP A 41 28.251 11.011 15.801 1.00 0.00 H new ATOM 0 HA ASP A 41 30.334 11.769 17.743 1.00 0.00 H new ATOM 0 HB2 ASP A 41 31.426 11.828 15.551 1.00 0.00 H new ATOM 0 HB3 ASP A 41 30.076 12.699 14.850 1.00 0.00 H new ATOM 595 N LYS A 42 29.161 13.921 18.281 1.00 0.00 N ATOM 596 CA LYS A 42 28.328 14.995 18.813 1.00 0.00 C ATOM 597 C LYS A 42 28.391 16.244 17.937 1.00 0.00 C ATOM 598 O LYS A 42 27.379 16.913 17.721 1.00 0.00 O ATOM 599 CB LYS A 42 28.774 15.353 20.233 1.00 0.00 C ATOM 600 CG LYS A 42 28.461 14.286 21.269 1.00 0.00 C ATOM 601 CD LYS A 42 26.968 14.190 21.536 1.00 0.00 C ATOM 602 CE LYS A 42 26.662 13.213 22.660 1.00 0.00 C ATOM 603 NZ LYS A 42 25.218 13.201 23.010 1.00 0.00 N ATOM 0 H LYS A 42 30.076 13.845 18.726 1.00 0.00 H new ATOM 0 HA LYS A 42 27.299 14.635 18.825 1.00 0.00 H new ATOM 0 HB2 LYS A 42 29.848 15.537 20.229 1.00 0.00 H new ATOM 0 HB3 LYS A 42 28.292 16.285 20.530 1.00 0.00 H new ATOM 0 HG2 LYS A 42 28.833 13.321 20.923 1.00 0.00 H new ATOM 0 HG3 LYS A 42 28.984 14.515 22.198 1.00 0.00 H new ATOM 0 HD2 LYS A 42 26.580 15.175 21.794 1.00 0.00 H new ATOM 0 HD3 LYS A 42 26.455 13.873 20.628 1.00 0.00 H new ATOM 0 HE2 LYS A 42 26.971 12.211 22.363 1.00 0.00 H new ATOM 0 HE3 LYS A 42 27.246 13.479 23.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 25.053 12.522 23.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 24.928 14.151 23.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 24.661 12.922 22.177 1.00 0.00 H new ATOM 617 N ALA A 43 29.580 16.550 17.428 1.00 0.00 N ATOM 618 CA ALA A 43 29.799 17.777 16.667 1.00 0.00 C ATOM 619 C ALA A 43 29.016 17.764 15.360 1.00 0.00 C ATOM 620 O ALA A 43 28.564 18.809 14.889 1.00 0.00 O ATOM 621 CB ALA A 43 31.283 17.974 16.398 1.00 0.00 C ATOM 0 H ALA A 43 30.409 15.964 17.529 1.00 0.00 H new ATOM 0 HA ALA A 43 29.436 18.614 17.264 1.00 0.00 H new ATOM 0 HB1 ALA A 43 31.431 18.892 15.830 1.00 0.00 H new ATOM 0 HB2 ALA A 43 31.818 18.043 17.345 1.00 0.00 H new ATOM 0 HB3 ALA A 43 31.665 17.128 15.826 1.00 0.00 H new ATOM 627 N ARG A 44 28.852 16.578 14.785 1.00 0.00 N ATOM 628 CA ARG A 44 28.098 16.418 13.544 1.00 0.00 C ATOM 629 C ARG A 44 26.664 16.924 13.689 1.00 0.00 C ATOM 630 O ARG A 44 26.068 17.397 12.723 1.00 0.00 O ATOM 631 CB ARG A 44 28.082 14.953 13.106 1.00 0.00 C ATOM 632 CG ARG A 44 29.455 14.394 12.774 1.00 0.00 C ATOM 633 CD ARG A 44 30.171 15.240 11.736 1.00 0.00 C ATOM 634 NE ARG A 44 31.411 14.613 11.286 1.00 0.00 N ATOM 635 CZ ARG A 44 32.439 15.277 10.759 1.00 0.00 C ATOM 636 NH1 ARG A 44 32.427 16.604 10.706 1.00 0.00 N ATOM 637 NH2 ARG A 44 33.489 14.610 10.301 1.00 0.00 N ATOM 0 H ARG A 44 29.232 15.709 15.159 1.00 0.00 H new ATOM 0 HA ARG A 44 28.599 17.016 12.783 1.00 0.00 H new ATOM 0 HB2 ARG A 44 27.638 14.352 13.899 1.00 0.00 H new ATOM 0 HB3 ARG A 44 27.439 14.852 12.232 1.00 0.00 H new ATOM 0 HG2 ARG A 44 30.057 14.345 13.681 1.00 0.00 H new ATOM 0 HG3 ARG A 44 29.353 13.374 12.404 1.00 0.00 H new ATOM 0 HD2 ARG A 44 29.514 15.400 10.881 1.00 0.00 H new ATOM 0 HD3 ARG A 44 30.392 16.221 12.156 1.00 0.00 H new ATOM 0 HE ARG A 44 31.496 13.601 11.381 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.627 17.122 11.070 1.00 0.00 H new ATOM 0 HH12 ARG A 44 33.218 17.105 10.301 1.00 0.00 H new ATOM 0 HH21 ARG A 44 33.508 13.591 10.353 1.00 0.00 H new ATOM 0 HH22 ARG A 44 34.278 15.115 9.897 1.00 0.00 H new ATOM 651 N ILE A 45 26.118 16.830 14.899 1.00 0.00 N ATOM 652 CA ILE A 45 24.763 17.303 15.167 1.00 0.00 C ATOM 653 C ILE A 45 24.676 18.809 14.945 1.00 0.00 C ATOM 654 O ILE A 45 23.742 19.307 14.313 1.00 0.00 O ATOM 655 CB ILE A 45 24.327 16.975 16.613 1.00 0.00 C ATOM 656 CG1 ILE A 45 24.360 15.462 16.848 1.00 0.00 C ATOM 657 CG2 ILE A 45 22.937 17.531 16.899 1.00 0.00 C ATOM 658 CD1 ILE A 45 24.006 15.061 18.265 1.00 0.00 C ATOM 0 H ILE A 45 26.593 16.431 15.709 1.00 0.00 H new ATOM 0 HA ILE A 45 24.093 16.789 14.477 1.00 0.00 H new ATOM 0 HB ILE A 45 25.029 17.449 17.299 1.00 0.00 H new ATOM 0 HG12 ILE A 45 23.666 14.980 16.159 1.00 0.00 H new ATOM 0 HG13 ILE A 45 25.356 15.088 16.611 1.00 0.00 H new ATOM 0 HG21 ILE A 45 22.651 17.288 17.922 1.00 0.00 H new ATOM 0 HG22 ILE A 45 22.945 18.614 16.772 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.219 17.090 16.207 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.050 13.976 18.358 1.00 0.00 H new ATOM 0 HD12 ILE A 45 24.714 15.514 18.959 1.00 0.00 H new ATOM 0 HD13 ILE A 45 22.999 15.405 18.499 1.00 0.00 H new ATOM 670 N ALA A 46 25.679 19.520 15.443 1.00 0.00 N ATOM 671 CA ALA A 46 25.723 20.971 15.332 1.00 0.00 C ATOM 672 C ALA A 46 25.873 21.405 13.879 1.00 0.00 C ATOM 673 O ALA A 46 25.353 22.445 13.471 1.00 0.00 O ATOM 674 CB ALA A 46 26.860 21.524 16.176 1.00 0.00 C ATOM 0 H ALA A 46 26.477 19.112 15.930 1.00 0.00 H new ATOM 0 HA ALA A 46 24.781 21.373 15.704 1.00 0.00 H new ATOM 0 HB1 ALA A 46 26.885 22.610 16.086 1.00 0.00 H new ATOM 0 HB2 ALA A 46 26.705 21.249 17.219 1.00 0.00 H new ATOM 0 HB3 ALA A 46 27.806 21.110 15.828 1.00 0.00 H new ATOM 680 N GLU A 47 26.587 20.600 13.101 1.00 0.00 N ATOM 681 CA GLU A 47 26.756 20.862 11.678 1.00 0.00 C ATOM 682 C GLU A 47 25.468 20.552 10.923 1.00 0.00 C ATOM 683 O GLU A 47 25.076 21.283 10.013 1.00 0.00 O ATOM 684 CB GLU A 47 27.899 20.020 11.109 1.00 0.00 C ATOM 685 CG GLU A 47 29.241 20.280 11.772 1.00 0.00 C ATOM 686 CD GLU A 47 30.371 19.527 11.100 1.00 0.00 C ATOM 687 OE1 GLU A 47 30.860 19.999 10.050 1.00 0.00 O ATOM 688 OE2 GLU A 47 30.775 18.466 11.616 1.00 0.00 O ATOM 0 H GLU A 47 27.059 19.759 13.433 1.00 0.00 H new ATOM 0 HA GLU A 47 26.997 21.918 11.554 1.00 0.00 H new ATOM 0 HB2 GLU A 47 27.649 18.965 11.217 1.00 0.00 H new ATOM 0 HB3 GLU A 47 27.987 20.219 10.041 1.00 0.00 H new ATOM 0 HG2 GLU A 47 29.455 21.349 11.748 1.00 0.00 H new ATOM 0 HG3 GLU A 47 29.188 19.990 12.821 1.00 0.00 H new ATOM 695 N ALA A 48 24.808 19.472 11.321 1.00 0.00 N ATOM 696 CA ALA A 48 23.585 19.027 10.665 1.00 0.00 C ATOM 697 C ALA A 48 22.488 20.082 10.754 1.00 0.00 C ATOM 698 O ALA A 48 21.792 20.344 9.769 1.00 0.00 O ATOM 699 CB ALA A 48 23.113 17.714 11.267 1.00 0.00 C ATOM 0 H ALA A 48 25.102 18.884 12.101 1.00 0.00 H new ATOM 0 HA ALA A 48 23.808 18.871 9.609 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.199 17.393 10.768 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.884 16.955 11.135 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.917 17.851 12.330 1.00 0.00 H new ATOM 705 N GLU A 49 22.350 20.702 11.923 1.00 0.00 N ATOM 706 CA GLU A 49 21.342 21.741 12.121 1.00 0.00 C ATOM 707 C GLU A 49 21.644 22.972 11.269 1.00 0.00 C ATOM 708 O GLU A 49 20.750 23.761 10.964 1.00 0.00 O ATOM 709 CB GLU A 49 21.240 22.136 13.596 1.00 0.00 C ATOM 710 CG GLU A 49 20.739 21.017 14.492 1.00 0.00 C ATOM 711 CD GLU A 49 20.384 21.498 15.884 1.00 0.00 C ATOM 712 OE1 GLU A 49 19.216 21.893 16.103 1.00 0.00 O ATOM 713 OE2 GLU A 49 21.260 21.481 16.771 1.00 0.00 O ATOM 0 H GLU A 49 22.921 20.504 12.745 1.00 0.00 H new ATOM 0 HA GLU A 49 20.384 21.329 11.805 1.00 0.00 H new ATOM 0 HB2 GLU A 49 22.221 22.459 13.946 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.571 22.992 13.689 1.00 0.00 H new ATOM 0 HG2 GLU A 49 19.862 20.557 14.036 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.504 20.244 14.563 1.00 0.00 H new ATOM 720 N LYS A 50 22.903 23.134 10.886 1.00 0.00 N ATOM 721 CA LYS A 50 23.295 24.233 10.016 1.00 0.00 C ATOM 722 C LYS A 50 23.028 23.881 8.556 1.00 0.00 C ATOM 723 O LYS A 50 22.547 24.710 7.784 1.00 0.00 O ATOM 724 CB LYS A 50 24.774 24.576 10.212 1.00 0.00 C ATOM 725 CG LYS A 50 25.096 25.115 11.594 1.00 0.00 C ATOM 726 CD LYS A 50 26.564 25.492 11.713 1.00 0.00 C ATOM 727 CE LYS A 50 26.875 26.106 13.068 1.00 0.00 C ATOM 728 NZ LYS A 50 26.681 25.139 14.181 1.00 0.00 N ATOM 0 H LYS A 50 23.668 22.520 11.164 1.00 0.00 H new ATOM 0 HA LYS A 50 22.698 25.105 10.281 1.00 0.00 H new ATOM 0 HB2 LYS A 50 25.372 23.683 10.031 1.00 0.00 H new ATOM 0 HB3 LYS A 50 25.069 25.314 9.466 1.00 0.00 H new ATOM 0 HG2 LYS A 50 24.477 25.988 11.799 1.00 0.00 H new ATOM 0 HG3 LYS A 50 24.849 24.365 12.346 1.00 0.00 H new ATOM 0 HD2 LYS A 50 27.181 24.606 11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 50 26.824 26.198 10.924 1.00 0.00 H new ATOM 0 HE2 LYS A 50 27.905 26.464 13.075 1.00 0.00 H new ATOM 0 HE3 LYS A 50 26.235 26.974 13.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 25.949 25.496 14.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 26.383 24.220 13.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 27.575 25.023 14.700 1.00 0.00 H new ATOM 742 N ALA A 51 23.330 22.641 8.189 1.00 0.00 N ATOM 743 CA ALA A 51 23.109 22.166 6.827 1.00 0.00 C ATOM 744 C ALA A 51 21.620 22.150 6.487 1.00 0.00 C ATOM 745 O ALA A 51 21.227 22.461 5.361 1.00 0.00 O ATOM 746 CB ALA A 51 23.709 20.779 6.648 1.00 0.00 C ATOM 0 H ALA A 51 23.730 21.944 8.817 1.00 0.00 H new ATOM 0 HA ALA A 51 23.604 22.854 6.142 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.537 20.437 5.627 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.781 20.819 6.841 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.240 20.087 7.347 1.00 0.00 H new ATOM 752 N GLY A 52 20.800 21.796 7.468 1.00 0.00 N ATOM 753 CA GLY A 52 19.365 21.763 7.258 1.00 0.00 C ATOM 754 C GLY A 52 18.763 20.407 7.566 1.00 0.00 C ATOM 755 O GLY A 52 17.648 20.104 7.143 1.00 0.00 O ATOM 0 H GLY A 52 21.102 21.531 8.405 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.892 22.518 7.886 1.00 0.00 H new ATOM 0 HA3 GLY A 52 19.147 22.027 6.223 1.00 0.00 H new ATOM 759 N VAL A 53 19.499 19.591 8.305 1.00 0.00 N ATOM 760 CA VAL A 53 19.030 18.266 8.678 1.00 0.00 C ATOM 761 C VAL A 53 18.227 18.345 9.969 1.00 0.00 C ATOM 762 O VAL A 53 18.787 18.525 11.051 1.00 0.00 O ATOM 763 CB VAL A 53 20.203 17.283 8.856 1.00 0.00 C ATOM 764 CG1 VAL A 53 19.701 15.885 9.191 1.00 0.00 C ATOM 765 CG2 VAL A 53 21.069 17.256 7.605 1.00 0.00 C ATOM 0 H VAL A 53 20.427 19.825 8.659 1.00 0.00 H new ATOM 0 HA VAL A 53 18.396 17.896 7.872 1.00 0.00 H new ATOM 0 HB VAL A 53 20.811 17.630 9.692 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.550 15.212 9.311 1.00 0.00 H new ATOM 0 HG12 VAL A 53 19.129 15.916 10.118 1.00 0.00 H new ATOM 0 HG13 VAL A 53 19.064 15.524 8.384 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.893 16.557 7.748 1.00 0.00 H new ATOM 0 HG22 VAL A 53 20.468 16.939 6.753 1.00 0.00 H new ATOM 0 HG23 VAL A 53 21.468 18.253 7.417 1.00 0.00 H new ATOM 775 N LYS A 54 16.913 18.234 9.848 1.00 0.00 N ATOM 776 CA LYS A 54 16.028 18.366 10.997 1.00 0.00 C ATOM 777 C LYS A 54 15.578 16.998 11.498 1.00 0.00 C ATOM 778 O LYS A 54 15.165 16.848 12.650 1.00 0.00 O ATOM 779 CB LYS A 54 14.821 19.232 10.630 1.00 0.00 C ATOM 780 CG LYS A 54 15.211 20.623 10.150 1.00 0.00 C ATOM 781 CD LYS A 54 14.002 21.457 9.755 1.00 0.00 C ATOM 782 CE LYS A 54 14.430 22.810 9.206 1.00 0.00 C ATOM 783 NZ LYS A 54 13.270 23.651 8.810 1.00 0.00 N ATOM 0 H LYS A 54 16.435 18.053 8.965 1.00 0.00 H new ATOM 0 HA LYS A 54 16.577 18.852 11.804 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.246 18.733 9.850 1.00 0.00 H new ATOM 0 HB3 LYS A 54 14.169 19.323 11.498 1.00 0.00 H new ATOM 0 HG2 LYS A 54 15.762 21.136 10.939 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.884 20.535 9.297 1.00 0.00 H new ATOM 0 HD2 LYS A 54 13.417 20.924 9.005 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.355 21.600 10.621 1.00 0.00 H new ATOM 0 HE2 LYS A 54 15.017 23.336 9.959 1.00 0.00 H new ATOM 0 HE3 LYS A 54 15.079 22.661 8.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.611 24.562 8.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.723 23.163 8.