USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1421 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: D 4 LYS NZ :NH3+ -140:sc= 1.23 (180deg=0.282) USER MOD Set 1.2: D 12 SER OG : rot -47:sc= 0.533 USER MOD Set 2.1: C 4 LYS NZ :NH3+ -140:sc= 1.2 (180deg=0.161) USER MOD Set 2.2: C 12 SER OG : rot -36:sc= 0.672 USER MOD Set 3.1: B 28 LYS NZ :NH3+ 170:sc= -0.564 (180deg=-0.746) USER MOD Set 3.2: B 30 SER OG : rot 180:sc= -0.895 USER MOD Set 4.1: B 25 HIS : no HD1:sc= -2.33 K(o=-2.6,f=-7.6) USER MOD Set 4.2: B 26 LYS NZ :NH3+ -151:sc= -0.254 (180deg=0.327) USER MOD Set 5.1: B 15 HIS : no HD1:sc= -0.851 X(o=-0.85,f=-1) USER MOD Set 5.2: B 24 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0176) USER MOD Set 6.1: B 1 SER OG : rot 180:sc= 0 USER MOD Set 6.2: B 5 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.148) USER MOD Set 7.1: A 81 THR OG1 : rot 134:sc= 1.05 USER MOD Set 7.2: A 85 HIS :FLIP no HE2:sc= -11.7! C(o=-12!,f=-11!) USER MOD Set 7.3: B 7 MET CE :methyl -142:sc= -0.198 (180deg=0) USER MOD Set 8.1: A 28 LYS NZ :NH3+ 171:sc= -0.587 (180deg=-0.726) USER MOD Set 8.2: A 30 SER OG : rot 180:sc= -0.913 USER MOD Set 9.1: A 25 HIS : no HD1:sc= -2.27 K(o=-2.5,f=-7.7) USER MOD Set 9.2: A 26 LYS NZ :NH3+ -155:sc= -0.266 (180deg=0.329) USER MOD Set10.1: A 15 HIS : no HD1:sc= -0.84 X(o=-0.84,f=-1) USER MOD Set10.2: A 24 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.018) USER MOD Set11.1: A 7 MET CE :methyl -145:sc= -0.151 (180deg=0) USER MOD Set11.2: B 81 THR OG1 : rot 95:sc= 1.02 USER MOD Set11.3: B 85 HIS : no HE2:sc= -12.4! C(o=-12!,f=-11!) USER MOD Set12.1: A 1 SER OG : rot 180:sc= 0 USER MOD Set12.2: A 5 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.14) USER MOD Single : A 1 SER N :NH3+ -149:sc= 0.879 (180deg=-0.157) USER MOD Single : A 16 GLN :FLIP amide:sc= -0.526 F(o=-1.2,f=-0.53) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.168 USER MOD Single : A 18 SER OG : rot -76:sc= -1.07 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 164:sc= 0.401 (180deg=0.125) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0.48) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -169:sc= -0.243 (180deg=-0.469) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 157:sc= -2.56 (180deg=-5.36!) USER MOD Single : A 59 THR OG1 : rot 75:sc= -1.26 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 68 CYS SG : rot 47:sc= -4.27 USER MOD Single : A 71 GLN : amide:sc= -2.27 K(o=-2.3,f=-4.2!) USER MOD Single : A 74 MET CE :methyl -113:sc= -2.19 (180deg=-5.44!) USER MOD Single : A 79 MET CE :methyl -167:sc= -2.11 (180deg=-2.33) USER MOD Single : A 82 THR OG1 : rot -102:sc= 1.17 USER MOD Single : A 84 CYS SG : rot -11:sc= -1.36! USER MOD Single : B 1 SER N :NH3+ -155:sc= 0.871 (180deg=-0.169) USER MOD Single : B 16 GLN :FLIP amide:sc= -0.645 F(o=-1.3,f=-0.65) USER MOD Single : B 17 TYR OH : rot 180:sc= -0.153 USER MOD Single : B 18 SER OG : rot -80:sc= -1.25 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ 166:sc= 0.411 (180deg=0.13) USER MOD Single : B 37 ASN :FLIP amide:sc= 0.537 F(o=0,f=0.54) USER MOD Single : B 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -167:sc= -0.276 (180deg=-0.4) USER MOD Single : B 50 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 158:sc= -2.75 (180deg=-5.16!) USER MOD Single : B 59 THR OG1 : rot 70:sc= -1.22 USER MOD Single : B 62 ASN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : B 68 CYS SG : rot 46:sc= -4.29 USER MOD Single : B 71 GLN : amide:sc= -2.26 K(o=-2.3,f=-4.5!) USER MOD Single : B 74 MET CE :methyl -113:sc= -2.24 (180deg=-5.44!) USER MOD Single : B 79 MET CE :methyl -169:sc= -2.12 (180deg=-2.47) USER MOD Single : B 82 THR OG1 : rot -93:sc= 1.06 USER MOD Single : B 84 CYS SG : rot -11:sc= -1.34! USER MOD Single : C 3 THR OG1 : rot -34:sc= 0.692 USER MOD Single : C 8 ASN :FLIP amide:sc= -0.0762 F(o=-0.72,f=-0.076) USER MOD Single : C 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 1 THR N :NH3+ -169:sc= -0.0268 (180deg=-0.167) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0 USER MOD Single : D 3 THR OG1 : rot -33:sc= 0.789 USER MOD Single : D 8 ASN :FLIP amide:sc= -0.0871 F(o=-0.72,f=-0.087) USER MOD Single : D 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.523 -3.893 -11.823 1.00 0.00 N ATOM 2 CA SER A 1 -9.470 -4.927 -11.997 1.00 0.00 C ATOM 3 C SER A 1 -8.076 -4.348 -11.774 1.00 0.00 C ATOM 4 O SER A 1 -7.118 -5.085 -11.539 1.00 0.00 O ATOM 5 CB SER A 1 -9.582 -5.503 -13.410 1.00 0.00 C ATOM 6 OG SER A 1 -9.103 -4.584 -14.376 1.00 0.00 O ATOM 0 H1 SER A 1 -11.391 -4.338 -11.462 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.195 -3.174 -11.146 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.721 -3.441 -12.739 1.00 0.00 H new ATOM 0 HA SER A 1 -9.618 -5.712 -11.255 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.014 -6.431 -13.474 1.00 0.00 H new ATOM 0 HB3 SER A 1 -10.622 -5.751 -13.624 1.00 0.00 H new ATOM 0 HG SER A 1 -9.184 -4.977 -15.270 1.00 0.00 H new ATOM 14 N GLU A 2 -7.970 -3.025 -11.848 1.00 0.00 N ATOM 15 CA GLU A 2 -6.693 -2.346 -11.655 1.00 0.00 C ATOM 16 C GLU A 2 -6.074 -2.717 -10.315 1.00 0.00 C ATOM 17 O GLU A 2 -4.859 -2.866 -10.195 1.00 0.00 O ATOM 18 CB GLU A 2 -6.877 -0.829 -11.747 1.00 0.00 C ATOM 19 CG GLU A 2 -7.692 -0.233 -10.609 1.00 0.00 C ATOM 20 CD GLU A 2 -9.184 -0.437 -10.787 1.00 0.00 C ATOM 21 OE1 GLU A 2 -9.662 -1.564 -10.543 1.00 0.00 O ATOM 22 OE2 GLU A 2 -9.874 0.531 -11.171 1.00 0.00 O ATOM 0 H GLU A 2 -8.754 -2.401 -12.040 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.016 -2.670 -12.446 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -5.896 -0.355 -11.764 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.363 -0.589 -12.693 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -7.378 -0.684 -9.668 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.482 