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 12.663 23.817 9.638 1.00 0.00 H new ATOM 797 N SER A 55 15.662 16.000 10.636 1.00 0.00 N ATOM 798 CA SER A 55 15.287 14.646 11.003 1.00 0.00 C ATOM 799 C SER A 55 16.198 13.638 10.313 1.00 0.00 C ATOM 800 O SER A 55 16.955 13.996 9.411 1.00 0.00 O ATOM 801 CB SER A 55 13.824 14.388 10.633 1.00 0.00 C ATOM 802 OG SER A 55 12.974 15.349 11.239 1.00 0.00 O ATOM 0 H SER A 55 15.987 16.102 9.675 1.00 0.00 H new ATOM 0 HA SER A 55 15.400 14.529 12.081 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.706 14.423 9.550 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.534 13.387 10.952 1.00 0.00 H new ATOM 0 HG SER A 55 12.275 15.613 10.605 1.00 0.00 H new ATOM 808 N VAL A 56 16.139 12.390 10.748 1.00 0.00 N ATOM 809 CA VAL A 56 16.944 11.336 10.154 1.00 0.00 C ATOM 810 C VAL A 56 16.064 10.174 9.702 1.00 0.00 C ATOM 811 O VAL A 56 15.062 9.850 10.349 1.00 0.00 O ATOM 812 CB VAL A 56 18.031 10.816 11.126 1.00 0.00 C ATOM 813 CG1 VAL A 56 19.050 11.906 11.425 1.00 0.00 C ATOM 814 CG2 VAL A 56 17.411 10.298 12.417 1.00 0.00 C ATOM 0 H VAL A 56 15.539 12.082 11.513 1.00 0.00 H new ATOM 0 HA VAL A 56 17.445 11.771 9.289 1.00 0.00 H new ATOM 0 HB VAL A 56 18.544 9.986 10.640 1.00 0.00 H new ATOM 0 HG11 VAL A 56 19.805 11.520 12.110 1.00 0.00 H new ATOM 0 HG12 VAL A 56 19.528 12.221 10.498 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.547 12.758 11.882 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.198 9.939 13.080 1.00 0.00 H new ATOM 0 HG22 VAL A 56 16.863 11.103 12.906 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.727 9.480 12.190 1.00 0.00 H new ATOM 824 N PRO A 57 16.422 9.540 8.576 1.00 0.00 N ATOM 825 CA PRO A 57 17.580 9.927 7.772 1.00 0.00 C ATOM 826 C PRO A 57 17.259 11.023 6.753 1.00 0.00 C ATOM 827 O PRO A 57 16.115 11.169 6.317 1.00 0.00 O ATOM 828 CB PRO A 57 17.946 8.626 7.065 1.00 0.00 C ATOM 829 CG PRO A 57 16.656 7.886 6.914 1.00 0.00 C ATOM 830 CD PRO A 57 15.723 8.380 7.996 1.00 0.00 C ATOM 0 HA PRO A 57 18.380 10.349 8.380 1.00 0.00 H new ATOM 0 HB2 PRO A 57 18.404 8.820 6.095 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.665 8.050 7.648 1.00 0.00 H new ATOM 0 HG2 PRO A 57 16.226 8.061 5.928 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.816 6.812 7.006 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.753 8.663 7.587 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.540 7.610 8.746 1.00 0.00 H new ATOM 838 N ALA A 58 18.271 11.789 6.378 1.00 0.00 N ATOM 839 CA ALA A 58 18.098 12.875 5.426 1.00 0.00 C ATOM 840 C ALA A 58 19.200 12.855 4.380 1.00 0.00 C ATOM 841 O ALA A 58 20.381 12.763 4.714 1.00 0.00 O ATOM 842 CB ALA A 58 18.078 14.215 6.145 1.00 0.00 C ATOM 0 H ALA A 58 19.225 11.678 6.720 1.00 0.00 H new ATOM 0 HA ALA A 58 17.142 12.735 4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 58 17.948 15.016 5.418 1.00 0.00 H new ATOM 0 HB2 ALA A 58 17.253 14.234 6.857 1.00 0.00 H new ATOM 0 HB3 ALA A 58 19.019 14.357 6.676 1.00 0.00 H new ATOM 848 N LEU A 59 18.816 12.931 3.116 1.00 0.00 N ATOM 849 CA LEU A 59 19.775 12.940 2.029 1.00 0.00 C ATOM 850 C LEU A 59 19.776 14.310 1.358 1.00 0.00 C ATOM 851 O LEU A 59 18.794 14.711 0.734 1.00 0.00 O ATOM 852 CB LEU A 59 19.433 11.843 1.011 1.00 0.00 C ATOM 853 CG LEU A 59 20.629 11.203 0.288 1.00 0.00 C ATOM 854 CD1 LEU A 59 20.159 10.069 -0.609 1.00 0.00 C ATOM 855 CD2 LEU A 59 21.398 12.230 -0.527 1.00 0.00 C ATOM 0 H LEU A 59 17.842 12.987 2.819 1.00 0.00 H new ATOM 0 HA LEU A 59 20.770 12.740 2.427 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.880 11.057 1.525 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.764 12.265 0.262 1.00 0.00 H new ATOM 0 HG LEU A 59 21.301 10.803 1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 59 21.017 9.625 -1.114 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.661 9.310 -0.005 1.00 0.00 H new ATOM 0 HD13 LEU A 59 19.462 10.457 -1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 59 22.237 11.745 -1.025 1.00 0.00 H new ATOM 0 HD22 LEU A 59 20.738 12.670 -1.274 1.00 0.00 H new ATOM 0 HD23 LEU A 59 21.772 13.013 0.133 1.00 0.00 H new ATOM 867 N VAL A 60 20.869 15.034 1.518 1.00 0.00 N ATOM 868 CA VAL A 60 21.026 16.339 0.903 1.00 0.00 C ATOM 869 C VAL A 60 21.551 16.182 -0.523 1.00 0.00 C ATOM 870 O VAL A 60 22.754 16.039 -0.738 1.00 0.00 O ATOM 871 CB VAL A 60 21.991 17.233 1.714 1.00 0.00 C ATOM 872 CG1 VAL A 60 22.075 18.629 1.116 1.00 0.00 C ATOM 873 CG2 VAL A 60 21.560 17.298 3.173 1.00 0.00 C ATOM 0 H VAL A 60 21.669 14.735 2.075 1.00 0.00 H new ATOM 0 HA VAL A 60 20.048 16.821 0.886 1.00 0.00 H new ATOM 0 HB VAL A 60 22.985 16.788 1.667 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.761 19.237 1.706 1.00 0.00 H new ATOM 0 HG12 VAL A 60 22.438 18.564 0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.086 19.088 1.122 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.251 17.932 3.729 1.00 0.00 H new ATOM 0 HG22 VAL A 60 20.555 17.714 3.237 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.565 16.295 3.599 1.00 0.00 H new ATOM 883 N ILE A 61 20.640 16.189 -1.479 1.00 0.00 N ATOM 884 CA ILE A 61 20.988 15.976 -2.876 1.00 0.00 C ATOM 885 C ILE A 61 21.289 17.303 -3.559 1.00 0.00 C ATOM 886 O ILE A 61 20.406 18.157 -3.667 1.00 0.00 O ATOM 887 CB ILE A 61 19.849 15.264 -3.639 1.00 0.00 C ATOM 888 CG1 ILE A 61 19.454 13.972 -2.924 1.00 0.00 C ATOM 889 CG2 ILE A 61 20.270 14.975 -5.074 1.00 0.00 C ATOM 890 CD1 ILE A 61 18.264 13.268 -3.546 1.00 0.00 C ATOM 0 H ILE A 61 19.645 16.341 -1.313 1.00 0.00 H new ATOM 0 HA ILE A 61 21.874 15.342 -2.896 1.00 0.00 H new ATOM 0 HB ILE A 61 18.981 15.923 -3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 61 20.307 13.293 -2.923 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.226 14.199 -1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.456 14.473 -5.598 1.00 0.00 H new ATOM 0 HG22 ILE A 61 20.504 15.912 -5.580 1.00 0.00 H new ATOM 0 HG23 ILE A 61 21.151 14.333 -5.072 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.044 12.360 -2.984 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.397 13.929 -3.522 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.494 13.008 -4.579 1.00 0.00 H new ATOM 902 N ASP A 62 22.548 17.484 -3.964 1.00 0.00 N ATOM 903 CA ASP A 62 22.982 18.654 -4.744 1.00 0.00 C ATOM 904 C ASP A 62 23.013 19.925 -3.891 1.00 0.00 C ATOM 905 O ASP A 62 23.627 20.927 -4.264 1.00 0.00 O ATOM 906 CB ASP A 62 22.072 18.845 -5.969 1.00 0.00 C ATOM 907 CG ASP A 62 22.545 19.947 -6.900 1.00 0.00 C ATOM 908 OD1 ASP A 62 23.361 19.657 -7.802 1.00 0.00 O ATOM 909 OD2 ASP A 62 22.093 21.102 -6.738 1.00 0.00 O ATOM 0 H ASP A 62 23.299 16.825 -3.762 1.00 0.00 H new ATOM 0 HA ASP A 62 24.000 18.467 -5.086 1.00 0.00 H new ATOM 0 HB2 ASP A 62 22.019 17.908 -6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 62 21.061 19.073 -5.631 1.00 0.00 H new ATOM 914 N GLY A 63 22.384 19.868 -2.726 1.00 0.00 N ATOM 915 CA GLY A 63 22.274 21.033 -1.874 1.00 0.00 C ATOM 916 C GLY A 63 20.934 21.101 -1.169 1.00 0.00 C ATOM 917 O GLY A 63 20.790 21.785 -0.154 1.00 0.00 O ATOM 0 H GLY A 63 21.944 19.027 -2.353 1.00 0.00 H new ATOM 0 HA2 GLY A 63 23.073 21.016 -1.132 1.00 0.00 H new ATOM 0 HA3 GLY A 63 22.414 21.933 -2.472 1.00 0.00 H new ATOM 921 N ALA A 64 19.949 20.387 -1.703 1.00 0.00 N ATOM 922 CA ALA A 64 18.618 20.355 -1.111 1.00 0.00 C ATOM 923 C ALA A 64 18.448 19.113 -0.242 1.00 0.00 C ATOM 924 O ALA A 64 18.776 18.006 -0.662 1.00 0.00 O ATOM 925 CB ALA A 64 17.554 20.401 -2.197 1.00 0.00 C ATOM 0 H ALA A 64 20.048 19.822 -2.546 1.00 0.00 H new ATOM 0 HA ALA A 64 18.500 21.233 -0.476 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.565 20.376 -1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 64 17.663 21.319 -2.775 1.00 0.00 H new ATOM 0 HB3 ALA A 64 17.670 19.541 -2.857 1.00 0.00 H new ATOM 931 N ALA A 65 17.939 19.301 0.966 1.00 0.00 N ATOM 932 CA ALA A 65 17.802 18.207 1.917 1.00 0.00 C ATOM 933 C ALA A 65 16.479 17.469 1.734 1.00 0.00 C ATOM 934 O ALA A 65 15.408 18.079 1.723 1.00 0.00 O ATOM 935 CB ALA A 65 17.920 18.730 3.341 1.00 0.00 C ATOM 0 H ALA A 65 17.613 20.203 1.312 1.00 0.00 H new ATOM 0 HA ALA A 65 18.608 17.498 1.728 1.00 0.00 H new ATOM 0 HB1 ALA A 65 17.816 17.902 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 65 18.894 19.200 3.476 1.00 0.00 H new ATOM 0 HB3 ALA A 65 17.135 19.463 3.526 1.00 0.00 H new ATOM 941 N PHE A 66 16.563 16.157 1.575 1.00 0.00 N ATOM 942 CA PHE A 66 15.378 15.322 1.457 1.00 0.00 C ATOM 943 C PHE A 66 15.395 14.219 2.507 1.00 0.00 C ATOM 944 O PHE A 66 16.207 13.297 2.443 1.00 0.00 O ATOM 945 CB PHE A 66 15.282 14.715 0.056 1.00 0.00 C ATOM 946 CG PHE A 66 15.103 15.740 -1.026 1.00 0.00 C ATOM 947 CD1 PHE A 66 13.844 16.239 -1.322 1.00 0.00 C ATOM 948 CD2 PHE A 66 16.191 16.210 -1.743 1.00 0.00 C ATOM 949 CE1 PHE A 66 13.674 17.186 -2.312 1.00 0.00 C ATOM 950 CE2 PHE A 66 16.027 17.157 -2.731 1.00 0.00 C ATOM 951 CZ PHE A 66 14.767 17.647 -3.017 1.00 0.00 C ATOM 0 H PHE A 66 17.444 15.646 1.525 1.00 0.00 H new ATOM 0 HA PHE A 66 14.502 15.949 1.624 1.00 0.00 H new ATOM 0 HB2 PHE A 66 16.185 14.139 -0.145 1.00 0.00 H new ATOM 0 HB3 PHE A 66 14.446 14.017 0.027 1.00 0.00 H new ATOM 0 HD1 PHE A 66 12.986 15.883 -0.772 1.00 0.00 H new ATOM 0 HD2 PHE A 66 17.178 15.830 -1.526 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.688 17.565 -2.534 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.884 17.516 -3.282 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.638 18.389 -3.791 1.00 0.00 H new ATOM 961 N HIS A 67 14.508 14.334 3.480 1.00 0.00 N ATOM 962 CA HIS A 67 14.389 13.338 4.536 1.00 0.00 C ATOM 963 C HIS A 67 13.716 12.086 3.989 1.00 0.00 C ATOM 964 O HIS A 67 12.596 12.151 3.485 1.00 0.00 O ATOM 965 CB HIS A 67 13.577 13.899 5.711 1.00 0.00 C ATOM 966 CG HIS A 67 14.160 15.141 6.323 1.00 0.00 C ATOM 967 ND1 HIS A 67 13.900 16.417 5.873 1.00 0.00 N ATOM 968 CD2 HIS A 67 14.999 15.284 7.379 1.00 0.00 C ATOM 969 CE1 HIS A 67 14.572 17.276 6.650 1.00 0.00 C ATOM 970 NE2 HIS A 67 15.256 16.639 7.583 1.00 0.00 N ATOM 0 H HIS A 67 13.854 15.113 3.562 1.00 0.00 H new ATOM 0 HA HIS A 67 15.387 13.083 4.893 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.565 14.116 5.368 1.00 0.00 H new ATOM 0 HB3 HIS A 67 13.495 13.132 6.481 1.00 0.00 H new ATOM 0 HD1 HIS A 67 13.300 16.664 5.086 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.404 14.475 7.969 1.00 0.00 H new ATOM 0 HE1 HIS A 67 14.557 18.349 6.529 1.00 0.00 H new ATOM 978 N ILE A 68 14.393 10.954 4.083 1.00 0.00 N ATOM 979 CA ILE A 68 13.876 9.713 3.523 1.00 0.00 C ATOM 980 C ILE A 68 13.230 8.868 4.613 1.00 0.00 C ATOM 981 O ILE A 68 13.923 8.195 5.374 1.00 0.00 O ATOM 982 CB ILE A 68 14.987 8.893 2.835 1.00 0.00 C ATOM 983 CG1 ILE A 68 15.737 9.761 1.822 1.00 0.00 C ATOM 984 CG2 ILE A 68 14.390 7.669 2.151 1.00 0.00 C ATOM 985 CD1 ILE A 68 16.906 9.058 1.167 1.00 0.00 C ATOM 0 H ILE A 68 15.300 10.867 4.541 1.00 0.00 H new ATOM 0 HA ILE A 68 13.131 9.981 2.774 1.00 0.00 H new ATOM 0 HB ILE A 68 15.695 8.556 3.592 1.00 0.00 H new ATOM 0 HG12 ILE A 68 15.040 10.086 1.049 1.00 0.00 H new ATOM 0 HG13 ILE A 68 16.099 10.659 2.323 1.00 0.00 H new ATOM 0 HG21 ILE A 68 15.184 7.098 1.669 1.00 0.00 H new ATOM 0 HG22 ILE A 68 13.893 7.044 2.893 1.00 0.00 H new ATOM 0 HG23 ILE A 68 13.666 7.988 1.401 1.00 0.00 H new ATOM 0 HD11 ILE A 68 17.389 9.735 0.462 1.00 0.00 H new ATOM 0 HD12 ILE A 68 17.624 8.757 1.930 1.00 0.00 H new ATOM 0 HD13 ILE A 68 16.549 8.175 0.636 1.00 0.00 H new ATOM 997 N ASN A 69 11.899 8.917 4.670 1.00 0.00 N ATOM 998 CA ASN A 69 11.121 8.235 5.705 1.00 0.00 C ATOM 999 C ASN A 69 11.357 8.874 7.067 1.00 0.00 C ATOM 1000 O ASN A 69 12.427 8.739 7.656 1.00 0.00 O ATOM 1001 CB ASN A 69 11.430 6.732 5.760 1.00 0.00 C ATOM 1002 CG ASN A 69 10.738 5.955 4.659 1.00 0.00 C ATOM 1003 OD1 ASN A 69 9.660 6.332 4.205 1.00 0.00 O ATOM 1004 ND2 ASN A 69 11.347 4.862 4.224 1.00 0.00 N ATOM 0 H ASN A 69 11.329 9.432 3.999 1.00 0.00 H new ATOM 0 HA ASN A 69 10.069 8.345 5.441 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.507 6.583 5.683 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.122 6.337 6.728 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.921 4.300 3.487 1.00 0.00 H new ATOM 0 HD22 ASN A 69 12.241 4.582 4.627 1.00 0.00 H new ATOM 1011 N PHE A 70 10.344 9.580 7.555 1.00 0.00 N ATOM 1012 CA PHE A 70 10.438 10.278 8.830 1.00 0.00 C ATOM 1013 C PHE A 70 10.567 9.284 9.981 1.00 0.00 C ATOM 1014 O PHE A 70 9.572 8.755 10.480 1.00 0.00 O ATOM 1015 CB PHE A 70 9.214 11.179 9.034 1.00 0.00 C ATOM 1016 CG PHE A 70 9.267 12.008 10.290 1.00 0.00 C ATOM 1017 CD1 PHE A 70 10.022 13.168 10.338 1.00 0.00 C ATOM 1018 CD2 PHE A 70 8.561 11.625 11.421 1.00 0.00 C ATOM 1019 CE1 PHE A 70 10.073 13.931 11.489 1.00 0.00 C ATOM 1020 CE2 PHE A 70 8.608 12.384 12.574 1.00 0.00 C ATOM 1021 CZ PHE A 70 9.365 13.538 12.608 1.00 0.00 C ATOM 0 H PHE A 70 9.445 9.684 7.084 1.00 0.00 H new ATOM 0 HA PHE A 70 11.332 10.902 8.816 1.00 0.00 H new ATOM 0 HB2 PHE A 70 9.118 11.844 8.176 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.318 10.558 9.058 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.577 13.480 9.466 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.968 10.723 11.400 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.666 14.833 11.514 1.00 0.00 H new ATOM 0 HE2 PHE A 70 8.053 12.075 13.448 1.00 0.00 H new ATOM 0 HZ PHE A 70 9.404 14.133 13.509 1.00 0.00 H new ATOM 1031 N GLY A 71 11.803 9.009 10.369 1.00 0.00 N ATOM 1032 CA GLY A 71 12.048 8.121 11.480 1.00 0.00 C ATOM 1033 C GLY A 71 12.084 8.867 12.794 1.00 0.00 C ATOM 1034 O GLY A 71 11.165 8.755 13.604 1.00 0.00 O ATOM 0 H GLY A 71 12.642 9.388 9.931 1.00 0.00 H new ATOM 0 HA2 GLY A 71 11.270 7.359 11.515 1.00 0.00 H new ATOM 0 HA3 GLY A 71 12.995 7.603 11.330 1.00 0.00 H new ATOM 1038 N ALA A 72 13.137 9.640 13.000 1.00 0.00 N ATOM 1039 CA ALA A 72 13.296 10.397 14.231 1.00 0.00 C ATOM 1040 C ALA A 72 13.836 11.788 13.943 1.00 0.00 C ATOM 1041 O ALA A 72 14.490 12.008 12.921 1.00 0.00 O ATOM 1042 CB ALA A 72 14.216 9.658 15.192 1.00 0.00 C ATOM 0 H ALA A 72 13.896 9.760 12.329 1.00 0.00 H new ATOM 0 HA ALA A 72 12.316 10.502 14.697 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.325 10.237 16.109 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.789 8.683 15.427 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.194 9.524 14.729 1.00 0.00 H new ATOM 1048 N GLY A 73 13.563 12.722 14.839 1.00 0.00 N ATOM 1049 CA GLY A 73 14.084 14.064 14.695 1.00 0.00 C ATOM 1050 C GLY A 73 15.434 14.209 15.363 1.00 0.00 C ATOM 1051 O GLY A 73 15.660 13.645 16.434 1.00 0.00 O ATOM 0 H GLY A 73 12.987 12.574 15.668 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.172 14.310 13.637 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.383 14.776 15.130 1.00 0.00 H new ATOM 1055 N ILE A 74 16.333 14.964 14.746 1.00 0.00 N ATOM 1056 CA ILE A 74 17.682 15.122 15.281 1.00 0.00 C ATOM 1057 C ILE A 74 17.654 15.940 16.571 1.00 0.00 C ATOM 1058 O ILE A 74 18.538 15.825 17.418 1.00 0.00 O ATOM 1059 CB ILE A 74 18.634 15.788 14.257 1.00 0.00 C ATOM 1060 CG1 ILE A 74 20.080 15.733 14.762 1.00 0.00 C ATOM 1061 CG2 ILE A 74 18.216 17.229 13.987 1.00 0.00 C ATOM 1062 CD1 ILE A 74 21.087 16.313 13.794 1.00 0.00 C ATOM 0 H ILE A 74 16.156 15.474 13.881 1.00 0.00 H new ATOM 0 HA ILE A 74 18.064 14.124 15.495 1.00 0.00 H new ATOM 0 HB ILE A 74 18.571 15.236 13.319 1.00 0.00 H new ATOM 0 HG12 ILE A 74 20.146 16.272 15.707 1.00 0.00 H new ATOM 0 HG13 ILE A 74 20.344 14.696 14.968 1.00 0.00 H new ATOM 0 HG21 ILE A 74 18.899 17.677 13.265 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.203 17.245 13.586 1.00 0.00 H new ATOM 0 HG23 ILE A 74 18.247 17.797 14.917 1.00 0.00 H new ATOM 0 HD11 ILE A 74 22.087 16.238 14.221 1.00 0.00 H new ATOM 0 HD12 ILE A 74 21.051 15.759 12.856 1.00 0.00 H new ATOM 0 HD13 ILE A 74 20.850 17.360 13.606 1.00 0.00 H new ATOM 1074 N ASP A 75 16.608 16.744 16.723 1.00 0.00 N ATOM 1075 CA ASP A 75 16.448 17.578 17.907 1.00 0.00 C ATOM 1076 C ASP A 75 16.188 16.717 19.138 1.00 0.00 C ATOM 1077 O ASP A 75 16.512 17.100 20.261 1.00 0.00 O ATOM 1078 CB ASP A 75 15.301 18.568 17.701 1.00 0.00 C ATOM 1079 CG ASP A 75 15.153 19.539 18.855 1.00 0.00 C ATOM 1080 OD1 ASP A 75 15.936 20.512 18.920 1.00 0.00 O ATOM 1081 OD2 ASP A 75 14.242 19.345 19.690 1.00 0.00 O ATOM 0 H ASP A 75 15.857 16.836 16.039 1.00 0.00 H new ATOM 0 HA ASP A 75 17.371 18.135 18.066 1.00 0.00 H new ATOM 0 HB2 ASP A 75 15.470 19.127 16.780 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.369 18.017 17.573 1.00 0.00 H new ATOM 1086 N ASP A 76 15.631 15.534 18.914 1.00 0.00 N ATOM 1087 CA ASP A 76 15.317 14.615 19.999 1.00 0.00 C ATOM 1088 C ASP A 76 16.574 13.897 20.473 1.00 0.00 C ATOM 1089 O ASP A 76 16.612 13.343 21.570 1.00 0.00 O ATOM 1090 CB ASP A 76 14.276 13.585 19.552 1.00 0.00 C ATOM 1091 CG ASP A 76 12.973 14.217 19.104 1.00 0.00 C ATOM 1092 OD1 ASP A 76 12.275 14.814 19.949 1.00 0.00 O ATOM 1093 OD2 ASP A 76 12.631 14.106 17.910 1.00 0.00 O ATOM 0 H ASP A 76 15.387 15.188 17.986 1.00 0.00 H new ATOM 0 HA ASP A 76 14.907 15.198 20.824 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.687 12.993 18.734 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.076 12.898 20.374 1.00 0.00 H new ATOM 1098 N LEU A 77 17.611 13.935 19.644 1.00 0.00 N ATOM 1099 CA LEU A 77 18.860 13.239 19.937 1.00 0.00 C ATOM 1100 C LEU A 77 19.772 14.092 20.815 1.00 0.00 C ATOM 1101 O LEU A 77 20.921 13.729 21.076 1.00 0.00 O ATOM 1102 CB LEU A 77 19.580 12.883 18.632 1.00 0.00 C ATOM 1103 CG LEU A 77 18.782 12.010 17.662 1.00 0.00 C ATOM 1104 CD1 LEU A 77 19.562 11.792 16.375 1.00 0.00 C ATOM 1105 CD2 LEU A 77 18.434 10.676 18.306 1.00 0.00 C ATOM 0 H LEU A 77 17.612 14.443 18.759 1.00 0.00 H new ATOM 0 HA LEU A 77 18.619 12.325 20.480 1.00 0.00 H new ATOM 0 HB2 LEU A 77 19.852 13.807 18.123 1.00 0.00 H new ATOM 0 HB3 LEU A 77 20.509 12.369 18.878 1.00 0.00 H new ATOM 0 HG LEU A 77 17.854 12.527 17.419 1.00 0.00 H new ATOM 0 HD11 LEU A 77 18.979 11.169 15.697 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.761 12.754 15.903 1.00 0.00 H new ATOM 0 HD13 LEU A 77 20.506 11.297 16.601 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.866 10.069 17.601 1.00 0.00 H new ATOM 0 HD22 LEU A 77 19.351 10.154 18.579 1.00 0.00 H new ATOM 0 HD23 LEU A 77 17.835 10.849 19.200 1.00 0.00 H new ATOM 1117 N LYS A 78 19.253 15.225 21.271 1.00 0.00 N ATOM 1118 CA LYS A 78 20.017 16.137 22.114 1.00 0.00 C ATOM 1119 C LYS A 78 19.816 15.804 23.586 1.00 0.00 C ATOM 1120 O LYS A 78 20.579 16.249 24.444 1.00 0.00 O ATOM 1121 CB LYS A 78 19.583 17.580 21.862 1.00 0.00 C ATOM 1122 CG LYS A 78 19.717 18.021 20.417 1.00 0.00 C ATOM 1123 CD LYS A 78 19.127 19.404 20.215 1.00 0.00 C ATOM 1124 CE LYS A 78 19.191 19.832 18.761 1.00 0.00 C ATOM 1125 NZ LYS A 78 18.559 21.159 18.554 1.00 0.00 N ATOM 0 H LYS A 78 18.302 15.536 21.070 1.00 0.00 H new ATOM 0 HA LYS A 78 21.072 16.024 21.863 1.00 0.00 H new ATOM 0 HB2 LYS A 78 18.544 17.696 22.172 1.00 0.00 H new ATOM 0 HB3 LYS A 78 20.178 18.243 22.490 1.00 0.00 H new ATOM 0 HG2 LYS A 78 20.769 18.025 20.130 1.00 0.00 H new ATOM 0 HG3 LYS A 78 19.211 17.307 19.767 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.090 19.410 20.551 1.00 0.00 H new ATOM 0 HD3 LYS A 78 19.666 20.124 20.831 1.00 0.00 H new ATOM 0 HE2 LYS A 78 20.231 19.869 18.438 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.690 19.089 18.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.591 21.405 17.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 17.569 21.125 18.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 19.074 21.878 19.101 1.00 0.00 H new ATOM 1139 N GLY A 79 18.787 15.023 23.872 1.00 0.00 N ATOM 1140 CA GLY A 79 18.456 14.718 25.245 1.00 0.00 C ATOM 1141 C GLY A 79 18.549 13.241 25.551 1.00 0.00 C ATOM 1142 O GLY A 79 18.759 12.422 24.652 1.00 0.00 O ATOM 0 H GLY A 79 18.175 14.595 23.177 1.00 0.00 H new ATOM 0 HA2 GLY A 79 19.127 15.265 25.907 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.445 15.066 25.457 1.00 0.00 H new ATOM 1146 N SER A 80 18.395 12.906 26.820 1.00 0.00 N ATOM 1147 CA SER A 80 18.441 11.525 27.262 1.00 0.00 C ATOM 1148 C SER A 80 17.096 10.845 27.016 1.00 0.00 C ATOM 1149 O SER A 80 17.013 9.983 26.114 1.00 0.00 O ATOM 1150 CB SER A 80 18.799 11.474 28.748 1.00 0.00 C ATOM 1151 OG SER A 80 19.940 12.273 29.023 1.00 0.00 O ATOM 1152 OXT SER A 80 16.117 11.190 27.716 1.00 0.00 O ATOM 0 H SER A 80 18.235 13.580 27.569 1.00 0.00 H new ATOM 0 HA SER A 80 19.204 10.993 26.693 1.00 0.00 H new ATOM 0 HB2 SER A 80 17.954 11.823 29.342 1.00 0.00 H new ATOM 0 HB3 SER A 80 18.992 10.443 29.044 1.00 0.00 H new ATOM 0 HG SER A 80 20.149 12.226 29.979 1.00 0.00 H new TER 1158 SER A 80 ATOM 1159 N VAL B 1 17.815 -3.125 -13.957 1.00 0.00 N ATOM 1160 CA VAL B 1 17.309 -2.991 -15.343 1.00 0.00 C ATOM 1161 C VAL B 1 16.475 -1.723 -15.479 1.00 0.00 C ATOM 1162 O VAL B 1 16.970 -0.701 -15.949 1.00 0.00 O ATOM 1163 CB VAL B 1 16.458 -4.210 -15.765 1.00 0.00 C ATOM 1164 CG1 VAL B 1 16.144 -4.162 -17.254 1.00 0.00 C ATOM 1165 CG2 VAL B 1 17.158 -5.509 -15.403 1.00 0.00 C ATOM 0 H1 VAL B 1 18.724 -3.629 -13.967 1.00 0.00 H new ATOM 0 H2 VAL B 1 17.947 -2.180 -13.543 1.00 0.00 H new ATOM 0 H3 VAL B 1 17.129 -3.660 -13.387 1.00 0.00 H new ATOM 0 HA VAL B 1 18.177 -2.937 -16.000 1.00 0.00 H new ATOM 0 HB VAL B 1 15.516 -4.169 -15.219 1.00 0.00 H new ATOM 0 HG11 VAL B 1 15.544 -5.030 -17.528 1.00 0.00 H new ATOM 0 HG12 VAL B 1 15.589 -3.252 -17.480 1.00 0.00 H new ATOM 0 HG13 VAL B 1 17.074 -4.170 -17.822 1.00 0.00 H new ATOM 0 HG21 VAL B 1 16.540 -6.353 -15.710 1.00 0.00 H new ATOM 0 HG22 VAL B 1 18.120 -5.559 -15.914 1.00 0.00 H new ATOM 0 HG23 VAL B 1 17.317 -5.548 -14.325 1.00 0.00 H new ATOM 1177 N ALA B 2 15.216 -1.787 -15.059 1.00 0.00 N ATOM 1178 CA ALA B 2 14.352 -0.614 -15.066 1.00 0.00 C ATOM 1179 C ALA B 2 13.389 -0.650 -13.886 1.00 0.00 C ATOM 1180 O ALA B 2 13.273 0.325 -13.148 1.00 0.00 O ATOM 1181 CB ALA B 2 13.593 -0.511 -16.381 1.00 0.00 C ATOM 0 H ALA B 2 14.773 -2.637 -14.710 1.00 0.00 H new ATOM 0 HA ALA B 2 14.978 0.273 -14.967 1.00 0.00 H new ATOM 0 HB1 ALA B 2 12.954 0.372 -16.364 1.00 0.00 H new ATOM 0 HB2 ALA B 2 14.302 -0.430 -17.205 1.00 0.00 H new ATOM 0 HB3 ALA B 2 12.978 -1.401 -16.517 1.00 0.00 H new ATOM 1187 N SER B 3 12.704 -1.781 -13.720 1.00 0.00 N ATOM 1188 CA SER B 3 11.784 -1.982 -12.601 1.00 0.00 C ATOM 1189 C SER B 3 10.715 -0.887 -12.570 1.00 0.00 C ATOM 1190 O SER B 3 10.432 -0.270 -13.598 1.00 0.00 O ATOM 1191 CB SER B 3 12.578 -2.027 -11.293 1.00 0.00 C ATOM 1192 OG SER B 3 13.536 -3.077 -11.333 1.00 0.00 O ATOM 0 H SER B 3 12.770 -2.579 -14.352 1.00 0.00 H new ATOM 0 HA SER B 3 11.265 -2.932 -12.727 1.00 0.00 H new ATOM 0 HB2 SER B 3 13.080 -1.073 -11.132 1.00 0.00 H new ATOM 0 HB3 SER B 3 11.900 -2.176 -10.453 1.00 0.00 H new ATOM 0 HG SER B 3 14.038 -3.094 -10.492 1.00 0.00 H new ATOM 1198 N LYS B 4 10.102 -0.654 -11.416 1.00 0.00 N ATOM 1199 CA LYS B 4 9.122 0.413 -11.308 1.00 0.00 C ATOM 1200 C LYS B 4 9.349 1.245 -10.051 1.00 0.00 C ATOM 1201 O LYS B 4 9.446 0.719 -8.942 1.00 0.00 O ATOM 1202 CB LYS B 4 7.684 -0.136 -11.346 1.00 0.00 C ATOM 1203 CG LYS B 4 7.279 -0.979 -10.143 1.00 0.00 C ATOM 1204 CD LYS B 4 5.788 -1.282 -10.176 1.00 0.00 C ATOM 1205 CE LYS B 4 5.293 -1.896 -8.872 1.00 0.00 C ATOM 1206 NZ LYS B 4 5.767 -3.291 -8.681 1.00 0.00 N ATOM 0 H LYS B 4 10.263 -1.180 -10.557 1.00 0.00 H new ATOM 0 HA LYS B 4 9.254 1.063 -12.173 1.00 0.00 H new ATOM 0 HB2 LYS B 4 6.994 0.703 -11.430 1.00 0.00 H new ATOM 0 HB3 LYS B 4 7.566 -0.737 -12.247 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.845 -1.911 -10.139 1.00 0.00 H new ATOM 0 HG3 LYS B 4 7.528 -0.451 -9.222 1.00 0.00 H new ATOM 0 HD2 LYS B 4 5.237 -0.363 -10.374 1.00 0.00 H new ATOM 0 HD3 LYS B 4 5.576 -1.964 -10.999 1.00 0.00 H new ATOM 0 HE2 LYS B 4 5.630 -1.284 -8.036 1.00 0.00 H new ATOM 0 HE3 LYS B 4 4.203 -1.881 -8.859 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 5.402 -3.661 -7.780 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 5.424 -3.884 -9.