0.834 -10.537 1.00 0.00 H new ATOM 29 N LEU A 3 -6.926 -2.863 -9.314 1.00 0.00 N ATOM 30 CA LEU A 3 -6.484 -3.219 -7.968 1.00 0.00 C ATOM 31 C LEU A 3 -5.631 -4.483 -7.990 1.00 0.00 C ATOM 32 O LEU A 3 -4.666 -4.606 -7.237 1.00 0.00 O ATOM 33 CB LEU A 3 -7.689 -3.421 -7.047 1.00 0.00 C ATOM 34 CG LEU A 3 -8.598 -2.197 -6.889 1.00 0.00 C ATOM 35 CD1 LEU A 3 -9.923 -2.418 -7.601 1.00 0.00 C ATOM 36 CD2 LEU A 3 -8.830 -1.889 -5.417 1.00 0.00 C ATOM 0 H LEU A 3 -7.935 -2.740 -9.405 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.877 -2.398 -7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.285 -4.250 -7.430 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.328 -3.716 -6.062 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.101 -1.341 -7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -10.554 -1.538 -7.477 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.742 -2.588 -8.662 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -10.425 -3.287 -7.175 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -9.478 -1.017 -5.325 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -9.304 -2.745 -4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -7.875 -1.684 -4.933 1.00 0.00 H new ATOM 48 N GLU A 4 -5.994 -5.418 -8.863 1.00 0.00 N ATOM 49 CA GLU A 4 -5.261 -6.672 -8.986 1.00 0.00 C ATOM 50 C GLU A 4 -3.916 -6.447 -9.670 1.00 0.00 C ATOM 51 O GLU A 4 -2.922 -7.092 -9.337 1.00 0.00 O ATOM 52 CB GLU A 4 -6.085 -7.693 -9.774 1.00 0.00 C ATOM 53 CG GLU A 4 -7.162 -8.373 -8.945 1.00 0.00 C ATOM 54 CD GLU A 4 -8.550 -7.840 -9.241 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.869 -7.643 -10.433 1.00 0.00 O ATOM 56 OE2 GLU A 4 -9.319 -7.619 -8.281 1.00 0.00 O ATOM 0 H GLU A 4 -6.790 -5.331 -9.494 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.079 -7.060 -7.984 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.552 -7.194 -10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.416 -8.452 -10.180 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.140 -9.446 -9.138 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.942 -8.235 -7.886 1.00 0.00 H new ATOM 63 N LYS A 5 -3.893 -5.523 -10.627 1.00 0.00 N ATOM 64 CA LYS A 5 -2.671 -5.208 -11.357 1.00 0.00 C ATOM 65 C LYS A 5 -1.747 -4.335 -10.513 1.00 0.00 C ATOM 66 O LYS A 5 -0.527 -4.492 -10.547 1.00 0.00 O ATOM 67 CB LYS A 5 -3.005 -4.498 -12.670 1.00 0.00 C ATOM 68 CG LYS A 5 -3.777 -5.366 -13.651 1.00 0.00 C ATOM 69 CD LYS A 5 -5.087 -4.713 -14.066 1.00 0.00 C ATOM 70 CE LYS A 5 -4.851 -3.384 -14.765 1.00 0.00 C ATOM 71 NZ LYS A 5 -6.128 -2.746 -15.189 1.00 0.00 N ATOM 0 H LYS A 5 -4.707 -4.980 -10.914 1.00 0.00 H new ATOM 0 HA LYS A 5 -2.157 -6.143 -11.580 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.589 -3.604 -12.452 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.079 -4.167 -13.141 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.166 -5.550 -14.534 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.981 -6.336 -13.197 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.634 -5.382 -14.730 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.711 -4.557 -13.186 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -4.314 -2.712 -14.096 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.216 -3.540 -15.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.962 -1.740 -15.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -6.485 -3.219 -16.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -6.830 -2.833 -14.426 1.00 0.00 H new ATOM 85 N ALA A 6 -2.339 -3.416 -9.757 1.00 0.00 N ATOM 86 CA ALA A 6 -1.572 -2.518 -8.903 1.00 0.00 C ATOM 87 C ALA A 6 -0.852 -3.291 -7.808 1.00 0.00 C ATOM 88 O ALA A 6 0.262 -2.943 -7.418 1.00 0.00 O ATOM 89 CB ALA A 6 -2.487 -1.463 -8.298 1.00 0.00 C ATOM 0 H ALA A 6 -3.348 -3.274 -9.719 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.819 -2.022 -9.515 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.904 -0.797 -7.662 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.954 -0.886 -9.096 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.259 -1.950 -7.702 1.00 0.00 H new ATOM 95 N MET A 7 -1.492 -4.345 -7.316 1.00 0.00 N ATOM 96 CA MET A 7 -0.905 -5.168 -6.269 1.00 0.00 C ATOM 97 C MET A 7 0.318 -5.914 -6.792 1.00 0.00 C ATOM 98 O MET A 7 1.384 -5.877 -6.180 1.00 0.00 O ATOM 99 CB MET A 7 -1.939 -6.161 -5.731 1.00 0.00 C ATOM 100 CG MET A 7 -2.465 -5.803 -4.351 1.00 0.00 C ATOM 101 SD MET A 7 -3.925 -6.756 -3.894 1.00 0.00 S ATOM 102 CE MET A 7 -3.409 -7.431 -2.318 1.00 0.00 C ATOM 0 H MET A 7 -2.415 -4.648 -7.625 1.00 0.00 H new ATOM 0 HA MET A 7 -0.589 -4.514 -5.456 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.776 -6.214 -6.427 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.492 -7.154 -5.694 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.681 -5.971 -3.613 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.706 -4.740 -4.323 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.823 -8.432 -2.198 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.321 -7.482 -2.283 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.769 -6.791 -1.513 1.00 0.00 H new ATOM 112 N VAL A 8 0.153 -6.588 -7.928 1.00 0.00 N ATOM 113 CA VAL A 8 1.241 -7.349 -8.539 1.00 0.00 C ATOM 114 C VAL A 8 2.241 -6.439 -9.237 1.00 0.00 C ATOM 115 O VAL A 8 3.420 -6.776 -9.347 1.00 0.00 O ATOM 116 CB VAL A 8 0.708 -8.380 -9.553 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.830 -9.285 -10.037 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.421 -9.199 -8.943 1.00 0.00 C ATOM 0 H VAL A 8 -0.726 -6.623 -8.445 1.00 0.00 H new ATOM 0 HA VAL A 8 1.745 -7.872 -7.726 1.00 0.00 H new ATOM 0 HB VAL A 8 0.311 -7.841 -10.413 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.433 -10.006 -10.752 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.601 -8.683 -10.518 