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 6.807 -3.305 -8.666 1.00 0.00 H new ATOM 1220 N ALA B 5 9.461 2.548 -10.243 1.00 0.00 N ATOM 1221 CA ALA B 5 9.586 3.485 -9.142 1.00 0.00 C ATOM 1222 C ALA B 5 8.405 4.442 -9.165 1.00 0.00 C ATOM 1223 O ALA B 5 8.371 5.382 -9.959 1.00 0.00 O ATOM 1224 CB ALA B 5 10.903 4.242 -9.235 1.00 0.00 C ATOM 0 H ALA B 5 9.468 2.985 -11.165 1.00 0.00 H new ATOM 0 HA ALA B 5 9.583 2.941 -8.198 1.00 0.00 H new ATOM 0 HB1 ALA B 5 10.981 4.941 -8.402 1.00 0.00 H new ATOM 0 HB2 ALA B 5 11.732 3.536 -9.195 1.00 0.00 H new ATOM 0 HB3 ALA B 5 10.941 4.793 -10.175 1.00 0.00 H new ATOM 1230 N ILE B 6 7.428 4.187 -8.312 1.00 0.00 N ATOM 1231 CA ILE B 6 6.175 4.923 -8.353 1.00 0.00 C ATOM 1232 C ILE B 6 6.148 6.032 -7.309 1.00 0.00 C ATOM 1233 O ILE B 6 6.251 5.778 -6.111 1.00 0.00 O ATOM 1234 CB ILE B 6 4.964 3.991 -8.141 1.00 0.00 C ATOM 1235 CG1 ILE B 6 5.030 2.805 -9.108 1.00 0.00 C ATOM 1236 CG2 ILE B 6 3.669 4.763 -8.336 1.00 0.00 C ATOM 1237 CD1 ILE B 6 3.910 1.803 -8.923 1.00 0.00 C ATOM 0 H ILE B 6 7.478 3.476 -7.582 1.00 0.00 H new ATOM 0 HA ILE B 6 6.106 5.369 -9.345 1.00 0.00 H new ATOM 0 HB ILE B 6 4.991 3.607 -7.121 1.00 0.00 H new ATOM 0 HG12 ILE B 6 5.004 3.180 -10.131 1.00 0.00 H new ATOM 0 HG13 ILE B 6 5.985 2.296 -8.979 1.00 0.00 H new ATOM 0 HG21 ILE B 6 2.821 4.095 -8.184 1.00 0.00 H new ATOM 0 HG22 ILE B 6 3.621 5.580 -7.617 1.00 0.00 H new ATOM 0 HG23 ILE B 6 3.635 5.168 -9.348 1.00 0.00 H new ATOM 0 HD11 ILE B 6 4.024 0.993 -9.643 1.00 0.00 H new ATOM 0 HD12 ILE B 6 3.947 1.398 -7.912 1.00 0.00 H new ATOM 0 HD13 ILE B 6 2.951 2.296 -9.081 1.00 0.00 H new ATOM 1249 N PHE B 7 6.001 7.258 -7.777 1.00 0.00 N ATOM 1250 CA PHE B 7 5.966 8.420 -6.906 1.00 0.00 C ATOM 1251 C PHE B 7 4.519 8.835 -6.650 1.00 0.00 C ATOM 1252 O PHE B 7 3.779 9.138 -7.585 1.00 0.00 O ATOM 1253 CB PHE B 7 6.750 9.568 -7.554 1.00 0.00 C ATOM 1254 CG PHE B 7 6.929 10.774 -6.675 1.00 0.00 C ATOM 1255 CD1 PHE B 7 7.923 10.802 -5.711 1.00 0.00 C ATOM 1256 CD2 PHE B 7 6.113 11.885 -6.822 1.00 0.00 C ATOM 1257 CE1 PHE B 7 8.099 11.910 -4.907 1.00 0.00 C ATOM 1258 CE2 PHE B 7 6.286 12.997 -6.022 1.00 0.00 C ATOM 1259 CZ PHE B 7 7.279 13.009 -5.064 1.00 0.00 C ATOM 0 H PHE B 7 5.903 7.477 -8.768 1.00 0.00 H new ATOM 0 HA PHE B 7 6.428 8.173 -5.950 1.00 0.00 H new ATOM 0 HB2 PHE B 7 7.733 9.199 -7.848 1.00 0.00 H new ATOM 0 HB3 PHE B 7 6.237 9.872 -8.466 1.00 0.00 H new ATOM 0 HD1 PHE B 7 8.569 9.945 -5.587 1.00 0.00 H new ATOM 0 HD2 PHE B 7 5.334 11.881 -7.570 1.00 0.00 H new ATOM 0 HE1 PHE B 7 8.876 11.917 -4.157 1.00 0.00 H new ATOM 0 HE2 PHE B 7 5.644 13.857 -6.146 1.00 0.00 H new ATOM 0 HZ PHE B 7 7.415 13.878 -4.437 1.00 0.00 H new ATOM 1269 N TYR B 8 4.117 8.835 -5.387 1.00 0.00 N ATOM 1270 CA TYR B 8 2.757 9.204 -5.015 1.00 0.00 C ATOM 1271 C TYR B 8 2.733 10.594 -4.400 1.00 0.00 C ATOM 1272 O TYR B 8 3.526 10.897 -3.503 1.00 0.00 O ATOM 1273 CB TYR B 8 2.168 8.197 -4.024 1.00 0.00 C ATOM 1274 CG TYR B 8 1.869 6.839 -4.621 1.00 0.00 C ATOM 1275 CD1 TYR B 8 0.677 6.610 -5.295 1.00 0.00 C ATOM 1276 CD2 TYR B 8 2.768 5.788 -4.500 1.00 0.00 C ATOM 1277 CE1 TYR B 8 0.391 5.370 -5.836 1.00 0.00 C ATOM 1278 CE2 TYR B 8 2.489 4.545 -5.038 1.00 0.00 C ATOM 1279 CZ TYR B 8 1.299 4.342 -5.704 1.00 0.00 C ATOM 1280 OH TYR B 8 1.016 3.105 -6.240 1.00 0.00 O ATOM 0 H TYR B 8 4.715 8.583 -4.600 1.00 0.00 H new ATOM 0 HA TYR B 8 2.151 9.200 -5.921 1.00 0.00 H new ATOM 0 HB2 TYR B 8 2.864 8.071 -3.195 1.00 0.00 H new ATOM 0 HB3 TYR B 8 1.248 8.609 -3.609 1.00 0.00 H new ATOM 0 HD1 TYR B 8 -0.038 7.413 -5.398 1.00 0.00 H new ATOM 0 HD2 TYR B 8 3.700 5.944 -3.977 1.00 0.00 H new ATOM 0 HE1 TYR B 8 -0.540 5.208 -6.360 1.00 0.00 H new ATOM 0 HE2 TYR B 8 3.199 3.738 -4.937 1.00 0.00 H new ATOM 0 HH TYR B 8 1.760 2.493 -6.060 1.00 0.00 H new ATOM 1290 N HIS B 9 1.831 11.440 -4.877 1.00 0.00 N ATOM 1291 CA HIS B 9 1.710 12.790 -4.348 1.00 0.00 C ATOM 1292 C HIS B 9 0.341 13.385 -4.667 1.00 0.00 C ATOM 1293 O HIS B 9 -0.496 12.742 -5.304 1.00 0.00 O ATOM 1294 CB HIS B 9 2.823 13.685 -4.907 1.00 0.00 C ATOM 1295 CG HIS B 9 2.642 14.082 -6.341 1.00 0.00 C ATOM 1296 ND1 HIS B 9 2.431 15.392 -6.690 1.00 0.00 N ATOM 1297 CD2 HIS B 9 2.656 13.322 -7.459 1.00 0.00 C ATOM 1298 CE1 HIS B 9 2.322 15.402 -8.007 1.00 0.00 C ATOM 1299 NE2 HIS B 9 2.452 14.171 -8.518 1.00 0.00 N ATOM 0 H HIS B 9 1.175 11.217 -5.626 1.00 0.00 H new ATOM 0 HA HIS B 9 1.812 12.737 -3.264 1.00 0.00 H new ATOM 0 HB2 HIS B 9 2.886 14.587 -4.299 1.00 0.00 H new ATOM 0 HB3 HIS B 9 3.775 13.165 -4.805 1.00 0.00 H new ATOM 0 HD2 HIS B 9 2.800 12.253 -7.509 1.00 0.00 H new ATOM 0 HE1 HIS B 9 2.150 16.290 -8.597 1.00 0.00 H new ATOM 0 HE2 HIS B 9 2.408 13.914 -9.504 1.00 0.00 H new ATOM 1307 N ALA B 10 0.123 14.619 -4.225 1.00 0.00 N ATOM 1308 CA ALA B 10 -1.149 15.296 -4.434 1.00 0.00 C ATOM 1309 C ALA B 10 -0.940 16.709 -4.979 1.00 0.00 C ATOM 1310 O ALA B 10 -1.797 17.577 -4.820 1.00 0.00 O ATOM 1311 CB ALA B 10 -1.935 15.339 -3.131 1.00 0.00 C ATOM 0 H ALA B 10 0.815 15.171 -3.718 1.00 0.00 H new ATOM 0 HA ALA B 10 -1.718 14.734 -5.175 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -2.885 15.847 -3.296 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -2.122 14.322 -2.785 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -1.361 15.878 -2.378 1.00 0.00 H new ATOM 1317 N GLY B 11 0.195 16.931 -5.633 1.00 0.00 N ATOM 1318 CA GLY B 11 0.474 18.233 -6.221 1.00 0.00 C ATOM 1319 C GLY B 11 0.953 19.249 -5.203 1.00 0.00 C ATOM 1320 O GLY B 11 0.839 20.458 -5.414 1.00 0.00 O ATOM 0 H GLY B 11 0.928 16.235 -5.768 1.00 0.00 H new ATOM 0 HA2 GLY B 11 1.230 18.121 -6.998 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -0.428 18.608 -6.705 1.00 0.00 H new ATOM 1324 N CYS B 12 1.495 18.759 -4.099 1.00 0.00 N ATOM 1325 CA CYS B 12 1.981 19.617 -3.030 1.00 0.00 C ATOM 1326 C CYS B 12 3.338 20.218 -3.402 1.00 0.00 C ATOM 1327 O CYS B 12 4.132 19.578 -4.087 1.00 0.00 O ATOM 1328 CB CYS B 12 2.109 18.803 -1.741 1.00 0.00 C ATOM 1329 SG CYS B 12 0.671 17.766 -1.384 1.00 0.00 S ATOM 0 H CYS B 12 1.610 17.762 -3.919 1.00 0.00 H new ATOM 0 HA CYS B 12 1.271 20.430 -2.879 1.00 0.00 H new ATOM 0 HB2 CYS B 12 2.994 18.170 -1.809 1.00 0.00 H new ATOM 0 HB3 CYS B 12 2.269 19.485 -0.906 1.00 0.00 H new ATOM 0 HG CYS B 12 0.871 17.113 -0.277 1.00 0.00 H new ATOM 1335 N PRO B 13 3.629 21.450 -2.951 1.00 0.00 N ATOM 1336 CA PRO B 13 4.912 22.114 -3.228 1.00 0.00 C ATOM 1337 C PRO B 13 6.112 21.262 -2.810 1.00 0.00 C ATOM 1338 O PRO B 13 7.184 21.340 -3.409 1.00 0.00 O ATOM 1339 CB PRO B 13 4.844 23.391 -2.386 1.00 0.00 C ATOM 1340 CG PRO B 13 3.387 23.654 -2.213 1.00 0.00 C ATOM 1341 CD PRO B 13 2.728 22.304 -2.155 1.00 0.00 C ATOM 0 HA PRO B 13 5.051 22.298 -4.293 1.00 0.00 H new ATOM 0 HB2 PRO B 13 5.339 23.258 -1.424 1.00 0.00 H new ATOM 0 HB3 PRO B 13 5.340 24.222 -2.887 1.00 0.00 H new ATOM 0 HG2 PRO B 13 3.198 24.220 -1.301 1.00 0.00 H new ATOM 0 HG3 PRO B 13 2.996 24.244 -3.042 1.00 0.00 H new ATOM 0 HD2 PRO B 13 2.636 21.945 -1.130 1.00 0.00 H new ATOM 0 HD3 PRO B 13 1.723 22.329 -2.575 1.00 0.00 H new ATOM 1349 N VAL B 14 5.908 20.437 -1.787 1.00 0.00 N ATOM 1350 CA VAL B 14 6.955 19.557 -1.278 1.00 0.00 C ATOM 1351 C VAL B 14 7.399 18.551 -2.340 1.00 0.00 C ATOM 1352 O VAL B 14 8.590 18.423 -2.630 1.00 0.00 O ATOM 1353 CB VAL B 14 6.476 18.791 -0.024 1.00 0.00 C ATOM 1354 CG1 VAL B 14 7.586 17.912 0.535 1.00 0.00 C ATOM 1355 CG2 VAL B 14 5.975 19.761 1.036 1.00 0.00 C ATOM 0 H VAL B 14 5.020 20.360 -1.291 1.00 0.00 H new ATOM 0 HA VAL B 14 7.802 20.190 -1.011 1.00 0.00 H new ATOM 0 HB VAL B 14 5.649 18.144 -0.318 1.00 0.00 H new ATOM 0 HG11 VAL B 14 7.223 17.384 1.417 1.00 0.00 H new ATOM 0 HG12 VAL B 14 7.893 17.189 -0.220 1.00 0.00 H new ATOM 0 HG13 VAL B 14 8.439 18.533 0.810 1.00 0.00 H new ATOM 0 HG21 VAL B 14 5.642 19.203 1.911 1.00 0.00 H new ATOM 0 HG22 VAL B 14 6.781 20.436 1.321 1.00 0.00 H new ATOM 0 HG23 VAL B 14 5.142 20.339 0.636 1.00 0.00 H new ATOM 1365 N CYS B 15 6.436 17.859 -2.937 1.00 0.00 N ATOM 1366 CA CYS B 15 6.744 16.817 -3.907 1.00 0.00 C ATOM 1367 C CYS B 15 7.166 17.413 -5.245 1.00 0.00 C ATOM 1368 O CYS B 15 7.819 16.747 -6.045 1.00 0.00 O ATOM 1369 CB CYS B 15 5.554 15.877 -4.083 1.00 0.00 C ATOM 1370 SG CYS B 15 3.974 16.709 -4.346 1.00 0.00 S ATOM 0 H CYS B 15 5.440 18.000 -2.767 1.00 0.00 H new ATOM 0 HA CYS B 15 7.584 16.240 -3.522 1.00 0.00 H new ATOM 0 HB2 CYS B 15 5.749 15.219 -4.930 1.00 0.00 H new ATOM 0 HB3 CYS B 15 5.474 15.244 -3.200 1.00 0.00 H new ATOM 0 HG CYS B 15 3.442 16.289 -5.455 1.00 0.00 H new ATOM 1376 N VAL B 16 6.799 18.670 -5.480 1.00 0.00 N ATOM 1377 CA VAL B 16 7.253 19.378 -6.670 1.00 0.00 C ATOM 1378 C VAL B 16 8.777 19.451 -6.676 1.00 0.00 C ATOM 1379 O VAL B 16 9.426 19.034 -7.634 1.00 0.00 O ATOM 1380 CB VAL B 16 6.666 20.806 -6.750 1.00 0.00 C ATOM 1381 CG1 VAL B 16 7.198 21.542 -7.972 1.00 0.00 C ATOM 1382 CG2 VAL B 16 5.146 20.762 -6.781 1.00 0.00 C ATOM 0 H VAL B 16 6.193 19.215 -4.866 1.00 0.00 H new ATOM 0 HA VAL B 16 6.901 18.823 -7.540 1.00 0.00 H new ATOM 0 HB VAL B 16 6.979 21.349 -5.858 1.00 0.00 H new ATOM 0 HG11 VAL B 16 6.771 22.544 -8.007 1.00 0.00 H new ATOM 0 HG12 VAL B 16 8.284 21.612 -7.910 1.00 0.00 H new ATOM 0 HG13 VAL B 16 6.920 20.997 -8.874 1.00 0.00 H new ATOM 0 HG21 VAL B 16 4.754 21.777 -6.837 1.00 0.00 H new ATOM 0 HG22 VAL B 16 4.816 20.197 -7.653 1.00 0.00 H new ATOM 0 HG23 VAL B 16 4.777 20.280 -5.875 1.00 0.00 H new ATOM 1392 N SER B 17 9.343 19.950 -5.581 1.00 0.00 N ATOM 1393 CA SER B 17 10.789 20.036 -5.435 1.00 0.00 C ATOM 1394 C SER B 17 11.426 18.648 -5.496 1.00 0.00 C ATOM 1395 O SER B 17 12.521 18.477 -6.037 1.00 0.00 O ATOM 1396 CB SER B 17 11.137 20.723 -4.114 1.00 0.00 C ATOM 1397 OG SER B 17 10.517 21.996 -4.031 1.00 0.00 O ATOM 0 H SER B 17 8.818 20.302 -4.780 1.00 0.00 H new ATOM 0 HA SER B 17 11.187 20.627 -6.260 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.814 20.101 -3.279 1.00 0.00 H new ATOM 0 HB3 SER B 17 12.218 20.834 -4.030 1.00 0.00 H new ATOM 0 HG SER B 17 10.750 22.419 -3.178 1.00 0.00 H new ATOM 1403 N ALA B 18 10.727 17.655 -4.955 1.00 0.00 N ATOM 1404 CA ALA B 18 11.208 16.281 -4.980 1.00 0.00 C ATOM 1405 C ALA B 18 11.313 15.771 -6.415 1.00 0.00 C ATOM 1406 O ALA B 18 12.254 15.060 -6.763 1.00 0.00 O ATOM 1407 CB ALA B 18 10.299 15.382 -4.155 1.00 0.00 C ATOM 0 H ALA B 18 9.825 17.778 -4.494 1.00 0.00 H new ATOM 0 HA ALA B 18 12.204 16.259 -4.538 1.00 0.00 H new ATOM 0 HB1 ALA B 18 10.674 14.359 -4.185 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.281 15.732 -3.123 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.290 15.411 -4.565 1.00 0.00 H new ATOM 1413 N GLU B 19 10.354 16.157 -7.247 1.00 0.00 N ATOM 1414 CA GLU B 19 10.346 15.758 -8.649 1.00 0.00 C ATOM 1415 C GLU B 19 11.489 16.433 -9.411 1.00 0.00 C ATOM 1416 O GLU B 19 12.033 15.871 -10.361 1.00 0.00 O ATOM 1417 CB GLU B 19 9.005 16.120 -9.295 1.00 0.00 C ATOM 1418 CG GLU B 19 8.852 15.601 -10.716 1.00 0.00 C ATOM 1419 CD GLU B 19 7.621 16.143 -11.411 1.00 0.00 C ATOM 1420 OE1 GLU B 19 6.506 15.674 -11.114 1.00 0.00 O ATOM 1421 OE2 GLU B 19 7.768 17.038 -12.273 1.00 0.00 O ATOM 0 H GLU B 19 9.569 16.748 -6.974 1.00 0.00 H new ATOM 0 HA GLU B 19 10.486 14.678 -8.697 1.00 0.00 H new ATOM 0 HB2 GLU B 19 8.197 15.720 -8.682 1.00 0.00 H new ATOM 0 HB3 GLU B 19 8.895 17.204 -9.300 1.00 0.00 H new ATOM 0 HG2 GLU B 19 9.737 15.870 -11.293 1.00 0.00 H new ATOM 0 HG3 GLU B 19 8.803 14.512 -10.697 1.00 0.00 H new ATOM 1428 N GLN B 20 11.858 17.631 -8.981 1.00 0.00 N ATOM 1429 CA GLN B 20 12.886 18.406 -9.670 1.00 0.00 C ATOM 1430 C GLN B 20 14.288 17.984 -9.240 1.00 0.00 C ATOM 1431 O GLN B 20 15.265 18.248 -9.938 1.00 0.00 O ATOM 1432 CB GLN B 20 12.703 19.900 -9.395 1.00 0.00 C ATOM 1433 CG GLN B 20 11.285 20.398 -9.615 1.00 0.00 C ATOM 1434 CD GLN B 20 11.132 21.877 -9.315 1.00 0.00 C ATOM 1435 OE1 GLN B 20 11.874 22.442 -8.511 1.00 0.00 O ATOM 1436 NE2 GLN B 20 10.146 22.504 -9.931 1.00 0.00 N ATOM 0 H GLN B 20 11.463 18.089 -8.160 1.00 0.00 H new ATOM 0 HA GLN B 20 12.777 18.213 -10.737 1.00 0.00 H new ATOM 0 HB2 GLN B 20 12.995 20.108 -8.366 1.00 0.00 H new ATOM 0 HB3 GLN B 20 13.379 20.463 -10.038 1.00 0.00 H new ATOM 0 HG2 GLN B 20 10.994 20.209 -10.648 1.00 0.00 H new ATOM 0 HG3 GLN B 20 10.602 19.830 -8.982 1.00 0.00 H new ATOM 0 HE21 GLN B 20 9.554 21.999 -10.590 1.00 0.00 H new ATOM 0 HE22 GLN B 20 9.977 23.493 -9.747 1.00 0.00 H new ATOM 1445 N ALA B 21 14.392 17.345 -8.086 1.00 0.00 N ATOM 1446 CA ALA B 21 15.696 16.965 -7.560 1.00 0.00 C ATOM 1447 C ALA B 21 15.849 15.454 -7.457 1.00 0.00 C ATOM 1448 O ALA B 21 16.709 14.869 -8.109 1.00 0.00 O ATOM 1449 CB ALA B 21 15.929 17.619 -6.208 1.00 0.00 C ATOM 0 H ALA B 21 13.600 17.080 -7.500 1.00 0.00 H new ATOM 0 HA ALA B 21 16.451 17.320 -8.262 1.00 0.00 H new ATOM 0 HB1 ALA B 21 16.907 17.327 -5.826 1.00 0.00 H new ATOM 0 HB2 ALA B 21 15.891 18.703 -6.317 1.00 0.00 H new ATOM 0 HB3 ALA B 21 15.156 17.297 -5.510 1.00 0.00 H new ATOM 1455 N VAL B 22 15.004 14.820 -6.653 1.00 0.00 N ATOM 1456 CA VAL B 22 15.117 13.386 -6.402 1.00 0.00 C ATOM 1457 C VAL B 22 14.823 12.585 -7.666 1.00 0.00 C ATOM 1458 O VAL B 22 15.507 11.607 -7.962 1.00 0.00 O ATOM 1459 CB VAL B 22 14.169 12.925 -5.277 1.00 0.00 C ATOM 1460 CG1 VAL B 22 14.392 11.456 -4.952 1.00 0.00 C ATOM 1461 CG2 VAL B 22 14.356 13.781 -4.035 1.00 0.00 C ATOM 0 H VAL B 22 14.233 15.275 -6.163 1.00 0.00 H new ATOM 0 HA VAL B 22 16.144 13.203 -6.087 1.00 0.00 H new ATOM 0 HB VAL B 22 13.143 13.045 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL B 22 13.713 11.152 -4.156 1.00 0.00 H new ATOM 0 HG12 VAL B 22 14.202 10.854 -5.840 1.00 0.00 H new ATOM 0 HG13 VAL B 22 15.422 11.308 -4.627 1.00 0.00 H new ATOM 0 HG21 VAL B 22 13.678 13.440 -3.253 1.00 0.00 H new ATOM 0 HG22 VAL B 22 15.385 13.696 -3.686 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.139 14.822 -4.275 1.00 0.00 H new ATOM 1471 N ALA B 23 13.823 13.019 -8.421 1.00 0.00 N ATOM 1472 CA ALA B 23 13.442 12.326 -9.646 1.00 0.00 C ATOM 1473 C ALA B 23 14.460 12.567 -10.761 1.00 0.00 C ATOM 1474 O ALA B 23 14.381 11.960 -11.827 1.00 0.00 O ATOM 1475 CB ALA B 23 12.049 12.752 -10.085 1.00 0.00 C ATOM 0 H ALA B 23 13.262 13.844 -8.209 1.00 0.00 H new ATOM 0 HA ALA B 23 13.429 11.256 -9.438 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.779 12.226 -11.001 1.00 0.00 H new ATOM 0 HB2 ALA B 23 11.331 12.509 -9.302 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.038 13.827 -10.267 1.00 0.00 H new ATOM 1481 N ASN B 24 15.403 13.472 -10.522 1.00 0.00 N ATOM 1482 CA ASN B 24 16.510 13.674 -11.450 1.00 0.00 C ATOM 1483 C ASN B 24 17.795 13.084 -10.882 1.00 0.00 C ATOM 1484 O ASN B 24 18.818 13.011 -11.567 1.00 0.00 O ATOM 1485 CB ASN B 24 16.703 15.157 -11.777 1.00 0.00 C ATOM 1486 CG ASN B 24 15.562 15.732 -12.599 1.00 0.00 C ATOM 1487 OD1 ASN B 24 14.886 14.884 -13.365 1.00 0.00 O flip ATOM 1488 ND2 ASN B 24 15.285 16.927 -12.540 1.00 0.00 N flip ATOM 0 H ASN B 24 15.424 14.074 -9.699 1.00 0.00 H new ATOM 0 HA ASN B 24 16.265 13.157 -12.378 1.00 0.00 H new ATOM 0 HB2 ASN B 24 16.795 15.720 -10.848 1.00 0.00 H new ATOM 0 HB3 ASN B 24 17.638 15.285 -12.322 1.00 0.00 H new ATOM 0 HD21 ASN B 24 15.828 17.547 -11.939 1.00 0.00 H new ATOM 0 HD22 ASN B 24 14.512 17.299 -13.092 1.00 0.00 H new ATOM 1495 N ALA B 25 17.740 12.680 -9.620 1.00 0.00 N ATOM 1496 CA ALA B 25 18.840 11.964 -8.997 1.00 0.00 C ATOM 1497 C ALA B 25 18.711 10.486 -9.318 1.00 0.00 C ATOM 1498 O ALA B 25 19.684 9.822 -9.679 1.00 0.00 O ATOM 1499 CB ALA B 25 18.853 12.194 -7.495 1.00 0.00 C ATOM 0 H ALA B 25 16.940 12.838 -9.007 1.00 0.00 H new ATOM 0 HA ALA B 25 19.785 12.338 -9.392 1.00 0.00 H new ATOM 0 HB1 ALA B 25 19.685 11.648 -7.051 1.00 0.00 H new ATOM 0 HB2 ALA B 25 18.967 13.259 -7.291 1.00 0.00 H new ATOM 0 HB3 ALA B 25 17.916 11.841 -7.065 1.00 0.00 H new ATOM 1505 N ILE B 26 17.492 9.982 -9.187 1.00 0.00 N ATOM 1506 CA ILE B 26 17.161 8.651 -9.653 1.00 0.00 C ATOM 1507 C ILE B 26 16.959 8.708 -11.159 1.00 0.00 C ATOM 1508 O ILE B 26 15.970 9.263 -11.635 1.00 0.00 O ATOM 1509 CB ILE B 26 15.882 8.107 -8.978 1.00 0.00 C ATOM 1510 CG1 ILE B 26 16.061 8.074 -7.455 1.00 0.00 C ATOM 1511 CG2 ILE B 26 15.546 6.719 -9.511 1.00 0.00 C ATOM 1512 CD1 ILE B 26 14.821 7.634 -6.705 1.00 0.00 C ATOM 0 H ILE B 26 16.714 10.482 -8.758 1.00 0.00 H new ATOM 0 HA ILE B 26 17.978 7.977 -9.394 1.00 0.00 H new ATOM 0 HB ILE B 26 15.052 8.772 -9.215 1.00 0.00 H new ATOM 0 HG12 ILE B 26 16.882 7.400 -7.209 1.00 0.00 H new ATOM 0 HG13 ILE B 26 16.350 9.067 -7.111 1.00 0.00 H new ATOM 0 HG21 ILE B 26 14.642 6.351 -9.025 1.00 0.00 H new ATOM 0 HG22 ILE B 26 15.383 6.772 -10.587 1.00 0.00 H new ATOM 0 HG23 ILE B 26 16.372 6.039 -9.303 1.00 0.00 H new ATOM 0 HD11 ILE B 26 15.024 7.635 -5.634 1.00 0.00 H new ATOM 0 HD12 ILE B 26 14.003 8.321 -6.920 1.00 0.00 H new ATOM 0 HD13 ILE B 26 14.543 6.628 -7.020 1.00 0.00 H new ATOM 1524 N ASP B 27 17.919 8.171 -11.898 1.00 0.00 N ATOM 1525 CA ASP B 27 17.921 8.281 -13.353 1.00 0.00 C ATOM 1526 C ASP B 27 16.654 7.673 -13.955 1.00 0.00 C ATOM 1527 O ASP B 27 16.358 6.497 -13.736 1.00 0.00 O ATOM 1528 CB ASP B 27 19.158 7.598 -13.934 1.00 0.00 C ATOM 1529 CG ASP B 27 19.365 7.934 -15.394 1.00 0.00 C ATOM 1530 OD1 ASP B 27 18.803 7.230 -16.261 1.00 0.00 O ATOM 1531 OD2 ASP B 27 20.099 8.902 -15.678 1.00 0.00 O ATOM 0 H ASP B 27 18.709 7.653 -11.514 1.00 0.00 H new ATOM 0 HA ASP B 27 17.945 9.340 -13.610 1.00 0.00 H new ATOM 0 HB2 ASP B 27 20.038 7.900 -13.366 1.00 0.00 H new ATOM 0 HB3 ASP B 27 19.061 6.518 -13.822 1.00 0.00 H new ATOM 1536 N PRO B 28 15.896 8.474 -14.724 1.00 0.00 N ATOM 1537 CA PRO B 28 14.616 8.050 -15.316 1.00 0.00 C ATOM 1538 C PRO B 28 14.765 6.898 -16.308 1.00 0.00 C ATOM 1539 O PRO B 28 13.784 6.233 -16.650 1.00 0.00 O ATOM 1540 CB PRO B 28 14.111 9.307 -16.038 1.00 0.00 C ATOM 1541 CG PRO B 28 14.876 10.437 -15.442 1.00 0.00 C ATOM 1542 CD PRO B 28 16.212 9.872 -15.062 1.00 0.00 C ATOM 0 HA PRO B 28 13.936 7.674 -14.551 1.00 0.00 H new ATOM 0 HB2 PRO B 28 14.283 9.239 -17.112 1.00 0.00 H new ATOM 0 HB3 PRO B 28 13.039 9.439 -15.894 1.00 0.00 H new ATOM 0 HG2 PRO B 28 14.986 11.254 -16.155 1.00 0.00 H new ATOM 0 HG3 PRO B 28 14.361 10.841 -14.571 1.00 0.00 H new ATOM 0 HD2 PRO B 28 16.926 9.937 -15.883 1.00 0.00 H new ATOM 0 HD3 PRO B 28 16.649 10.403 -14.216 1.00 0.00 H new ATOM 1550 N SER B 29 15.983 6.673 -16.779 1.00 0.00 N ATOM 1551 CA SER B 29 16.250 5.587 -17.707 1.00 0.00 C ATOM 1552 C SER B 29 16.918 4.420 -16.983 1.00 0.00 C ATOM 1553 O SER B 29 17.114 3.347 -17.556 1.00 0.00 O ATOM 1554 CB SER B 29 17.129 6.085 -18.853 1.00 0.00 C ATOM 1555 OG SER B 29 16.549 7.219 -19.483 1.00 0.00 O ATOM 0 H SER B 29 16.802 7.229 -16.533 1.00 0.00 H new ATOM 0 HA SER B 29 15.305 5.235 -18.120 1.00 0.00 H new ATOM 0 HB2 SER B 29 18.118 6.342 -18.473 1.00 0.00 H new ATOM 0 HB3 SER B 29 17.266 5.288 -19.584 1.00 0.00 H new ATOM 0 HG SER B 29 17.130 7.521 -20.212 1.00 0.00 H new ATOM 1561 N LYS B 30 17.266 4.644 -15.724 1.00 0.00 N ATOM 1562 CA LYS B 30 17.833 3.600 -14.883 1.00 0.00 C ATOM 1563 C LYS B 30 16.708 2.847 -14.185 1.00 0.00 C ATOM 1564 O LYS B 30 16.774 1.632 -13.995 1.00 0.00 O ATOM 1565 CB LYS B 30 18.774 4.212 -13.842 1.00 0.00 C ATOM 1566 CG LYS B 30 19.452 3.194 -12.941 1.00 0.00 C ATOM 1567 CD LYS B 30 20.058 3.865 -11.720 1.00 0.00 C ATOM 1568 CE LYS B 30 20.740 2.861 -10.804 1.00 0.00 C ATOM 1569 NZ LYS B 30 22.001 2.341 -11.388 1.00 0.00 N ATOM 0 H LYS B 30 17.164 5.547 -15.260 1.00 0.00 H new ATOM 0 HA LYS B 30 18.403 2.909 -15.505 1.00 0.00 H new ATOM 0 HB2 LYS B 30 19.540 4.792 -14.357 1.00 0.00 H new ATOM 0 HB3 LYS B 30 18.209 4.909 -13.223 1.00 0.00 H new ATOM 0 HG2 LYS B 30 18.728 2.443 -12.626 1.00 0.00 H new ATOM 0 HG3 LYS B 30 20.231 2.672 -13.497 1.00 0.00 H new ATOM 0 HD2 LYS B 30 20.781 4.616 -12.039 1.00 0.00 H new ATOM 0 HD3 LYS B 30 19.277 4.389 -11.168 1.00 0.00 H new ATOM 0 HE2 LYS B 30 20.952 3.332 -9.844 1.00 0.00 H new ATOM 0 HE3 LYS B 30 20.062 2.030 -10.608 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 22.610 1.974 -10.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 21.784 1.576 -12.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 22.495 3.108 -11.887 1.00 0.00 H new ATOM 1583 N TYR B 31 15.687 3.592 -13.790 1.00 0.00 N ATOM 1584 CA TYR B 31 14.489 3.021 -13.199 1.00 0.00 C ATOM 1585 C TYR B 31 13.258 3.676 -13.799 1.00 0.00 C ATOM 1586 O TYR B 31 13.246 4.883 -14.038 1.00 0.00 O ATOM 1587 CB TYR B 31 14.487 3.188 -11.674 1.00 0.00 C ATOM 1588 CG TYR B 31 15.424 2.242 -10.956 1.00 0.00 C ATOM 1589 CD1 TYR B 31 15.059 0.921 -10.727 1.00 0.00 C ATOM 1590 CD2 TYR B 31 16.673 2.660 -10.520 1.00 0.00 C ATOM 1591 CE1 TYR B 31 15.909 0.047 -10.082 1.00 0.00 C ATOM 1592 CE2 TYR B 31 17.532 1.789 -9.877 1.00 0.00 C ATOM 1593 CZ TYR B 31 17.144 0.484 -9.661 1.00 0.00 C ATOM 1594 OH TYR B 31 17.999 -0.393 -9.035 1.00 0.00 O ATOM 0 H TYR B 31 15.667 4.609 -13.871 1.00 0.00 H new ATOM 0 HA TYR B 31 14.475 1.953 -13.419 1.00 0.00 H new ATOM 0 HB2 TYR B 31 14.763 4.214 -11.430 1.00 0.00 H new ATOM 0 HB3 TYR B 31 13.474 3.034 -11.302 1.00 0.00 H new ATOM 0 HD1 TYR B 31 14.093 0.572 -11.060 1.00 0.00 H new ATOM 0 HD2 TYR B 31 16.979 3.682 -10.686 1.00 0.00 H new ATOM 0 HE1 TYR B 31 15.607 -0.975 -9.908 1.00 0.00 H new ATOM 0 HE2 TYR B 31 18.502 2.129 -9.546 1.00 0.00 H new ATOM 0 HH TYR B 31 18.830 0.071 -8.801 1.00 0.00 H new ATOM 1604 N THR B 32 12.231 2.880 -14.056 1.00 0.00 N ATOM 1605 CA THR B 32 10.993 3.397 -14.614 1.00 0.00 C ATOM 1606 C THR B 32 10.254 4.235 -13.578 1.00 0.00 C ATOM 1607 O THR B 32 9.531 3.706 -12.731 1.00 0.00 O ATOM 1608 CB THR B 32 10.082 2.255 -15.112 1.00 0.00 C ATOM 1609 OG1 THR B 32 10.792 1.438 -16.052 1.00 0.00 O ATOM 1610 CG2 THR B 32 8.821 2.798 -15.769 1.00 0.00 C ATOM 0 H THR B 32 12.231 1.874 -13.887 1.00 0.00 H new ATOM 0 HA THR B 32 11.250 4.025 -15.467 1.00 0.00 H new ATOM 0 HB THR B 32 9.791 1.659 -14.247 1.00 0.00 H new ATOM 0 HG1 THR B 32 10.913 0.540 -15.679 1.00 0.00 H new ATOM 0 HG21 THR B 32 8.201 1.968 -16.109 1.00 0.00 H new ATOM 0 HG22 THR B 32 8.264 3.396 -15.048 1.00 0.00 H new ATOM 0 HG23 THR B 32 9.094 3.420 -16.622 1.00 0.00 H new ATOM 1618 N VAL B 33 10.469 5.541 -13.627 1.00 0.00 N ATOM 1619 CA VAL B 33 9.825 6.455 -12.702 1.00 0.00 C ATOM 1620 C VAL B 33 8.403 6.744 -13.160 1.00 0.00 C ATOM 1621 O VAL B 33 8.189 7.325 -14.229 1.00 0.00 O ATOM 1622 CB VAL B 33 10.608 7.782 -12.574 1.00 0.00 C ATOM 1623 CG1 VAL B 33 9.949 8.702 -11.555 1.00 0.00 C ATOM 1624 CG2 VAL B 33 12.058 7.517 -12.201 1.00 0.00 C ATOM 0 H VAL B 33 11.088 5.991 -14.302 1.00 0.00 H new ATOM 0 HA VAL B 33 9.807 5.976 -11.723 1.00 0.00 H new ATOM 0 HB VAL B 33 10.591 8.281 -13.543 1.00 0.00 H new ATOM 0 HG11 VAL B 33 10.517 9.629 -11.481 1.00 0.00 H new ATOM 0 HG12 VAL B 33 8.930 8.925 -11.871 1.00 0.00 H new ATOM 0 HG13 VAL B 33 9.928 8.211 -10.582 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.591 8.464 -12.116 1.00 0.00 H new ATOM 0 HG22 VAL B 33 12.098 6.991 -11.247 1.00 0.00 H new ATOM 0 HG23 VAL B 33 12.526 6.905 -12.972 1.00 0.00 H new ATOM 1634 N GLU B 34 7.442 6.319 -12.363 1.00 0.00 N ATOM 1635 CA GLU B 34 6.043 6.516 -12.679 1.00 0.00 C ATOM 1636 C GLU B 34 5.395 7.351 -11.584 1.00 0.00 C ATOM 1637 O GLU B 34 5.475 7.007 -10.410 1.00 0.00 O ATOM 1638 CB GLU B 34 5.338 5.165 -12.816 1.00 0.00 C ATOM 1639 CG GLU B 34 4.090 5.217 -13.678 1.00 0.00 C ATOM 1640 CD GLU B 34 4.392 5.672 -15.091 1.00 0.00 C ATOM 1641 OE1 GLU B 34 4.874 4.846 -15.898 1.00 0.00 O ATOM 1642 OE2 GLU B 34 4.169 6.860 -15.400 1.00 0.00 O ATOM 0 H GLU B 34 7.609 5.830 -11.483 1.00 0.00 H new ATOM 0 HA GLU B 34 5.954 7.043 -13.629 1.00 0.00 H new ATOM 0 HB2 GLU B 34 6.034 4.443 -13.242 1.00 0.00 H new ATOM 0 HB3 GLU B 34 5.070 4.802 -11.824 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.628 4.230 -13.706 1.00 0.00 H new ATOM 0 HG3 GLU B 34 3.366 5.895 -13.226 1.00 0.00 H new ATOM 1649 N ILE B 35 4.782 8.456 -11.961 1.00 0.00 N ATOM 1650 CA ILE B 35 4.235 9.383 -10.983 1.00 0.00 C ATOM 1651 C ILE B 35 2.711 9.327 -10.958 1.00 0.00 C ATOM 1652 O ILE B 35 2.055 9.505 -11.984 1.00 0.00 O ATOM 1653 CB ILE B 35 4.709 10.824 -11.266 1.00 0.00 C ATOM 1654 CG1 ILE B 35 6.242 10.883 -11.240 1.00 0.00 C ATOM 1655 CG2 ILE B 35 4.116 11.794 -10.254 1.00 0.00 C ATOM 1656 CD1 ILE B 35 6.810 12.250 -11.550 1.00 0.00 C ATOM 0 H ILE B 35 4.649 8.735 -12.933 1.00 0.00 H new ATOM 0 HA ILE B 35 4.604 9.080 -10.003 1.00 0.00 H new ATOM 0 HB ILE B 35 4.363 11.119 -12.256 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.591 10.571 -10.256 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.635 10.166 -11.960 1.00 0.00 H new ATOM 0 HG21 ILE B 35 4.463 12.804 -10.472 1.00 0.00 H new ATOM 0 HG22 ILE B 35 3.028 11.763 -10.315 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.432 11.510 -9.250 1.00 0.00 H new ATOM 0 HD11 ILE B 35 7.899 12.209 -11.512 1.00 0.00 H new ATOM 0 HD12 ILE B 35 6.493 12.558 -12.546 1.00 0.00 H new ATOM 0 HD13 ILE B 35 6.448 12.969 -10.816 1.00 0.00 H new ATOM 1668 N VAL B 36 2.160 9.075 -9.779 1.00 0.00 N ATOM 1669 CA VAL B 36 0.719 9.000 -9.599 1.00 0.00 C ATOM 1670 C VAL B 36 0.215 10.224 -8.843 1.00 0.00 C ATOM 1671 O VAL B 36 0.676 10.525 -7.740 1.00 0.00 O ATOM 1672 CB VAL B 36 0.303 7.719 -8.843 1.00 0.00 C ATOM 1673 CG1 VAL B 36 -1.204 7.671 -8.640 1.00 0.00 C ATOM 1674 CG2 VAL B 36 0.779 6.481 -9.588 1.00 0.00 C ATOM 0 H VAL B 36 2.696 8.918 -8.926 1.00 0.00 H new ATOM 0 HA VAL B 36 0.269 8.971 -10.591 1.00 0.00 H new ATOM 0 HB VAL B 36 0.777 7.738 -7.862 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -1.470 6.759 -8.105 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -1.521 8.538 -8.060 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -1.702 7.682 -9.609 1.00 0.00 H new ATOM 0 HG21 VAL B 36 0.477 5.588 -9.040 1.00 0.00 H new ATOM 0 HG22 VAL B 36 0.336 6.463 -10.584 1.00 0.00 H new ATOM 0 HG23 VAL B 36 1.865 6.503 -9.674 1.00 0.00 H new ATOM 1684 N HIS B 37 -0.727 10.928 -9.449 1.00 0.00 N ATOM 1685 CA HIS B 37 -1.271 12.144 -8.872 1.00 0.00 C ATOM 1686 C HIS B 37 -2.643 11.864 -8.260 1.00 0.00 C ATOM 1687 O HIS B 37 -3.568 11.439 -8.961 1.00 0.00 O ATOM 1688 CB HIS B 37 -1.385 13.217 -9.959 1.00 0.00 C ATOM 1689 CG HIS B 37 -1.428 14.622 -9.448 1.00 0.00 C ATOM 1690 ND1 HIS B 37 -2.293 15.008 -8.455 1.00 0.00 N ATOM 1691 CD2 HIS B 37 -0.698 15.694 -9.836 1.00 0.00 C ATOM 1692 CE1 HIS B 37 -2.076 16.298 -8.269 1.00 0.00 C ATOM 1693 NE2 HIS B 37 -1.117 16.759 -9.083 1.00 0.00 N ATOM 0 H HIS B 37 -1.133 10.674 -10.349 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.606 12.500 -8.085 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.539 13.118 -10.639 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -2.286 13.029 -10.543 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.070 15.707 -10.596 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -2.606 16.905 -7.550 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -0.767 17.716 -9.132 1.00 0.00 H new ATOM 1701 N LEU B 38 -2.778 12.096 -6.958 1.00 0.00 N ATOM 1702 CA LEU B 38 -4.044 11.861 -6.264 1.00 0.00 C ATOM 1703 C LEU B 38 -5.088 12.902 -6.654 1.00 0.00 C ATOM 1704 O LEU B 38 -6.280 12.725 -6.407 1.00 0.00 O ATOM 1705 CB LEU B 38 -3.850 11.869 -4.746 1.00 0.00 C ATOM 1706 CG LEU B 38 -2.976 10.744 -4.189 1.00 0.00 C ATOM 1707 CD1 LEU B 38 -2.960 10.790 -2.671 1.00 0.00 C ATOM 1708 CD2 LEU B 38 -3.468 9.389 -4.673 1.00 0.00 C ATOM 0 H LEU B 38 -2.029 12.446 -6.361 1.00 0.00 H new ATOM 0 HA LEU B 38 -4.401 10.877 -6.568 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -3.410 12.824 -4.458 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -4.830 11.813 -4.271 1.00 0.00 H new ATOM 0 HG LEU B 38 -1.959 10.888 -4.554 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -2.334 9.983 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -2.559 11.748 -2.340 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -3.975 10.671 -2.293 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.832 8.604 -4.265 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -4.494 9.234 -4.340 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -3.431 9.356 -5.762 1.00 0.00 H new ATOM 1720 N GLY B 39 -4.630 13.983 -7.271 1.00 0.00 N ATOM 1721 CA GLY B 39 -5.534 15.016 -7.732 1.00 0.00 C ATOM 1722 C GLY B 39 -6.364 14.548 -8.906 1.00 0.00 C ATOM 1723 O GLY B 39 -7.425 15.105 -9.190 1.00 0.00 O ATOM 0 H GLY B 39 -3.644 14.163 -7.461 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -6.193 15.314 -6.916 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -4.962 15.899 -8.019 1.00 0.00 H new ATOM 1727 N THR B 40 -5.882 13.519 -9.590 1.00 0.00 N ATOM 1728 CA THR B 40 -6.618 12.923 -10.688 1.00 0.00 C ATOM 1729 C THR B 40 -7.642 11.923 -10.160 1.00 0.00 C ATOM 1730 O THR B 40 -8.846 12.080 -10.370 1.00 0.00 O ATOM 1731 CB THR B 40 -5.674 12.211 -11.676 1.00 0.00 C ATOM 1732 OG1 THR B 40 -4.669 13.126 -12.135 1.00 0.00 O ATOM 1733 CG2 THR B 40 -6.446 11.662 -12.866 1.00 0.00 C ATOM 0 H THR B 40 -4.981 13.081 -9.400 1.00 0.00 H new ATOM 0 HA THR B 40 -7.130 13.728 -11.215 1.00 0.00 H new ATOM 0 HB THR B 40 -5.201 11.378 -11.156 1.00 0.00 H new ATOM 0 HG1 THR B 40 -4.071 12.668 -12.761 1.00 0.00 H new ATOM 0 HG21 THR B 40 -5.757 11.164 -13.548 1.00 0.00 H new ATOM 0 HG22 THR B 40 -7.191 10.947 -12.518 1.00 0.00 H new ATOM 0 HG23 THR B 40 -6.944 12.481 -13.386 1.00 0.00 H new ATOM 1741 N ASP B 41 -7.161 10.906 -9.457 1.00 0.00 N ATOM 1742 CA ASP B 41 -8.035 9.859 -8.947 1.00 0.00 C ATOM 1743 C ASP B 41 -7.888 9.710 -7.442 1.00 0.00 C ATOM 1744 O ASP B 41 -6.817 9.363 -6.948 1.00 0.00 O ATOM 1745 CB ASP B 41 -7.740 8.510 -9.611 1.00 0.00 C ATOM 1746 CG ASP B 41 -8.156 8.451 -11.065 1.00 0.00 C ATOM 1747 OD1 ASP B 41 -9.332 8.749 -11.367 1.00 0.00 O ATOM 1748 OD2 ASP B 41 -7.311 8.088 -11.912 1.00 0.00 O ATOM 0 H ASP B 41 -6.175 10.784 -9.228 1.00 0.00 H new ATOM 0 HA ASP B 41 -9.056 10.157 -9.184 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.672 8.303 -9.538 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -8.256 7.723 -9.061 1.00 0.00 H new ATOM 1753 N LYS B 42 -8.972 9.958 -6.720 1.00 0.00 N ATOM 1754 CA LYS B 42 -8.992 9.739 -5.280 1.00 0.00 C ATOM 1755 C LYS B 42 -9.001 8.244 -4.981 1.00 0.00 C ATOM 1756 O LYS B 42 -8.713 7.816 -3.866 1.00 0.00 O ATOM 1757 CB LYS B 42 -10.209 10.412 -4.639 1.00 0.00 C ATOM 1758 CG LYS B 42 -10.195 11.928 -4.750 1.00 0.00 C ATOM 1759 CD LYS B 42 -11.370 12.556 -4.014 1.00 0.00 C ATOM 1760 CE LYS B 42 -11.345 14.073 -4.120 1.00 0.00 C ATOM 1761 NZ LYS B 42 -12.458 14.706 -3.365 1.00 0.00 N ATOM 0 H LYS B 42 -9.848 10.310 -7.107 1.00 0.00 H new ATOM 0 HA LYS B 42 -8.094 10.185 -4.853 1.00 0.00 H new ATOM 0 HB2 LYS B 42 -11.115 10.030 -5.110 1.00 0.00 H new ATOM 0 HB3 LYS B 42 -10.255 10.134 -3.586 1.00 0.00 H new ATOM 0 HG2 LYS B 42 -9.261 12.314 -4.342 1.00 0.00 H new ATOM 0 HG3 LYS B 42 -10.227 12.217 -5.801 1.00 0.00 H new ATOM 0 HD2 LYS B 42 -12.305 12.176 -4.427 1.00 0.00 H new ATOM 0 HD3 LYS B 42 -11.343 12.263 -2.965 1.00 0.00 H new ATOM 0 HE2 LYS B 42 -10.393 14.446 -3.742 1.00 0.00 H new ATOM 0 HE3 LYS B 42 -11.408 14.364 -5.169 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 -12.527 15.711 -3.625 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 -13.351 14.227 -3.597 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 -12.276 14.624 -2.344 1.00 0.00 H new ATOM 1775 N ALA B 43 -9.321 7.453 -5.999 1.00 0.00 N ATOM 1776 CA ALA B 43 -9.308 6.002 -5.884 1.00 0.00 C ATOM 1777 C ALA B 43 -7.886 5.479 -5.698 1.00 0.00 C ATOM 1778 O ALA B 43 -7.681 4.377 -5.188 1.00 0.00 O ATOM 1779 CB ALA B 43 -9.942 5.372 -7.113 1.00 0.00 C ATOM 0 H ALA B 43 -9.594 7.797 -6.919 1.00 0.00 H new ATOM 0 HA ALA B 43 -9.889 5.727 -5.004 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -9.926 4.287 -7.015 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -10.973 5.713 -7.206 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -9.382 5.664 -8.001 1.00 0.00 H new ATOM 1785 N ARG B 44 -6.907 6.290 -6.092 1.00 0.00 N ATOM 1786 CA ARG B 44 -5.503 5.897 -6.016 1.00 0.00 C ATOM 1787 C ARG B 44 -5.019 5.845 -4.568 1.00 0.00 C ATOM 1788 O ARG B 44 -3.951 5.304 -4.287 1.00 0.00 O ATOM 1789 CB ARG B 44 -4.623 6.865 -6.812 1.00 0.00 C ATOM 1790 CG ARG B 44 -4.946 6.934 -8.296 1.00 0.00 C ATOM 1791 CD ARG B 44 -4.653 5.624 -9.009 1.00 0.00 C ATOM 1792 NE ARG B 44 -4.865 5.734 -10.454 1.00 0.00 N ATOM 1793 CZ ARG B 44 -4.794 4.706 -11.302 1.00 0.00 C ATOM 1794 NH1 ARG B 44 -4.589 3.475 -10.858 1.00 0.00 N ATOM 1795 NH2 ARG B 44 -4.953 4.907 -12.602 1.00 0.00 N ATOM 0 H ARG B 44 -7.061 7.226 -6.468 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.422 4.900 -6.448 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -4.723 7.863 -6.384 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -3.580 6.570 -6.693 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -5.998 7.189 -8.426 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -4.365 7.734 -8.756 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -3.623 5.326 -8.814 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -5.293 4.839 -8.606 1.00 0.00 H new ATOM 0 HE ARG B 44 -5.081 6.655 -10.836 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -4.483 3.305 -9.858 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -4.537 2.698 -11.516 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -5.130 5.848 -12.955 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -4.899 4.121 -13.250 1.00 0.00 H new ATOM 1809 N ILE B 45 -5.804 6.412 -3.653 1.00 0.00 N ATOM 1810 CA ILE B 45 -5.451 6.421 -2.236 1.00 0.00 C ATOM 1811 C ILE B 45 -5.337 4.997 -1.696 1.00 0.00 C ATOM 1812 O ILE B 45 -4.323 4.631 -1.100 1.00 0.00 O ATOM 1813 CB ILE B 45 -6.477 7.218 -1.396 1.00 0.00 C ATOM 1814 CG1 ILE B 45 -6.455 8.697 -1.800 1.00 0.00 C ATOM 1815 CG2 ILE B 45 -6.193 7.068 0.095 1.00 0.00 C ATOM 1816 CD1 ILE B 45 -7.466 9.548 -1.060 1.00 0.00 C ATOM 0 H ILE B 45 -6.689 6.871 -3.869 1.00 0.00 H new ATOM 0 HA ILE B 45 -4.483 6.915 -2.150 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.470 6.814 -1.593 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.457 9.098 -1.622 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -6.643 8.774 -2.871 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.928 7.637 0.664 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.255 6.016 0.373 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -5.194 7.443 0.315 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -7.390 10.581 -1.400 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -8.471 9.174 -1.258 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -7.266 9.502 0.011 1.00 0.00 H new ATOM 1828 N ALA B 46 -6.367 4.190 -1.937 1.00 0.00 N ATOM 1829 CA ALA B 46 -6.379 2.804 -1.479 1.00 0.00 C ATOM 1830 C ALA B 46 -5.261 2.005 -2.142 1.00 0.00 C ATOM 1831 O ALA B 46 -4.686 1.093 -1.542 1.00 0.00 O ATOM 1832 CB ALA B 46 -7.732 2.168 -1.763 1.00 0.00 C ATOM 0 H ALA B 46 -7.204 4.472 -2.447 1.00 0.00 H new ATOM 0 HA ALA B 46 -6.208 2.795 -0.402 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -7.728 1.134 -1.417 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -8.512 2.723 -1.241 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -7.927 2.191 -2.835 1.00 0.00 H new ATOM 1838 N GLU B 47 -4.954 2.364 -3.380 1.00 0.00 N ATOM 1839 CA GLU B 47 -3.874 1.730 -4.122 1.00 0.00 C ATOM 1840 C GLU B 47 -2.526 2.064 -3.488 1.00 0.00 C ATOM 1841 O GLU B 47 -1.660 1.199 -3.345 1.00 0.00 O ATOM 1842 CB GLU B 47 -3.901 2.191 -5.579 1.00 0.00 C ATOM 1843 CG GLU B 47 -5.191 1.839 -6.298 1.00 0.00 C ATOM 1844 CD GLU B 47 -5.268 2.445 -7.682 1.00 0.00 C ATOM 1845 OE1 GLU B 47 -4.375 2.163 -8.509 1.00 0.00 O ATOM 1846 OE2 GLU B 47 -6.229 3.192 -7.958 1.00 0.00 O ATOM 0 H GLU B 47 -5.442 3.097 -3.895 1.00 0.00 H new ATOM 0 HA GLU B 47 -4.013 0.649 -4.090 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -3.757 3.271 -5.614 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -3.063 1.741 -6.111 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -5.276 0.755 -6.374 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -6.039 2.184 -5.706 1.00 0.00 H new ATOM 1853 N ALA B 48 -2.365 3.322 -3.096 1.00 0.00 N ATOM 1854 CA ALA B 48 -1.145 3.769 -2.440 1.00 0.00 C ATOM 1855 C ALA B 48 -0.976 3.080 -1.091 1.00 0.00 C ATOM 1856 O ALA B 48 0.138 2.728 -0.700 1.00 0.00 O ATOM 1857 CB ALA B 48 -1.157 5.279 -2.269 1.00 0.00 C ATOM 0 H ALA B 48 -3.067 4.051 -3.222 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.298 3.499 -3.070 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -0.238 5.597 -1.777 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -1.229 5.755 -3.247 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -2.013 5.569 -1.660 1.00 0.00 H new ATOM 1863 N GLU B 49 -2.085 2.873 -0.390 1.00 0.00 N ATOM 1864 CA GLU B 49 -2.052 2.184 0.892 1.00 0.00 C ATOM 1865 C GLU B 49 -1.562 0.748 0.719 1.00 0.00 C ATOM 1866 O GLU B 49 -0.843 0.221 1.568 1.00 0.00 O ATOM 1867 CB GLU B 49 -3.429 2.202 1.560 1.00 0.00 C ATOM 1868 CG GLU B 49 -3.924 3.603 1.884 1.00 0.00 C ATOM 1869 CD GLU B 49 -5.160 3.600 2.756 1.00 0.00 C ATOM 1870 OE1 GLU B 49 -5.014 3.573 3.998 1.00 0.00 O ATOM 1871 OE2 GLU B 49 -6.281 3.643 2.214 1.00 0.00 O ATOM 0 H GLU B 49 -3.014 3.172 -0.687 1.00 0.00 H new ATOM 0 HA GLU B 49 -1.353 2.713 1.540 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -4.149 1.713 0.904 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.387 1.618 2.479 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -3.131 4.156 2.387 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.141 4.131 0.955 1.00 0.00 H new ATOM 1878 N LYS B 50 -1.938 0.125 -0.393 1.00 0.00 N ATOM 1879 CA LYS B 50 -1.460 -1.216 -0.712 1.00 0.00 C ATOM 1880 C LYS B 50 0.034 -1.209 -1.011 1.00 0.00 C ATOM 1881 O LYS B 50 0.733 -2.182 -0.741 1.00 0.00 O ATOM 1882 CB LYS B 50 -2.221 -1.804 -1.900 1.00 0.00 C ATOM 1883 CG LYS B 50 -3.492 -2.533 -1.511 1.00 0.00 C ATOM 1884 CD LYS B 50 -4.120 -3.220 -2.711 1.00 0.00 C ATOM 1885 CE LYS B 50 -5.166 -4.237 -2.286 1.00 0.00 C ATOM 1886 NZ LYS B 50 -6.310 -3.611 -1.573 1.00 0.00 N ATOM 0 H LYS B 50 -2.570 0.525 -1.086 1.00 0.00 H new ATOM 0 HA LYS B 50 -1.640 -1.841 0.163 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -2.471 -1.001 -2.593 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -1.567 -2.493 -2.434 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -3.270 -3.272 -0.741 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -4.202 -1.827 -1.080 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -4.579 -2.474 -3.360 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -3.345 -3.716 -3.295 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -5.535 -4.764 -3.166 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -4.702 -4.982 -1.