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.261 -9.816 -9.188 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.783 -9.921 -9.675 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.053 -9.727 -8.063 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.236 -8.536 -8.653 1.00 0.00 H new ATOM 128 N ALA A 9 1.781 -5.279 -9.693 1.00 0.00 N ATOM 129 CA ALA A 9 2.668 -4.336 -10.357 1.00 0.00 C ATOM 130 C ALA A 9 3.819 -3.990 -9.427 1.00 0.00 C ATOM 131 O ALA A 9 4.986 -3.946 -9.829 1.00 0.00 O ATOM 132 CB ALA A 9 1.909 -3.081 -10.763 1.00 0.00 C ATOM 0 H ALA A 9 0.811 -4.973 -9.616 1.00 0.00 H new ATOM 0 HA ALA A 9 3.065 -4.793 -11.263 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.590 -2.388 -11.258 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.103 -3.348 -11.446 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.490 -2.606 -9.876 1.00 0.00 H new ATOM 138 N LEU A 10 3.475 -3.783 -8.164 1.00 0.00 N ATOM 139 CA LEU A 10 4.469 -3.477 -7.151 1.00 0.00 C ATOM 140 C LEU A 10 5.405 -4.661 -6.992 1.00 0.00 C ATOM 141 O LEU A 10 6.624 -4.528 -7.093 1.00 0.00 O ATOM 142 CB LEU A 10 3.796 -3.159 -5.815 1.00 0.00 C ATOM 143 CG LEU A 10 2.935 -1.894 -5.808 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.676 -2.109 -4.983 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.733 -0.714 -5.270 1.00 0.00 C ATOM 0 H LEU A 10 2.516 -3.822 -7.819 1.00 0.00 H new ATOM 0 HA LEU A 10 5.037 -2.601 -7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.172 -4.006 -5.529 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.568 -3.059 -5.052 1.00 0.00 H new ATOM 0 HG LEU A 10 2.638 -1.672 -6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.077 -1.199 -4.990 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.097 -2.928 -5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.951 -2.355 -3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.108 0.179 -5.271 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.058 -0.928 -4.252 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.605 -0.547 -5.902 1.00 0.00 H new ATOM 157 N ILE A 11 4.815 -5.828 -6.757 1.00 0.00 N ATOM 158 CA ILE A 11 5.583 -7.055 -6.594 1.00 0.00 C ATOM 159 C ILE A 11 6.552 -7.248 -7.749 1.00 0.00 C ATOM 160 O ILE A 11 7.749 -7.427 -7.538 1.00 0.00 O ATOM 161 CB ILE A 11 4.692 -8.311 -6.500 1.00 0.00 C ATOM 162 CG1 ILE A 11 3.316 -7.995 -5.918 1.00 0.00 C ATOM 163 CG2 ILE A 11 5.379 -9.349 -5.648 1.00 0.00 C ATOM 164 CD1 ILE A 11 2.399 -9.200 -5.862 1.00 0.00 C ATOM 0 H ILE A 11 3.806 -5.949 -6.675 1.00 0.00 H new ATOM 0 HA ILE A 11 6.124 -6.941 -5.655 1.00 0.00 H new ATOM 0 HB ILE A 11 4.541 -8.691 -7.510 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.438 -7.593 -4.912 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.845 -7.216 -6.518 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.751 -10.237 -5.580 1.00 0.00 H new ATOM 0 HG22 ILE A 11 6.336 -9.614 -6.098 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.547 -8.946 -4.649 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.438 -8.907 -5.439 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.248 -9.590 -6.869 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.850 -9.972 -5.238 1.00 0.00 H new ATOM 176 N ASP A 12 6.026 -7.204 -8.972 1.00 0.00 N ATOM 177 CA ASP A 12 6.849 -7.369 -10.167 1.00 0.00 C ATOM 178 C ASP A 12 8.151 -6.592 -10.025 1.00 0.00 C ATOM 179 O ASP A 12 9.212 -7.047 -10.453 1.00 0.00 O ATOM 180 CB ASP A 12 6.086 -6.895 -11.406 1.00 0.00 C ATOM 181 CG ASP A 12 5.385 -8.031 -12.124 1.00 0.00 C ATOM 182 OD1 ASP A 12 6.044 -8.720 -12.932 1.00 0.00 O ATOM 183 OD2 ASP A 12 4.177 -8.234 -11.879 1.00 0.00 O ATOM 0 H ASP A 12 5.035 -7.056 -9.160 1.00 0.00 H new ATOM 0 HA ASP A 12 7.084 -8.427 -10.283 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.351 -6.146 -11.112 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.779 -6.408 -12.092 1.00 0.00 H new ATOM 188 N VAL A 13 8.058 -5.418 -9.411 1.00 0.00 N ATOM 189 CA VAL A 13 9.225 -4.574 -9.197 1.00 0.00 C ATOM 190 C VAL A 13 10.204 -5.209 -8.204 1.00 0.00 C ATOM 191 O VAL A 13 11.406 -5.274 -8.463 1.00 0.00 O ATOM 192 CB VAL A 13 8.816 -3.180 -8.685 1.00 0.00 C ATOM 193 CG1 VAL A 13 10.026 -2.268 -8.593 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.748 -2.572 -9.583 1.00 0.00 C ATOM 0 H VAL A 13 7.185 -5.030 -9.053 1.00 0.00 H new ATOM 0 HA VAL A 13 9.721 -4.471 -10.162 1.00 0.00 H new ATOM 0 HB VAL A 13 8.397 -3.291 -7.685 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.716 -1.288 -8.229 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.754 -2.697 -7.904 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.478 -2.163 -9.579 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.472 -1.588 -9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.137 -2.476 -10.597 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.869 -3.217 -9.591 1.00 0.00 H new ATOM 204 N PHE A 14 9.686 -5.674 -7.067 1.00 0.00 N ATOM 205 CA PHE A 14 10.519 -6.298 -6.037 1.00 0.00 C ATOM 206 C PHE A 14 10.917 -7.721 -6.437 1.00 0.00 C ATOM 207 O PHE A 14 11.941 -8.236 -5.993 1.00 0.00 O ATOM 208 CB PHE A 14 9.786 -6.271 -4.675 1.00 0.00 C ATOM 209 CG PHE A 14 9.602 -7.612 -4.009 1.00 0.00 C ATOM 210 CD1 PHE A 14 8.954 -8.647 -4.665 1.00 0.00 C ATOM 211 CD2 PHE A 14 10.083 -7.837 -2.726 1.00 0.00 C ATOM 212 CE1 PHE A 14 8.794 -9.877 -4.063 1.00 0.00 C ATOM 213 CE2 PHE A 14 9.924 -9.066 -2.123 1.00 0.00 C ATOM 214 CZ PHE A 14 9.281 -10.088 -2.790 1.00 0.00 C ATOM 0 H PHE A 14 8.694 -5.631 -6.835 1.00 0.00 H new ATOM 0 HA PHE A 14 11.441 -5.725 -5.938 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.340 -5.621 -3.997 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.805 -5.819 -4.819 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.569 -8.488 -5.661 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.586 -7.042 -2.196 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.288 -10.674 -4.587 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.304 -9.229 -1.125 1.00 0.00 H new ATOM 0 HZ PHE A 14 9.159 -11.051 -2.317 1.00 0.00 H new ATOM 224 N HIS A 15 10.097 -8.351 -7.273 1.00 0.00 N ATOM 225 CA HIS A 15 10.362 -9.712 -7.724 1.00 0.00 C ATOM 226 C HIS A 15 11.375 -9.727 -8.865 1.00 0.00 C ATOM 227 O HIS A 15 11.979 -10.761 -9.154 1.00 0.00 O ATOM 228 CB HIS A 15 9.061 -10.386 -8.165 1.00 0.00 C ATOM 229 CG HIS A 15 8.593 -11.450 -7.222 1.00 0.00 C ATOM 230 ND1 HIS A 15 7.268 -11.814 -7.093 1.00 0.00 N ATOM 231 CD2 HIS A 15 9.281 -12.233 -6.357 1.00 0.00 C ATOM 232 CE1 HIS A 15 7.162 -12.773 -6.191 1.00 0.00 C ATOM 233 NE2 HIS A 15 8.369 -13.045 -5.730 1.00 0.00 N ATOM 0 H HIS A 15 9.244 -7.940 -7.651 1.00 0.00 H new ATOM 0 HA HIS A 15 10.786 -10.268 -6.888 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.283 -9.629 -8.262 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.204 -10.824 -9.153 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.348 -12.221 -6.191 1.00 0.00 H new ATOM 0 HE1 HIS A 15 6.245 -13.253 -5.883 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.588 -13.746 -5.022 1.00 0.00 H new ATOM 242 N GLN A 16 11.563 -8.579 -9.507 1.00 0.00 N ATOM 243 CA GLN A 16 12.509 -8.470 -10.607 1.00 0.00 C ATOM 244 C GLN A 16 13.916 -8.240 -10.073 1.00 0.00 C ATOM 245 O GLN A 16 14.881 -8.821 -10.570 1.00 0.00 O ATOM 246 CB GLN A 16 12.109 -7.329 -11.544 1.00 0.00 C ATOM 247 CG GLN A 16 11.128 -7.747 -12.627 1.00 0.00 C ATOM 248 CD GLN A 16 11.666 -8.861 -13.503 1.00 0.00 C ATOM 249 OE1 GLN A 16 11.399 -10.102 -13.112 1.00 0.00 O flip ATOM 250 NE2 GLN A 16 12.314 -8.610 -14.519 1.00 0.00 N flip ATOM 0 H GLN A 16 11.073 -7.713 -9.284 1.00 0.00 H new ATOM 0 HA GLN A 16 12.495 -9.404 -11.169 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.667 -6.525 -10.956 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.006 -6.925 -12.014 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.197 -8.072 -12.163 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.890 -6.884 -13.249 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.495 -7.641 -14.782 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.669 -9.371 -15.098 1.00 0.00 H new ATOM 259 N TYR A 17 14.025 -7.391 -9.057 1.00 0.00 N ATOM 260 CA TYR A 17 15.318 -7.089 -8.456 1.00 0.00 C ATOM 261 C TYR A 17 15.709 -8.148 -7.430 1.00 0.00 C ATOM 262 O TYR A 17 16.633 -8.930 -7.653 1.00 0.00 O ATOM 263 CB TYR A 17 15.298 -5.706 -7.806 1.00 0.00 C ATOM 264 CG TYR A 17 15.898 -4.628 -8.680 1.00 0.00 C ATOM 265 CD1 TYR A 17 15.536 -4.511 -10.017 1.00 0.00 C ATOM 266 CD2 TYR A 17 16.828 -3.732 -8.171 1.00 0.00 C ATOM 267 CE1 TYR A 17 16.085 -3.531 -10.821 1.00 0.00 C ATOM 268 CE2 TYR A 17 17.382 -2.748 -8.969 1.00 0.00 C ATOM 269 CZ TYR A 17 17.007 -2.652 -10.292 1.00 0.00 C ATOM 270 OH TYR A 17 17.556 -1.675 -11.090 1.00 0.00 O ATOM 0 H TYR A 17 13.236 -6.902 -8.634 1.00 0.00 H new ATOM 0 HA TYR A 17 16.064 -7.093 -9.250 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.269 -5.439 -7.566 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.844 -5.747 -6.864 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.814 -5.197 -10.434 1.00 0.00 H new ATOM 0 HD2 TYR A 17 17.124 -3.805 -7.135 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.794 -3.453 -11.858 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.105 -2.058 -8.558 1.00 0.00 H new ATOM 0 HH TYR A 17 18.186 -1.139 -10.564 1.00 0.00 H new ATOM 280 N SER A 18 15.004 -8.166 -6.303 1.00 0.00 N ATOM 281 CA SER A 18 15.285 -9.127 -5.243 1.00 0.00 C ATOM 282 C SER A 18 15.135 -10.558 -5.751 1.00 0.00 C ATOM 283 O SER A 18 14.094 -10.932 -6.293 1.00 0.00 O ATOM 284 CB SER A 18 14.356 -8.891 -4.050 1.00 0.00 C ATOM 285 OG SER A 18 14.075 -10.099 -3.365 1.00 0.00 O ATOM 0 H SER A 18 14.235 -7.527 -6.101 1.00 0.00 H new ATOM 0 HA SER A 18 16.316 -8.984 -4.921 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.817 -8.181 -3.363 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.425 -8.442 -4.396 1.00 0.00 H new ATOM 0 HG SER A 18 13.425 -10.623 -3.879 1.00 0.00 H new ATOM 291 N GLY A 19 16.183 -11.353 -5.568 1.00 0.00 N ATOM 292 CA GLY A 19 16.154 -12.736 -6.008 1.00 0.00 C ATOM 293 C GLY A 19 17.394 -13.118 -6.793 1.00 0.00 C ATOM 294 O GLY A 19 17.806 -14.278 -6.792 1.00 0.00 O ATOM 0 H GLY A 19 17.054 -11.064 -5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 19 16.061 -13.389 -5.140 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.271 -12.900 -6.626 1.00 0.00 H new ATOM 355 N LYS A 24 16.737 -12.967 -1.601 1.00 0.00 N ATOM 356 CA LYS A 24 15.391 -12.781 -2.132 1.00 0.00 C ATOM 357 C LYS A 24 14.438 -12.303 -1.040 1.00 0.00 C ATOM 358 O LYS A 24 14.692 -12.504 0.147 1.00 0.00 O ATOM 359 CB LYS A 24 14.878 -14.084 -2.748 1.00 0.00 C ATOM 360 CG LYS A 24 13.685 -13.894 -3.673 1.00 0.00 C ATOM 361 CD LYS A 24 12.407 -14.444 -3.062 1.00 0.00 C ATOM 362 CE LYS A 24 11.199 -14.141 -3.932 1.00 0.00 C ATOM 363 NZ LYS A 24 11.236 -14.892 -5.219 1.00 0.00 N ATOM 0 HA LYS A 24 15.434 -12.017 -2.908 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.687 -14.556 -3.305 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.600 -14.770 -1.947 1.00 0.00 H new ATOM 0 HG2 LYS A 24 13.558 -12.833 -3.890 1.00 0.00 H new ATOM 0 HG3 LYS A 24 13.878 -14.392 -4.623 1.00 0.00 H new ATOM 0 HD2 LYS A 24 12.500 -15.522 -2.930 1.00 0.00 H new ATOM 0 HD3 LYS A 24 12.261 -14.013 -2.072 1.00 0.00 H new ATOM 0 HE2 LYS A 24 10.288 -14.396 -3.390 1.00 0.00 H new ATOM 0 HE3 LYS A 24 11.159 -13.071 -4.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 10.362 -14.709 -5.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 12.055 -14.581 -5.