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -7.027 -4.335 -1.364 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -5.975 -3.188 -0.684 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -6.729 -2.871 -2.172 1.00 0.00 H new ATOM 1900 N ALA B 51 0.524 -0.103 -1.554 1.00 0.00 N ATOM 1901 CA ALA B 51 1.938 0.025 -1.884 1.00 0.00 C ATOM 1902 C ALA B 51 2.781 0.272 -0.634 1.00 0.00 C ATOM 1903 O ALA B 51 4.011 0.293 -0.695 1.00 0.00 O ATOM 1904 CB ALA B 51 2.148 1.140 -2.895 1.00 0.00 C ATOM 0 H ALA B 51 -0.037 0.720 -1.776 1.00 0.00 H new ATOM 0 HA ALA B 51 2.264 -0.916 -2.326 1.00 0.00 H new ATOM 0 HB1 ALA B 51 3.209 1.222 -3.131 1.00 0.00 H new ATOM 0 HB2 ALA B 51 1.591 0.916 -3.805 1.00 0.00 H new ATOM 0 HB3 ALA B 51 1.795 2.082 -2.476 1.00 0.00 H new ATOM 1910 N GLY B 52 2.112 0.456 0.498 1.00 0.00 N ATOM 1911 CA GLY B 52 2.809 0.687 1.748 1.00 0.00 C ATOM 1912 C GLY B 52 2.998 2.162 2.031 1.00 0.00 C ATOM 1913 O GLY B 52 3.832 2.546 2.852 1.00 0.00 O ATOM 0 H GLY B 52 1.095 0.449 0.572 1.00 0.00 H new ATOM 0 HA2 GLY B 52 2.249 0.231 2.564 1.00 0.00 H new ATOM 0 HA3 GLY B 52 3.782 0.197 1.716 1.00 0.00 H new ATOM 1917 N VAL B 53 2.220 2.988 1.348 1.00 0.00 N ATOM 1918 CA VAL B 53 2.300 4.430 1.513 1.00 0.00 C ATOM 1919 C VAL B 53 1.427 4.886 2.677 1.00 0.00 C ATOM 1920 O VAL B 53 0.212 4.681 2.674 1.00 0.00 O ATOM 1921 CB VAL B 53 1.868 5.162 0.223 1.00 0.00 C ATOM 1922 CG1 VAL B 53 1.906 6.670 0.407 1.00 0.00 C ATOM 1923 CG2 VAL B 53 2.748 4.746 -0.944 1.00 0.00 C ATOM 0 H VAL B 53 1.522 2.681 0.670 1.00 0.00 H new ATOM 0 HA VAL B 53 3.339 4.681 1.725 1.00 0.00 H new ATOM 0 HB VAL B 53 0.839 4.877 0.004 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.597 7.157 -0.518 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.228 6.956 1.212 1.00 0.00 H new ATOM 0 HG13 VAL B 53 2.920 6.980 0.659 1.00 0.00 H new ATOM 0 HG21 VAL B 53 2.430 5.271 -1.845 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.786 4.997 -0.725 1.00 0.00 H new ATOM 0 HG23 VAL B 53 2.660 3.671 -1.101 1.00 0.00 H new ATOM 1933 N LYS B 54 2.055 5.486 3.680 1.00 0.00 N ATOM 1934 CA LYS B 54 1.329 5.998 4.834 1.00 0.00 C ATOM 1935 C LYS B 54 1.159 7.508 4.730 1.00 0.00 C ATOM 1936 O LYS B 54 0.304 8.097 5.396 1.00 0.00 O ATOM 1937 CB LYS B 54 2.053 5.647 6.134 1.00 0.00 C ATOM 1938 CG LYS B 54 2.199 4.153 6.378 1.00 0.00 C ATOM 1939 CD LYS B 54 2.819 3.878 7.736 1.00 0.00 C ATOM 1940 CE LYS B 54 3.036 2.391 7.969 1.00 0.00 C ATOM 1941 NZ LYS B 54 3.639 2.127 9.301 1.00 0.00 N ATOM 0 H LYS B 54 3.064 5.630 3.717 1.00 0.00 H new ATOM 0 HA LYS B 54 0.345 5.529 4.846 1.00 0.00 H new ATOM 0 HB2 LYS B 54 3.044 6.101 6.120 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.512 6.090 6.970 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.221 3.675 6.318 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.818 3.713 5.596 1.00 0.00 H new ATOM 0 HD2 LYS B 54 3.773 4.400 7.812 1.00 0.00 H new ATOM 0 HD3 LYS B 54 2.173 4.278 8.518 1.00 0.00 H new ATOM 0 HE2 LYS B 54 2.083 1.867 7.890 1.00 0.00 H new ATOM 0 HE3 LYS B 54 3.685 1.991 7.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 3.772 1.103 9.425 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 4.560 2.607 9.367 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 3.008 2.486 10.045 1.00 0.00 H new ATOM 1955 N SER B 55 1.975 8.134 3.898 1.00 0.00 N ATOM 1956 CA SER B 55 1.913 9.573 3.711 1.00 0.00 C ATOM 1957 C SER B 55 2.219 9.946 2.263 1.00 0.00 C ATOM 1958 O SER B 55 3.014 9.284 1.600 1.00 0.00 O ATOM 1959 CB SER B 55 2.904 10.267 4.654 1.00 0.00 C ATOM 1960 OG SER B 55 2.643 9.935 6.010 1.00 0.00 O ATOM 0 H SER B 55 2.690 7.666 3.340 1.00 0.00 H new ATOM 0 HA SER B 55 0.902 9.907 3.944 1.00 0.00 H new ATOM 0 HB2 SER B 55 3.922 9.975 4.395 1.00 0.00 H new ATOM 0 HB3 SER B 55 2.839 11.347 4.523 1.00 0.00 H new ATOM 0 HG SER B 55 3.000 10.637 6.593 1.00 0.00 H new ATOM 1966 N VAL B 56 1.573 10.998 1.777 1.00 0.00 N ATOM 1967 CA VAL B 56 1.865 11.533 0.459 1.00 0.00 C ATOM 1968 C VAL B 56 3.202 12.287 0.498 1.00 0.00 C ATOM 1969 O VAL B 56 3.797 12.395 1.577 1.00 0.00 O ATOM 1970 CB VAL B 56 0.714 12.411 -0.077 1.00 0.00 C ATOM 1971 CG1 VAL B 56 -0.470 11.540 -0.444 1.00 0.00 C ATOM 1972 CG2 VAL B 56 0.299 13.462 0.935 1.00 0.00 C ATOM 0 H VAL B 56 0.840 11.498 2.281 1.00 0.00 H new ATOM 0 HA VAL B 56 1.956 10.704 -0.243 1.00 0.00 H new ATOM 0 HB VAL B 56 1.071 12.930 -0.967 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -1.279 12.166 -0.822 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -0.173 10.828 -1.214 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -0.811 10.999 0.439 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.513 14.062 0.524 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.037 12.974 1.850 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.149 14.107 1.159 1.00 0.00 H new ATOM 1982 N PRO B 57 3.575 13.011 -0.585 1.00 0.00 N ATOM 1983 CA PRO B 57 4.912 13.025 -1.134 1.00 0.00 C ATOM 1984 C PRO B 57 5.841 11.907 -0.643 1.00 0.00 C ATOM 1985 O PRO B 57 6.582 12.039 0.334 1.00 0.00 O ATOM 1986 CB PRO B 57 5.312 14.440 -0.758 1.00 0.00 C ATOM 1987 CG PRO B 57 4.025 15.214 -0.996 1.00 0.00 C ATOM 1988 CD PRO B 57 2.911 14.173 -1.141 1.00 0.00 C ATOM 0 HA PRO B 57 4.975 12.807 -2.200 1.00 0.00 H new ATOM 0 HB2 PRO B 57 5.642 14.508 0.279 1.00 0.00 H new ATOM 0 HB3 PRO B 57 6.129 14.810 -1.377 1.00 0.00 H new ATOM 0 HG2 PRO B 57 3.819 15.889 -0.165 1.00 0.00 H new ATOM 0 HG3 PRO B 57 4.102 15.827 -1.894 1.00 0.00 H new ATOM 0 HD2 PRO B 57 2.013 14.444 -0.586 1.00 0.00 H new ATOM 0 HD3 PRO B 57 2.612 14.025 -2.179 1.00 0.00 H new ATOM 1996 N ALA B 58 5.770 10.793 -1.374 1.00 0.00 N ATOM 1997 CA ALA B 58 6.586 9.613 -1.118 1.00 0.00 C ATOM 1998 C ALA B 58 6.834 8.861 -2.426 1.00 0.00 C ATOM 1999 O ALA B 58 6.051 8.975 -3.369 1.00 0.00 O ATOM 2000 CB ALA B 58 5.894 8.704 -0.115 1.00 0.00 C ATOM 0 H ALA B 58 5.137 10.687 -2.167 1.00 0.00 H new ATOM 0 HA ALA B 58 7.543 9.927 -0.701 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.513 7.826 0.068 1.00 0.00 H new ATOM 0 HB2 ALA B 58 5.743 9.243 0.820 1.00 0.00 H new ATOM 0 HB3 ALA B 58 4.929 8.391 -0.513 1.00 0.00 H new ATOM 2006 N LEU B 59 7.915 8.094 -2.485 1.00 0.00 N ATOM 2007 CA LEU B 59 8.250 7.340 -3.687 1.00 0.00 C ATOM 2008 C LEU B 59 8.468 5.869 -3.338 1.00 0.00 C ATOM 2009 O LEU B 59 9.223 5.542 -2.426 1.00 0.00 O ATOM 2010 CB LEU B 59 9.504 7.938 -4.347 1.00 0.00 C ATOM 2011 CG LEU B 59 9.765 7.529 -5.807 1.00 0.00 C ATOM 2012 CD1 LEU B 59 10.724 8.509 -6.463 1.00 0.00 C ATOM 2013 CD2 LEU B 59 10.337 6.122 -5.891 1.00 0.00 C ATOM 0 H LEU B 59 8.574 7.977 -1.716 1.00 0.00 H new ATOM 0 HA LEU B 59 7.424 7.405 -4.395 1.00 0.00 H new ATOM 0 HB2 LEU B 59 9.428 9.025 -4.304 1.00 0.00 H new ATOM 0 HB3 LEU B 59 10.372 7.655 -3.752 1.00 0.00 H new ATOM 0 HG LEU B 59 8.811 7.545 -6.334 1.00 0.00 H new ATOM 0 HD11 LEU B 59 10.901 8.209 -7.496 1.00 0.00 H new ATOM 0 HD12 LEU B 59 10.291 9.509 -6.445 1.00 0.00 H new ATOM 0 HD13 LEU B 59 11.669 8.513 -5.919 1.00 0.00 H new ATOM 0 HD21 LEU B 59 10.511 5.862 -6.935 1.00 0.00 H new ATOM 0 HD22 LEU B 59 11.279 6.079 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU B 59 9.631 5.416 -5.453 1.00 0.00 H new ATOM 2025 N VAL B 60 7.794 4.991 -4.064 1.00 0.00 N ATOM 2026 CA VAL B 60 7.893 3.558 -3.829 1.00 0.00 C ATOM 2027 C VAL B 60 8.767 2.894 -4.890 1.00 0.00 C ATOM 2028 O VAL B 60 8.405 2.846 -6.067 1.00 0.00 O ATOM 2029 CB VAL B 60 6.501 2.890 -3.836 1.00 0.00 C ATOM 2030 CG1 VAL B 60 6.608 1.403 -3.526 1.00 0.00 C ATOM 2031 CG2 VAL B 60 5.571 3.577 -2.847 1.00 0.00 C ATOM 0 H VAL B 60 7.168 5.248 -4.827 1.00 0.00 H new ATOM 0 HA VAL B 60 8.346 3.425 -2.847 1.00 0.00 H new ATOM 0 HB VAL B 60 6.081 2.998 -4.836 1.00 0.00 H new ATOM 0 HG11 VAL B 60 5.614 0.957 -3.537 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.232 0.919 -4.277 1.00 0.00 H new ATOM 0 HG13 VAL B 60 7.055 1.268 -2.541 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.595 3.091 -2.867 1.00 0.00 H new ATOM 0 HG22 VAL B 60 5.991 3.506 -1.844 1.00 0.00 H new ATOM 0 HG23 VAL B 60 5.460 4.626 -3.121 1.00 0.00 H new ATOM 2041 N ILE B 61 9.916 2.389 -4.468 1.00 0.00 N ATOM 2042 CA ILE B 61 10.804 1.664 -5.362 1.00 0.00 C ATOM 2043 C ILE B 61 10.458 0.181 -5.319 1.00 0.00 C ATOM 2044 O ILE B 61 10.749 -0.499 -4.331 1.00 0.00 O ATOM 2045 CB ILE B 61 12.289 1.860 -4.981 1.00 0.00 C ATOM 2046 CG1 ILE B 61 12.644 3.351 -4.973 1.00 0.00 C ATOM 2047 CG2 ILE B 61 13.192 1.100 -5.947 1.00 0.00 C ATOM 2048 CD1 ILE B 61 14.071 3.637 -4.553 1.00 0.00 C ATOM 0 H ILE B 61 10.256 2.469 -3.509 1.00 0.00 H new ATOM 0 HA ILE B 61 10.665 2.058 -6.369 1.00 0.00 H new ATOM 0 HB ILE B 61 12.446 1.462 -3.979 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.480 3.759 -5.970 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.965 3.873 -4.299 1.00 0.00 H new ATOM 0 HG21 ILE B 61 14.234 1.249 -5.664 1.00 0.00 H new ATOM 0 HG22 ILE B 61 12.954 0.037 -5.908 1.00 0.00 H new ATOM 0 HG23 ILE B 61 13.034 1.470 -6.960 1.00 0.00 H new ATOM 0 HD11 ILE B 61 14.247 4.712 -4.572 1.00 0.00 H new ATOM 0 HD12 ILE B 61 14.236 3.260 -3.544 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.758 3.145 -5.241 1.00 0.00 H new ATOM 2060 N ASP B 62 9.818 -0.296 -6.385 1.00 0.00 N ATOM 2061 CA ASP B 62 9.311 -1.668 -6.469 1.00 0.00 C ATOM 2062 C ASP B 62 8.256 -1.931 -5.405 1.00 0.00 C ATOM 2063 O ASP B 62 7.058 -1.836 -5.669 1.00 0.00 O ATOM 2064 CB ASP B 62 10.434 -2.708 -6.359 1.00 0.00 C ATOM 2065 CG ASP B 62 11.178 -2.918 -7.663 1.00 0.00 C ATOM 2066 OD1 ASP B 62 10.548 -2.806 -8.739 1.00 0.00 O ATOM 2067 OD2 ASP B 62 12.381 -3.240 -7.612 1.00 0.00 O ATOM 0 H ASP B 62 9.635 0.260 -7.220 1.00 0.00 H new ATOM 0 HA ASP B 62 8.854 -1.770 -7.453 1.00 0.00 H new ATOM 0 HB2 ASP B 62 11.140 -2.392 -5.591 1.00 0.00 H new ATOM 0 HB3 ASP B 62 10.011 -3.658 -6.032 1.00 0.00 H new ATOM 2072 N GLY B 63 8.710 -2.242 -4.204 1.00 0.00 N ATOM 2073 CA GLY B 63 7.806 -2.536 -3.114 1.00 0.00 C ATOM 2074 C GLY B 63 8.225 -1.857 -1.827 1.00 0.00 C ATOM 2075 O GLY B 63 7.681 -2.144 -0.763 1.00 0.00 O ATOM 0 H GLY B 63 9.699 -2.297 -3.962 1.00 0.00 H new ATOM 0 HA2 GLY B 63 6.799 -2.215 -3.382 1.00 0.00 H new ATOM 0 HA3 GLY B 63 7.765 -3.614 -2.958 1.00 0.00 H new ATOM 2079 N ALA B 64 9.194 -0.958 -1.924 1.00 0.00 N ATOM 2080 CA ALA B 64 9.684 -0.232 -0.760 1.00 0.00 C ATOM 2081 C ALA B 64 9.261 1.230 -0.829 1.00 0.00 C ATOM 2082 O ALA B 64 9.623 1.947 -1.762 1.00 0.00 O ATOM 2083 CB ALA B 64 11.196 -0.354 -0.661 1.00 0.00 C ATOM 0 H ALA B 64 9.658 -0.713 -2.799 1.00 0.00 H new ATOM 0 HA ALA B 64 9.246 -0.670 0.137 1.00 0.00 H new ATOM 0 HB1 ALA B 64 11.549 0.193 0.213 1.00 0.00 H new ATOM 0 HB2 ALA B 64 11.471 -1.405 -0.567 1.00 0.00 H new ATOM 0 HB3 ALA B 64 11.654 0.062 -1.558 1.00 0.00 H new ATOM 2089 N ALA B 65 8.491 1.662 0.158 1.00 0.00 N ATOM 2090 CA ALA B 65 7.946 3.010 0.168 1.00 0.00 C ATOM 2091 C ALA B 65 8.850 3.967 0.932 1.00 0.00 C ATOM 2092 O ALA B 65 9.075 3.805 2.133 1.00 0.00 O ATOM 2093 CB ALA B 65 6.548 3.009 0.769 1.00 0.00 C ATOM 0 H ALA B 65 8.229 1.096 0.965 1.00 0.00 H new ATOM 0 HA ALA B 65 7.888 3.357 -0.864 1.00 0.00 H new ATOM 0 HB1 ALA B 65 6.152 4.024 0.770 1.00 0.00 H new ATOM 0 HB2 ALA B 65 5.897 2.366 0.176 1.00 0.00 H new ATOM 0 HB3 ALA B 65 6.592 2.635 1.792 1.00 0.00 H new ATOM 2099 N PHE B 66 9.371 4.959 0.230 1.00 0.00 N ATOM 2100 CA PHE B 66 10.228 5.960 0.839 1.00 0.00 C ATOM 2101 C PHE B 66 9.566 7.327 0.796 1.00 0.00 C ATOM 2102 O PHE B 66 9.451 7.939 -0.263 1.00 0.00 O ATOM 2103 CB PHE B 66 11.581 6.016 0.129 