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 11.316 -15.910 -5.024 1.00 0.00 H new ATOM 377 N HIS A 25 13.344 -11.662 -1.456 1.00 0.00 N ATOM 378 CA HIS A 25 12.334 -11.135 -0.534 1.00 0.00 C ATOM 379 C HIS A 25 12.730 -9.760 0.005 1.00 0.00 C ATOM 380 O HIS A 25 11.878 -8.901 0.208 1.00 0.00 O ATOM 381 CB HIS A 25 12.082 -12.096 0.633 1.00 0.00 C ATOM 382 CG HIS A 25 10.852 -11.756 1.417 1.00 0.00 C ATOM 383 ND1 HIS A 25 10.386 -12.529 2.459 1.00 0.00 N ATOM 384 CD2 HIS A 25 9.993 -10.714 1.308 1.00 0.00 C ATOM 385 CE1 HIS A 25 9.291 -11.980 2.956 1.00 0.00 C ATOM 386 NE2 HIS A 25 9.033 -10.878 2.277 1.00 0.00 N ATOM 0 H HIS A 25 13.133 -11.493 -2.440 1.00 0.00 H new ATOM 0 HA HIS A 25 11.411 -11.032 -1.105 1.00 0.00 H new ATOM 0 HB2 HIS A 25 11.991 -13.111 0.247 1.00 0.00 H new ATOM 0 HB3 HIS A 25 12.945 -12.084 1.299 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.052 -9.906 0.594 1.00 0.00 H new ATOM 0 HE1 HIS A 25 8.707 -12.367 3.778 1.00 0.00 H new ATOM 0 HE2 HIS A 25 8.247 -10.249 2.445 1.00 0.00 H new ATOM 395 N LYS A 26 14.021 -9.554 0.236 1.00 0.00 N ATOM 396 CA LYS A 26 14.507 -8.281 0.752 1.00 0.00 C ATOM 397 C LYS A 26 15.314 -7.550 -0.313 1.00 0.00 C ATOM 398 O LYS A 26 15.728 -8.144 -1.309 1.00 0.00 O ATOM 399 CB LYS A 26 15.372 -8.502 1.995 1.00 0.00 C ATOM 400 CG LYS A 26 14.665 -8.178 3.303 1.00 0.00 C ATOM 401 CD LYS A 26 14.241 -9.440 4.041 1.00 0.00 C ATOM 402 CE LYS A 26 13.371 -10.332 3.171 1.00 0.00 C ATOM 403 NZ LYS A 26 12.197 -10.869 3.916 1.00 0.00 N ATOM 0 H LYS A 26 14.748 -10.251 0.075 1.00 0.00 H new ATOM 0 HA LYS A 26 13.645 -7.672 1.025 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.699 -9.541 2.018 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.269 -7.887 1.916 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.327 -7.590 3.939 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.788 -7.563 3.100 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.126 -9.992 4.358 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.695 -9.168 4.944 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.023 -9.767 2.306 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.968 -11.161 2.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.882 -11.757 3.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.466 -11.050 4.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.422 -10.176 3.890 1.00 0.00 H new ATOM 417 N LEU A 27 15.526 -6.259 -0.101 1.00 0.00 N ATOM 418 CA LEU A 27 16.275 -5.447 -1.052 1.00 0.00 C ATOM 419 C LEU A 27 17.257 -4.537 -0.322 1.00 0.00 C ATOM 420 O LEU A 27 16.952 -4.007 0.741 1.00 0.00 O ATOM 421 CB LEU A 27 15.312 -4.632 -1.919 1.00 0.00 C ATOM 422 CG LEU A 27 14.412 -5.464 -2.849 1.00 0.00 C ATOM 423 CD1 LEU A 27 13.052 -5.743 -2.206 1.00 0.00 C ATOM 424 CD2 LEU A 27 14.234 -4.762 -4.188 1.00 0.00 C ATOM 0 H LEU A 27 15.192 -5.752 0.718 1.00 0.00 H new ATOM 0 HA LEU A 27 16.850 -6.106 -1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 27 14.678 -4.032 -1.266 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.893 -3.937 -2.526 1.00 0.00 H new ATOM 0 HG LEU A 27 14.904 -6.422 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.441 -6.333 -2.889 1.00 0.00 H new ATOM 0 HD12 LEU A 27 13.195 -6.296 -1.278 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.550 -4.799 -1.992 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.595 -5.365 -4.833 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.773 -3.787 -4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 27 15.207 -4.631 -4.662 1.00 0.00 H new ATOM 436 N LYS A 28 18.443 -4.372 -0.889 1.00 0.00 N ATOM 437 CA LYS A 28 19.467 -3.535 -0.268 1.00 0.00 C ATOM 438 C LYS A 28 19.572 -2.179 -0.950 1.00 0.00 C ATOM 439 O LYS A 28 18.925 -1.930 -1.968 1.00 0.00 O ATOM 440 CB LYS A 28 20.826 -4.241 -0.296 1.00 0.00 C ATOM 441 CG LYS A 28 21.109 -4.980 -1.594 1.00 0.00 C ATOM 442 CD LYS A 28 22.581 -4.907 -1.967 1.00 0.00 C ATOM 443 CE LYS A 28 23.003 -6.095 -2.817 1.00 0.00 C ATOM 444 NZ LYS A 28 23.213 -5.714 -4.241 1.00 0.00 N ATOM 0 H LYS A 28 18.722 -4.802 -1.771 1.00 0.00 H new ATOM 0 HA LYS A 28 19.170 -3.369 0.768 1.00 0.00 H new ATOM 0 HB2 LYS A 28 21.611 -3.503 -0.131 1.00 0.00 H new ATOM 0 HB3 LYS A 28 20.874 -4.949 0.532 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.810 -6.023 -1.493 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.508 -4.552 -2.396 1.00 0.00 H new ATOM 0 HD2 LYS A 28 22.773 -3.983 -2.512 1.00 0.00 H new ATOM 0 HD3 LYS A 28 23.185 -4.875 -1.060 1.00 0.00 H new ATOM 0 HE2 LYS A 28 23.923 -6.520 -2.416 1.00 0.00 H new ATOM 0 HE3 LYS A 28 22.241 -6.872 -2.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 23.644 -6.510 -4.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.298 -5.477 -4.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 23.844 -4.889 -4.290 1.00 0.00 H new ATOM 458 N LYS A 29 20.397 -1.305 -0.380 1.00 0.00 N ATOM 459 CA LYS A 29 20.600 0.033 -0.924 1.00 0.00 C ATOM 460 C LYS A 29 20.876 -0.029 -2.422 1.00 0.00 C ATOM 461 O LYS A 29 20.578 0.910 -3.159 1.00 0.00 O ATOM 462 CB LYS A 29 21.762 0.726 -0.209 1.00 0.00 C ATOM 463 CG LYS A 29 21.641 0.708 1.308 1.00 0.00 C ATOM 464 CD LYS A 29 22.932 0.246 1.965 1.00 0.00 C ATOM 465 CE LYS A 29 22.659 -0.570 3.218 1.00 0.00 C ATOM 466 NZ LYS A 29 23.815 -0.551 4.156 1.00 0.00 N ATOM 0 H LYS A 29 20.938 -1.501 0.462 1.00 0.00 H new ATOM 0 HA LYS A 29 19.688 0.608 -0.762 1.00 0.00 H new ATOM 0 HB2 LYS A 29 22.695 0.242 -0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 29 21.822 1.760 -0.548 1.00 0.00 H new ATOM 0 HG2 LYS A 29 21.387 1.706 1.666 1.00 0.00 H new ATOM 0 HG3 LYS A 29 20.826 0.047 1.601 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.507 -0.352 1.258 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.542 1.113 2.220 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.776 -0.177 3.722 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.435 -1.600 2.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 23.589 -1.119 4.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 24.652 -0.950 3.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 24.013 0.429 4.443 1.00 0.00 H new ATOM 480 N SER A 30 21.443 -1.145 -2.866 1.00 0.00 N ATOM 481 CA SER A 30 21.751 -1.332 -4.275 1.00 0.00 C ATOM 482 C SER A 30 20.502 -1.731 -5.052 1.00 0.00 C ATOM 483 O SER A 30 20.210 -1.169 -6.103 1.00 0.00 O ATOM 484 CB SER A 30 22.834 -2.398 -4.446 1.00 0.00 C ATOM 485 OG SER A 30 23.830 -2.278 -3.444 1.00 0.00 O ATOM 0 H SER A 30 21.698 -1.932 -2.270 1.00 0.00 H new ATOM 0 HA SER A 30 22.119 -0.386 -4.671 1.00 0.00 H new ATOM 0 HB2 SER A 30 22.384 -3.389 -4.399 1.00 0.00 H new ATOM 0 HB3 SER A 30 23.291 -2.302 -5.431 1.00 0.00 H new ATOM 0 HG SER A 30 24.510 -2.972 -3.574 1.00 0.00 H new ATOM 491 N GLU A 31 19.766 -2.706 -4.531 1.00 0.00 N ATOM 492 CA GLU A 31 18.552 -3.173 -5.190 1.00 0.00 C ATOM 493 C GLU A 31 17.507 -2.065 -5.277 1.00 0.00 C ATOM 494 O GLU A 31 17.191 -1.582 -6.362 1.00 0.00 O ATOM 495 CB GLU A 31 17.973 -4.377 -4.445 1.00 0.00 C ATOM 496 CG GLU A 31 18.877 -5.598 -4.464 1.00 0.00 C ATOM 497 CD GLU A 31 18.824 -6.342 -5.784 1.00 0.00 C ATOM 498 OE1 GLU A 31 19.173 -5.739 -6.821 1.00 0.00 O ATOM 499 OE2 GLU A 31 18.433 -7.528 -5.781 1.00 0.00 O ATOM 0 H GLU A 31 19.987 -3.186 -3.659 1.00 0.00 H new ATOM 0 HA GLU A 31 18.818 -3.471 -6.204 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.780 -4.095 -3.410 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.012 -4.640 -4.888 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.903 -5.289 -4.266 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.587 -6.273 -3.659 1.00 0.00 H new ATOM 506 N LEU A 32 16.967 -1.674 -4.127 1.00 0.00 N ATOM 507 CA LEU A 32 15.945 -0.631 -4.067 1.00 0.00 C ATOM 508 C LEU A 32 16.360 0.619 -4.843 1.00 0.00 C ATOM 509 O LEU A 32 15.764 0.949 -5.869 1.00 0.00 O ATOM 510 CB LEU A 32 15.651 -0.264 -2.611 1.00 0.00 C ATOM 511 CG LEU A 32 14.483 0.703 -2.411 1.00 0.00 C ATOM 512 CD1 LEU A 32 13.751 0.397 -1.113 1.00 0.00 C ATOM 513 CD2 LEU A 32 14.977 2.142 -2.420 1.00 0.00 C ATOM 0 H LEU A 32 17.221 -2.065 -3.220 1.00 0.00 H new ATOM 0 HA LEU A 32 15.044 -1.029 -4.533 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.444 -1.179 -2.056 1.00 0.00 H new ATOM 0 HB3 LEU A 32 16.547 0.178 -2.175 1.00 0.00 H new ATOM 0 HG LEU A 32 13.783 0.573 -3.237 1.00 0.00 H new ATOM 0 HD11 LEU A 32 12.924 1.096 -0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.364 -0.622 -1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.440 0.498 -0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.133 2.817 -2.277 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.697 2.285 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.455 2.357 -3.376 1.00 0.00 H new ATOM 525 N LYS A 33 17.373 1.317 -4.338 1.00 0.00 N ATOM 526 CA LYS A 33 17.862 2.543 -4.973 1.00 0.00 C ATOM 527 C LYS A 33 18.005 2.384 -6.486 1.00 0.00 C ATOM 528 O LYS A 33 17.289 3.028 -7.252 1.00 0.00 O ATOM 529 CB LYS A 33 19.203 2.952 -4.364 1.00 0.00 C ATOM 530 CG LYS A 33 19.443 4.455 -4.385 1.00 0.00 C ATOM 531 CD LYS A 33 20.635 4.864 -3.526 1.00 0.00 C ATOM 532 CE LYS A 33 20.650 4.153 -2.177 1.00 0.00 C ATOM 533 NZ LYS A 33 21.465 4.889 -1.171 1.00 0.00 N ATOM 0 H LYS A 33 17.874 1.056 -3.489 1.00 0.00 H new ATOM 0 HA LYS A 33 17.124 3.324 -4.790 1.00 0.00 H new ATOM 0 HB2 LYS A 33 19.249 2.599 -3.334 1.00 0.00 H new ATOM 0 HB3 LYS A 33 20.007 2.455 -4.907 1.00 0.00 H new ATOM 0 HG2 LYS A 33 19.610 4.779 -5.412 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.549 4.968 -4.030 1.00 0.00 H new ATOM 0 HD2 LYS A 33 21.558 4.642 -4.061 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.611 5.942 -3.365 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.629 4.048 -1.810 1.00 0.00 H new ATOM 0 HE3 LYS A 33 21.049 3.146 -2.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.239 4.539 -0.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 22.475 4.737 -1.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.250 5.905 -1.227 1.00 0.00 H new ATOM 547 N GLU A 34 18.935 1.531 -6.915 1.00 0.00 N ATOM 548 CA GLU A 34 19.162 1.305 -8.343 1.00 0.00 C ATOM 549 C GLU A 34 17.842 1.094 -9.078 1.00 0.00 C ATOM 550 O GLU A 34 17.629 1.637 -10.162 1.00 0.00 O ATOM 551 CB GLU A 34 20.078 0.100 -8.565 1.00 0.00 C ATOM 552 CG GLU A 34 21.468 0.272 -7.974 1.00 0.00 C ATOM 553 CD GLU A 34 22.484 0.741 -8.996 1.00 0.00 C ATOM 554 OE1 GLU A 34 22.068 1.279 -10.044 1.00 0.00 O ATOM 555 OE2 GLU A 34 23.696 0.572 -8.749 1.00 0.00 O ATOM 0 H GLU A 34 19.540 0.988 -6.299 1.00 0.00 H new ATOM 0 HA GLU A 34 19.648 2.194 -8.745 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.614 -0.784 -8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 34 20.168 -0.084 -9.636 1.00 0.00 H new ATOM 0 HG2 GLU A 34 21.424 0.990 -7.155 1.00 0.00 H new ATOM 0 HG3 GLU A 34 21.797 -0.676 -7.549 1.00 0.00 H new ATOM 562 N LEU A 35 16.955 0.308 -8.475 1.00 0.00 N ATOM 563 CA LEU A 35 15.652 0.038 -9.070 1.00 0.00 C ATOM 564 C LEU A 35 14.874 1.330 -9.248 1.00 0.00 C ATOM 565 O LEU A 35 14.285 1.582 -10.300 1.00 0.00 O ATOM 566 CB LEU A 35 14.857 -0.933 -8.197 1.00 0.00 C ATOM 567 CG LEU A 35 13.780 -1.733 -8.928 1.00 0.00 C ATOM 568 CD1 LEU A 35 12.948 -2.526 -7.932 1.00 0.00 C ATOM 569 CD2 LEU A 35 12.897 -0.809 -9.754 1.00 0.00 C ATOM 0 H LEU A 35 17.115 -0.151 -7.578 1.00 0.00 H new ATOM 0 HA LEU A 35 15.809 -0.417 -10.048 1.00 0.00 H new ATOM 0 HB2 LEU A 35 15.553 -1.631 -7.732 1.00 0.00 H new ATOM 0 HB3 LEU A 35 14.385 -0.370 -7.392 1.00 0.00 H new ATOM 0 HG LEU A 35 14.266 -2.434 -9.607 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.184 -3.092 -8.465 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.593 -3.213 -7.385 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.470 -1.842 -7.231 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.136 -1.396 -10.268 1.00 0.00 H new ATOM 0 HD22 LEU A 35 12.415 -0.084 -9.098 1.00 0.00 H new ATOM 0 HD23 LEU A 35 13.507 -0.284 -10.489 1.00 0.00 H new ATOM 581 N ILE A 36 14.890 2.144 -8.210 1.00 0.00 N ATOM 582 CA ILE A 36 14.200 3.425 -8.224 1.00 0.00 C ATOM 583 C ILE A 36 14.658 4.254 -9.421 1.00 0.00 C ATOM 584 O ILE A 36 13.852 4.629 -10.271 1.00 0.00 O ATOM 585 CB ILE A 36 14.428 4.197 -6.898 1.00 0.00 C ATOM 586 CG1 ILE A 36 13.297 3.866 -5.915 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.524 5.702 -7.129 1.00 0.00 C ATOM 588 CD1 ILE A 36 13.185 4.828 -4.752 1.00 0.00 C ATOM 0 H ILE A 36 15.377 1.940 -7.337 1.00 0.00 H new ATOM 0 HA ILE A 36 13.130 3.239 -8.317 1.00 0.00 H new ATOM 0 HB ILE A 36 15.381 3.880 -6.474 1.00 0.00 H new ATOM 0 HG12 ILE A 36 12.351 3.857 -6.457 1.00 0.00 H new ATOM 0 HG13 ILE A 36 13.452 2.860 -5.526 1.00 0.00 H new ATOM 0 HG21 ILE A 36 14.684 6.207 -6.176 1.00 0.00 H new ATOM 0 HG22 ILE A 36 15.359 5.915 -7.797 1.00 0.00 H new ATOM 0 HG23 ILE A 36 13.598 6.061 -7.579 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.362 4.523 -4.106 1.00 0.00 H new ATOM 0 HD12 ILE A 36 14.115 4.821 -4.183 1.00 0.00 H new ATOM 0 HD13 ILE A 36 12.997 5.834 -5.128 1.00 0.00 H new ATOM 600 N ASN A 37 15.958 4.513 -9.494 1.00 0.00 N ATOM 601 CA ASN A 37 16.517 5.274 -10.603 1.00 0.00 C ATOM 602 C ASN A 37 16.262 4.549 -11.923 1.00 0.00 C ATOM 603 O ASN A 37 16.306 5.153 -12.995 1.00 0.00 O ATOM 604 CB ASN A 37 18.018 5.486 -10.402 1.00 0.00 C ATOM 605 CG ASN A 37 18.485 6.836 -10.912 1.00 0.00 C ATOM 606 OD1 ASN A 37 18.126 7.255 -12.013 1.00 0.00 O ATOM 607 ND2 ASN A 37 19.290 7.525 -10.111 1.00 0.00 N ATOM 0 H ASN A 37 16.642 4.208 -8.801 1.00 0.00 H new ATOM 0 HA ASN A 37 16.028 6.248 -10.635 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.256 5.399 -9.342 1.00 0.00 H new ATOM 0 HB3 ASN A 37 18.566 4.697 -10.917 1.00 0.00 H new ATOM 0 HD21 ASN A 37 19.636 8.440 -10.400 1.00 0.00 H new ATOM 0 HD22 ASN A 37 19.562 7.139 -9.207 1.00 0.00 H new ATOM 614 N ASN A 38 15.992 3.248 -11.833 1.00 0.00 N ATOM 615 CA ASN A 38 15.726 2.433 -13.010 1.00 0.00 C ATOM 616 C ASN A 38 14.269 2.561 -13.447 1.00 0.00 C ATOM 617 O ASN A 38 13.965 2.512 -14.638 1.00 0.00 O ATOM 618 CB ASN A 38 16.054 0.965 -12.721 1.00 0.00 C ATOM 619 CG ASN A 38 16.196 0.145 -13.988 1.00 0.00 C ATOM 620 OD1 ASN A 38 17.279 0.058 -14.567 1.00 0.00 O ATOM 621 ND2 ASN A 38 15.100 -0.465 -14.424 1.00 0.00 N ATOM 0 H ASN A 38 15.952 2.737 -10.951 1.00 0.00 H new ATOM 0 HA ASN A 38 16.361 2.792 -13.820 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.980 0.908 -12.149 1.00 0.00 H new ATOM 0 HB3 ASN A 38 15.268 0.535 -12.099 1.00 0.00 H new ATOM 0 HD21 ASN A 38 15.135 -1.033 -15.270 1.00 0.00 H new ATOM 0 HD22 ASN A 38 14.223 -0.365 -13.912 1.00 0.00 H new ATOM 628 N GLU A 39 13.372 2.717 -12.477 1.00 0.00 N ATOM 629 CA GLU A 39 11.947 2.842 -12.776 1.00 0.00 C ATOM 630 C GLU A 39 11.412 4.223 -12.402 1.00 0.00 C ATOM 631 O GLU A 39 10.209 4.398 -12.216 1.00 0.00 O ATOM 632 CB GLU A 39 11.157 1.760 -12.038 1.00 0.00 C ATOM 633 CG GLU A 39 11.323 0.373 -12.637 1.00 0.00 C ATOM 634 CD GLU A 39 9.997 -0.310 -12.911 1.00 0.00 C ATOM 635 OE1 GLU A 39 9.282 -0.631 -11.939 1.00 0.00 O ATOM 636 OE2 GLU A 39 9.674 -0.526 -14.098 1.00 0.00 O ATOM 0 H GLU A 39 13.603 2.760 -11.484 1.00 0.00 H new ATOM 0 HA GLU A 39 11.822 2.714 -13.851 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.474 1.737 -10.995 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.100 2.025 -12.044 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.887 0.449 -13.567 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.911 -0.244 -11.957 1.00 0.00 H new ATOM 643 N LEU A 40 12.307 5.202 -12.301 1.00 0.00 N ATOM 644 CA LEU A 40 11.909 6.565 -11.957 1.00 0.00 C ATOM 645 C LEU A 40 12.850 7.582 -12.594 1.00 0.00 C ATOM 646 O LEU A 40 12.486 8.260 -13.555 1.00 0.00 O ATOM 647 CB LEU A 40 11.884 6.754 -10.436 1.00 0.00 C ATOM 648 CG LEU A 40 10.887 5.867 -9.686 1.00 0.00 C ATOM 649 CD1 LEU A 40 11.254 5.777 -8.213 1.00 0.00 C ATOM 650 CD2 LEU A 40 9.471 6.399 -9.853 1.00 0.00 C ATOM 0 H LEU A 40 13.308 5.079 -12.452 1.00 0.00 H new ATOM 0 HA LEU A 40 10.905 6.729 -12.347 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.883 6.561 -10.045 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.653 7.797 -10.219 1.00 0.00 H new ATOM 0 HG LEU A 40 10.931 4.864 -10.111 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.534 5.142 -7.697 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.252 5.350 -8.112 1.00 0.00 H new ATOM 0 HD13 LEU A 40 11.240 6.774 -7.773 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.775 5.757 -9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 40 9.413 7.412 -9.454 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.209 6.410 -10.911 1.00 0.00 H new ATOM 779 N LYS A 48 15.622 12.283 -3.396 1.00 0.00 N ATOM 780 CA LYS A 48 16.177 13.569 -3.804 1.00 0.00 C ATOM 781 C LYS A 48 17.705 13.549 -3.725 1.00 0.00 C ATOM 782 O LYS A 48 18.361 14.557 -3.988 1.00 0.00 O ATOM 783 CB LYS A 48 15.619 14.697 -2.933 1.00 0.00 C ATOM 784 CG LYS A 48 15.651 14.396 -1.443 1.00 0.00 C ATOM 785 CD LYS A 48 14.288 13.958 -0.933 1.00 0.00 C ATOM 786 CE LYS A 48 14.389 13.311 0.438 1.00 0.00 C ATOM 787 NZ LYS A 48 14.790 14.288 1.486 1.00 0.00 N ATOM 0 HA LYS A 48 15.886 13.750 -4.839 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.190 15.606 -3.123 1.00 0.00 H new ATOM 0 HB3 LYS A 48 14.590 14.899 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 48 16.383 13.613 -1.245 1.00 0.00 H new ATOM 0 HG3 LYS A 48 15.976 15.283 -0.899 1.00 0.00 H new ATOM 0 HD2 LYS A 48 13.623 14.820 -0.882 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.844 13.254 -1.637 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.428 12.869 0.702 1.00 0.00 H new ATOM 0 HE3 LYS A 48 15.115 12.498 0.