1.00 0.00 C ATOM 2104 CG PHE B 66 12.316 4.712 0.153 1.00 0.00 C ATOM 2105 CD1 PHE B 66 12.995 4.307 1.289 1.00 0.00 C ATOM 2106 CD2 PHE B 66 12.325 3.889 -0.960 1.00 0.00 C ATOM 2107 CE1 PHE B 66 13.669 3.105 1.316 1.00 0.00 C ATOM 2108 CE2 PHE B 66 12.999 2.686 -0.939 1.00 0.00 C ATOM 2109 CZ PHE B 66 13.670 2.293 0.202 1.00 0.00 C ATOM 0 H PHE B 66 9.214 5.092 -0.769 1.00 0.00 H new ATOM 0 HA PHE B 66 10.389 5.679 1.880 1.00 0.00 H new ATOM 0 HB2 PHE B 66 11.428 6.320 -0.906 1.00 0.00 H new ATOM 0 HB3 PHE B 66 12.198 6.782 0.598 1.00 0.00 H new ATOM 0 HD1 PHE B 66 12.997 4.940 2.164 1.00 0.00 H new ATOM 0 HD2 PHE B 66 11.799 4.192 -1.853 1.00 0.00 H new ATOM 0 HE1 PHE B 66 14.195 2.800 2.208 1.00 0.00 H new ATOM 0 HE2 PHE B 66 13.002 2.052 -1.814 1.00 0.00 H new ATOM 0 HZ PHE B 66 14.195 1.350 0.222 1.00 0.00 H new ATOM 2119 N HIS B 67 9.112 7.786 1.947 1.00 0.00 N ATOM 2120 CA HIS B 67 8.501 9.102 2.064 1.00 0.00 C ATOM 2121 C HIS B 67 9.581 10.170 1.945 1.00 0.00 C ATOM 2122 O HIS B 67 10.480 10.239 2.781 1.00 0.00 O ATOM 2123 CB HIS B 67 7.761 9.225 3.402 1.00 0.00 C ATOM 2124 CG HIS B 67 6.718 8.163 3.620 1.00 0.00 C ATOM 2125 ND1 HIS B 67 6.985 6.917 4.146 1.00 0.00 N ATOM 2126 CD2 HIS B 67 5.384 8.178 3.367 1.00 0.00 C ATOM 2127 CE1 HIS B 67 5.837 6.232 4.197 1.00 0.00 C ATOM 2128 NE2 HIS B 67 4.832 6.951 3.735 1.00 0.00 N ATOM 0 H HIS B 67 9.154 7.264 2.822 1.00 0.00 H new ATOM 0 HA HIS B 67 7.775 9.240 1.262 1.00 0.00 H new ATOM 0 HB2 HIS B 67 8.487 9.180 4.214 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.285 10.204 3.455 1.00 0.00 H new ATOM 0 HD1 HIS B 67 7.899 6.577 4.444 1.00 0.00 H new ATOM 0 HD2 HIS B 67 4.837 9.009 2.947 1.00 0.00 H new ATOM 0 HE1 HIS B 67 5.745 5.222 4.568 1.00 0.00 H new ATOM 2136 N ILE B 68 9.497 10.995 0.912 1.00 0.00 N ATOM 2137 CA ILE B 68 10.560 11.946 0.615 1.00 0.00 C ATOM 2138 C ILE B 68 10.186 13.328 1.118 1.00 0.00 C ATOM 2139 O ILE B 68 9.438 14.052 0.459 1.00 0.00 O ATOM 2140 CB ILE B 68 10.867 12.009 -0.896 1.00 0.00 C ATOM 2141 CG1 ILE B 68 11.210 10.613 -1.423 1.00 0.00 C ATOM 2142 CG2 ILE B 68 12.014 12.975 -1.164 1.00 0.00 C ATOM 2143 CD1 ILE B 68 11.459 10.570 -2.914 1.00 0.00 C ATOM 0 H ILE B 68 8.707 11.026 0.267 1.00 0.00 H new ATOM 0 HA ILE B 68 11.458 11.601 1.128 1.00 0.00 H new ATOM 0 HB ILE B 68 9.982 12.371 -1.418 1.00 0.00 H new ATOM 0 HG12 ILE B 68 12.096 10.246 -0.905 1.00 0.00 H new ATOM 0 HG13 ILE B 68 10.394 9.932 -1.180 1.00 0.00 H new ATOM 0 HG21 ILE B 68 12.219 13.009 -2.234 1.00 0.00 H new ATOM 0 HG22 ILE B 68 11.740 13.971 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE B 68 12.905 12.638 -0.634 1.00 0.00 H new ATOM 0 HD11 ILE B 68 11.696 9.549 -3.214 1.00 0.00 H new ATOM 0 HD12 ILE B 68 10.566 10.905 -3.442 1.00 0.00 H new ATOM 0 HD13 ILE B 68 12.295 11.224 -3.162 1.00 0.00 H new ATOM 2155 N ASN B 69 10.724 13.679 2.285 1.00 0.00 N ATOM 2156 CA ASN B 69 10.315 14.875 3.016 1.00 0.00 C ATOM 2157 C ASN B 69 8.846 14.765 3.377 1.00 0.00 C ATOM 2158 O ASN B 69 7.979 14.992 2.536 1.00 0.00 O ATOM 2159 CB ASN B 69 10.586 16.164 2.226 1.00 0.00 C ATOM 2160 CG ASN B 69 12.022 16.635 2.362 1.00 0.00 C ATOM 2161 OD1 ASN B 69 12.672 16.395 3.380 1.00 0.00 O ATOM 2162 ND2 ASN B 69 12.528 17.315 1.346 1.00 0.00 N ATOM 0 H ASN B 69 11.456 13.141 2.750 1.00 0.00 H new ATOM 0 HA ASN B 69 10.914 14.936 3.925 1.00 0.00 H new ATOM 0 HB2 ASN B 69 10.360 15.996 1.173 1.00 0.00 H new ATOM 0 HB3 ASN B 69 9.915 16.949 2.575 1.00 0.00 H new ATOM 0 HD21 ASN B 69 13.487 17.660 1.390 1.00 0.00 H new ATOM 0 HD22 ASN B 69 11.959 17.495 0.519 1.00 0.00 H new ATOM 2169 N PHE B 70 8.596 14.389 4.635 1.00 0.00 N ATOM 2170 CA PHE B 70 7.250 14.093 5.130 1.00 0.00 C ATOM 2171 C PHE B 70 6.216 15.063 4.577 1.00 0.00 C ATOM 2172 O PHE B 70 6.131 16.215 5.009 1.00 0.00 O ATOM 2173 CB PHE B 70 7.237 14.124 6.664 1.00 0.00 C ATOM 2174 CG PHE B 70 5.910 13.762 7.271 1.00 0.00 C ATOM 2175 CD1 PHE B 70 5.515 12.436 7.360 1.00 0.00 C ATOM 2176 CD2 PHE B 70 5.061 14.743 7.759 1.00 0.00 C ATOM 2177 CE1 PHE B 70 4.298 12.098 7.922 1.00 0.00 C ATOM 2178 CE2 PHE B 70 3.842 14.411 8.321 1.00 0.00 C ATOM 2179 CZ PHE B 70 3.461 13.085 8.403 1.00 0.00 C ATOM 0 H PHE B 70 9.325 14.281 5.340 1.00 0.00 H new ATOM 0 HA PHE B 70 6.982 13.095 4.784 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.996 13.436 7.038 1.00 0.00 H new ATOM 0 HB3 PHE B 70 7.518 15.122 7.000 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.165 11.659 6.986 1.00 0.00 H new ATOM 0 HD2 PHE B 70 5.355 15.780 7.699 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.002 11.061 7.985 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.189 15.186 8.695 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.510 12.821 8.843 1.00 0.00 H new ATOM 2189 N GLY B 71 5.459 14.592 3.593 1.00 0.00 N ATOM 2190 CA GLY B 71 4.442 15.409 2.987 1.00 0.00 C ATOM 2191 C GLY B 71 3.208 15.492 3.846 1.00 0.00 C ATOM 2192 O GLY B 71 3.123 16.327 4.746 1.00 0.00 O ATOM 0 H GLY B 71 5.538 13.651 3.207 1.00 0.00 H new ATOM 0 HA2 GLY B 71 4.835 16.411 2.816 1.00 0.00 H new ATOM 0 HA3 GLY B 71 4.179 14.999 2.012 1.00 0.00 H new ATOM 2196 N ALA B 72 2.240 14.634 3.576 1.00 0.00 N ATOM 2197 CA ALA B 72 0.993 14.671 4.341 1.00 0.00 C ATOM 2198 C ALA B 72 0.494 13.273 4.654 1.00 0.00 C ATOM 2199 O ALA B 72 0.735 12.350 3.893 1.00 0.00 O ATOM 2200 CB ALA B 72 -0.072 15.472 3.602 1.00 0.00 C ATOM 0 H ALA B 72 2.284 13.917 2.852 1.00 0.00 H new ATOM 0 HA ALA B 72 1.201 15.169 5.288 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.990 15.486 4.190 1.00 0.00 H new ATOM 0 HB2 ALA B 72 0.279 16.493 3.453 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -0.268 15.011 2.634 1.00 0.00 H new ATOM 2206 N GLY B 73 -0.202 13.115 5.766 1.00 0.00 N ATOM 2207 CA GLY B 73 -0.784 11.827 6.085 1.00 0.00 C ATOM 2208 C GLY B 73 -1.833 11.420 5.066 1.00 0.00 C ATOM 2209 O GLY B 73 -2.751 12.188 4.777 1.00 0.00 O ATOM 0 H GLY B 73 -0.375 13.850 6.452 1.00 0.00 H new ATOM 0 HA2 GLY B 73 0.001 11.072 6.122 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -1.235 11.866 7.077 1.00 0.00 H new ATOM 2213 N ILE B 74 -1.703 10.218 4.513 1.00 0.00 N ATOM 2214 CA ILE B 74 -2.621 9.768 3.471 1.00 0.00 C ATOM 2215 C ILE B 74 -3.986 9.435 4.068 1.00 0.00 C ATOM 2216 O ILE B 74 -5.016 9.549 3.403 1.00 0.00 O ATOM 2217 CB ILE B 74 -2.070 8.543 2.696 1.00 0.00 C ATOM 2218 CG1 ILE B 74 -2.877 8.322 1.413 1.00 0.00 C ATOM 2219 CG2 ILE B 74 -2.098 7.289 3.562 1.00 0.00 C ATOM 2220 CD1 ILE B 74 -2.363 7.183 0.559 1.00 0.00 C ATOM 0 H ILE B 74 -0.980 9.544 4.765 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.727 10.589 2.761 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.033 8.747 2.431 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -3.916 8.126 1.677 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -2.865 9.239 0.825 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -1.706 6.445 2.994 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.484 7.446 4.449 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.124 7.078 3.864 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.984 7.087 -0.332 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.334 7.386 0.263 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.401 6.255 1.129 1.00 0.00 H new ATOM 2232 N ASP B 75 -3.991 9.056 5.340 1.00 0.00 N ATOM 2233 CA ASP B 75 -5.224 8.711 6.027 1.00 0.00 C ATOM 2234 C ASP B 75 -5.935 9.985 6.464 1.00 0.00 C ATOM 2235 O ASP B 75 -7.151 10.008 6.663 1.00 0.00 O ATOM 2236 CB ASP B 75 -4.923 7.819 7.233 1.00 0.00 C ATOM 2237 CG ASP B 75 -6.168 7.206 7.835 1.00 0.00 C ATOM 2238 OD1 ASP B 75 -6.627 6.159 7.323 1.00 0.00 O ATOM 2239 OD2 ASP B 75 -6.686 7.752 8.829 1.00 0.00 O ATOM 0 H ASP B 75 -3.152 8.980 5.915 1.00 0.00 H new ATOM 0 HA ASP B 75 -5.875 8.159 5.349 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -4.242 7.024 6.930 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -4.408 8.406 7.994 1.00 0.00 H new ATOM 2244 N ASP B 76 -5.156 11.052 6.578 1.00 0.00 N ATOM 2245 CA ASP B 76 -5.676 12.366 6.933 1.00 0.00 C ATOM 2246 C ASP B 76 -6.453 12.959 5.769 1.00 0.00 C ATOM 2247 O ASP B 76 -7.401 13.717 5.962 1.00 0.00 O ATOM 2248 CB ASP B 76 -4.533 13.309 7.313 1.00 0.00 C ATOM 2249 CG ASP B 76 -3.756 12.837 8.523 1.00 0.00 C ATOM 2250 OD1 ASP B 76 -2.932 11.909 8.385 1.00 0.00 O ATOM 2251 OD2 ASP B 76 -3.954 13.401 9.619 1.00 0.00 O ATOM 0 H ASP B 76 -4.147 11.032 6.427 1.00 0.00 H new ATOM 0 HA ASP B 76 -6.342 12.248 7.788 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -3.853 13.407 6.467 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -4.938 14.301 7.512 1.00 0.00 H new ATOM 2256 N LEU B 77 -6.049 12.596 4.557 1.00 0.00 N ATOM 2257 CA LEU B 77 -6.682 13.108 3.346 1.00 0.00 C ATOM 2258 C LEU B 77 -8.072 12.507 3.156 1.00 0.00 C ATOM 2259 O LEU B 77 -8.878 13.016 2.377 1.00 0.00 O ATOM 2260 CB LEU B 77 -5.814 12.802 2.122 1.00 0.00 C ATOM 2261 CG LEU B 77 -4.396 13.377 2.167 1.00 0.00 C ATOM 2262 CD1 LEU B 77 -3.625 12.983 0.919 1.00 0.00 C ATOM 2263 CD2 LEU B 77 -4.435 14.891 2.314 1.00 0.00 C ATOM 0 H LEU B 77 -5.282 11.946 4.386 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.785 14.188 3.453 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -5.746 11.720 2.006 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.317 13.187 1.235 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.884 12.963 3.036 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.619 13.400 0.966 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.565 11.896 0.856 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.137 13.370 0.038 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -3.417 15.280 2.344 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.965 15.325 1.466 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.951 15.154 3.237 1.00 0.00 H new ATOM 2275 N LYS B 78 -8.346 11.425 3.873 1.00 0.00 N ATOM 2276 CA LYS B 78 -9.638 10.760 3.791 1.00 0.00 C ATOM 2277 C LYS B 78 -10.706 11.585 4.495 1.00 0.00 C ATOM 2278 O LYS B 78 -10.838 11.532 5.719 1.00 0.00 O ATOM 2279 CB LYS B 78 -9.563 9.370 4.424 1.00 0.00 C ATOM 2280 CG LYS B 78 -8.502 8.474 3.810 1.00 0.00 C ATOM 2281 CD LYS B 78 -8.381 7.169 4.575 1.00 0.00 C ATOM 2282 CE LYS B 78 -7.258 6.304 4.035 1.00 0.00 C ATOM 2283 NZ LYS B 78 -7.062 5.086 4.862 1.00 0.00 N ATOM 0 H LYS B 78 -7.688 10.989 4.519 1.00 0.00 H new ATOM 0 HA LYS B 78 -9.903 10.659 2.739 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -9.363 9.477 5.490 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -10.534 8.885 4.329 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -8.753 8.268 2.770 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -7.542 8.990 3.810 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -8.203 7.380 5.629 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -9.322 6.623 4.514 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -7.482 6.015 3.008 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -6.333 6.881 4.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -6.094 4.729 4.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -7.212 5.319 5.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -7.743 4.355 4.571 1.00 0.00 H new ATOM 2297 N GLY B 79 -11.446 12.364 3.725 1.00 0.00 N ATOM 2298 CA GLY B 79 -12.496 13.181 4.292 1.00 0.00 C ATOM 2299 C GLY B 79 -13.426 13.725 3.231 1.00 0.00 C ATOM 2300 O GLY B 79 -14.609 13.382 3.194 1.00 0.00 O ATOM 0 H GLY B 79 -11.338 12.446 2.714 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -13.068 12.591 5.008 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -12.052 14.009 4.845 1.00 0.00 H new ATOM 2304 N SER B 80 -12.889 14.570 2.367 1.00 0.00 N ATOM 2305 CA SER B 80 -13.662 15.154 1.288 1.00 0.00 C ATOM 2306 C SER B 80 -12.724 15.607 0.174 1.00 0.00 C ATOM 2307 O SER B 80 -12.280 16.774 0.200 1.00 0.00 O ATOM 2308 CB SER B 80 -14.498 16.331 1.813 1.00 0.00 C ATOM 2309 OG SER B 80 -15.355 16.854 0.810 1.00 0.00 O ATOM 2310 OXT SER B 80 -12.413 14.786 -0.712 1.00 0.00 O ATOM 0 H SER B 80 -11.914 14.867 2.394 1.00 0.00 H new ATOM 0 HA SER B 80 -14.346 14.406 0.886 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.093 16.003 2.665 1.00 0.00 H new ATOM 0 HB3 SER B 80 -13.834 17.118 2.171 1.00 0.00 H new ATOM 0 HG SER B 80 -15.873 17.600 1.179 1.00 0.00 H new TER 2316 SER B 80