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.028 13.780 2.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.619 14.825 1.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.003 14.943 1.669 1.00 0.00 H new ATOM 801 N GLU A 49 18.263 12.393 -3.365 1.00 0.00 N ATOM 802 CA GLU A 49 19.707 12.234 -3.253 1.00 0.00 C ATOM 803 C GLU A 49 20.059 10.793 -2.894 1.00 0.00 C ATOM 804 O GLU A 49 19.176 9.977 -2.629 1.00 0.00 O ATOM 805 CB GLU A 49 20.268 13.192 -2.197 1.00 0.00 C ATOM 806 CG GLU A 49 21.125 14.303 -2.779 1.00 0.00 C ATOM 807 CD GLU A 49 22.300 14.658 -1.890 1.00 0.00 C ATOM 808 OE1 GLU A 49 23.126 13.763 -1.611 1.00 0.00 O ATOM 809 OE2 GLU A 49 22.396 15.832 -1.472 1.00 0.00 O ATOM 0 H GLU A 49 17.731 11.551 -3.146 1.00 0.00 H new ATOM 0 HA GLU A 49 20.156 12.473 -4.217 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.440 13.635 -1.644 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.862 12.623 -1.481 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.494 13.997 -3.758 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.509 15.189 -2.933 1.00 0.00 H new ATOM 816 N GLN A 50 21.349 10.485 -2.883 1.00 0.00 N ATOM 817 CA GLN A 50 21.803 9.140 -2.551 1.00 0.00 C ATOM 818 C GLN A 50 21.726 8.902 -1.047 1.00 0.00 C ATOM 819 O GLN A 50 21.437 7.793 -0.594 1.00 0.00 O ATOM 820 CB GLN A 50 23.236 8.927 -3.046 1.00 0.00 C ATOM 821 CG GLN A 50 23.409 7.665 -3.876 1.00 0.00 C ATOM 822 CD GLN A 50 24.850 7.428 -4.282 1.00 0.00 C ATOM 823 OE1 GLN A 50 25.774 7.995 -3.699 1.00 0.00 O ATOM 824 NE2 GLN A 50 25.049 6.586 -5.290 1.00 0.00 N ATOM 0 H GLN A 50 22.097 11.144 -3.099 1.00 0.00 H new ATOM 0 HA GLN A 50 21.148 8.424 -3.048 1.00 0.00 H new ATOM 0 HB2 GLN A 50 23.538 9.788 -3.642 1.00 0.00 H new ATOM 0 HB3 GLN A 50 23.906 8.882 -2.187 1.00 0.00 H new ATOM 0 HG2 GLN A 50 23.050 6.808 -3.306 1.00 0.00 H new ATOM 0 HG3 GLN A 50 22.790 7.735 -4.770 1.00 0.00 H new ATOM 0 HE21 GLN A 50 24.254 6.138 -5.745 1.00 0.00 H new ATOM 0 HE22 GLN A 50 25.997 6.388 -5.609 1.00 0.00 H new ATOM 833 N GLU A 51 21.989 9.953 -0.277 1.00 0.00 N ATOM 834 CA GLU A 51 21.954 9.863 1.177 1.00 0.00 C ATOM 835 C GLU A 51 20.532 9.648 1.684 1.00 0.00 C ATOM 836 O GLU A 51 20.304 8.854 2.598 1.00 0.00 O ATOM 837 CB GLU A 51 22.547 11.125 1.809 1.00 0.00 C ATOM 838 CG GLU A 51 22.097 12.418 1.145 1.00 0.00 C ATOM 839 CD GLU A 51 22.420 13.643 1.977 1.00 0.00 C ATOM 840 OE1 GLU A 51 23.460 13.634 2.668 1.00 0.00 O ATOM 841 OE2 GLU A 51 21.632 14.611 1.938 1.00 0.00 O ATOM 0 H GLU A 51 22.229 10.877 -0.637 1.00 0.00 H new ATOM 0 HA GLU A 51 22.556 9.002 1.469 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.272 11.155 2.863 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.634 11.065 1.765 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.577 12.508 0.171 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.022 12.376 0.968 1.00 0.00 H new ATOM 848 N VAL A 52 19.580 10.359 1.094 1.00 0.00 N ATOM 849 CA VAL A 52 18.186 10.238 1.499 1.00 0.00 C ATOM 850 C VAL A 52 17.674 8.819 1.290 1.00 0.00 C ATOM 851 O VAL A 52 17.009 8.260 2.160 1.00 0.00 O ATOM 852 CB VAL A 52 17.278 11.220 0.734 1.00 0.00 C ATOM 853 CG1 VAL A 52 17.608 12.656 1.112 1.00 0.00 C ATOM 854 CG2 VAL A 52 17.408 11.011 -0.766 1.00 0.00 C ATOM 0 H VAL A 52 19.746 11.022 0.337 1.00 0.00 H new ATOM 0 HA VAL A 52 18.149 10.484 2.560 1.00 0.00 H new ATOM 0 HB VAL A 52 16.243 11.024 1.015 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.957 13.336 0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.456 12.795 2.182 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.648 12.868 0.863 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.759 11.714 -1.289 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.442 11.178 -1.068 1.00 0.00 H new ATOM 0 HG23 VAL A 52 17.116 9.991 -1.018 1.00 0.00 H new ATOM 864 N VAL A 53 17.988 8.234 0.134 1.00 0.00 N ATOM 865 CA VAL A 53 17.545 6.872 -0.165 1.00 0.00 C ATOM 866 C VAL A 53 17.939 5.920 0.957 1.00 0.00 C ATOM 867 O VAL A 53 17.114 5.153 1.451 1.00 0.00 O ATOM 868 CB VAL A 53 18.113 6.329 -1.492 1.00 0.00 C ATOM 869 CG1 VAL A 53 17.208 5.231 -2.038 1.00 0.00 C ATOM 870 CG2 VAL A 53 18.302 7.440 -2.516 1.00 0.00 C ATOM 0 H VAL A 53 18.540 8.675 -0.602 1.00 0.00 H new ATOM 0 HA VAL A 53 16.460 6.926 -0.259 1.00 0.00 H new ATOM 0 HB VAL A 53 19.097 5.905 -1.292 1.00 0.00 H new ATOM 0 HG11 VAL A 53 17.618 4.854 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.147 4.417 -1.315 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.211 5.635 -2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 53 18.704 7.020 -3.438 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.342 7.913 -2.721 1.00 0.00 H new ATOM 0 HG23 VAL A 53 18.996 8.183 -2.123 1.00 0.00 H new ATOM 880 N ASP A 54 19.205 5.982 1.366 1.00 0.00 N ATOM 881 CA ASP A 54 19.699 5.127 2.441 1.00 0.00 C ATOM 882 C ASP A 54 18.794 5.246 3.663 1.00 0.00 C ATOM 883 O ASP A 54 18.367 4.244 4.232 1.00 0.00 O ATOM 884 CB ASP A 54 21.135 5.501 2.809 1.00 0.00 C ATOM 885 CG ASP A 54 21.770 4.500 3.755 1.00 0.00 C ATOM 886 OD1 ASP A 54 21.588 3.283 3.540 1.00 0.00 O ATOM 887 OD2 ASP A 54 22.448 4.932 4.710 1.00 0.00 O ATOM 0 H ASP A 54 19.903 6.612 0.971 1.00 0.00 H new ATOM 0 HA ASP A 54 19.690 4.094 2.094 1.00 0.00 H new ATOM 0 HB2 ASP A 54 21.734 5.569 1.901 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.143 6.488 3.270 1.00 0.00 H new ATOM 892 N LYS A 55 18.491 6.482 4.045 1.00 0.00 N ATOM 893 CA LYS A 55 17.618 6.733 5.179 1.00 0.00 C ATOM 894 C LYS A 55 16.197 6.302 4.839 1.00 0.00 C ATOM 895 O LYS A 55 15.448 5.852 5.707 1.00 0.00 O ATOM 896 CB LYS A 55 17.647 8.214 5.557 1.00 0.00 C ATOM 897 CG LYS A 55 17.484 8.461 7.048 1.00 0.00 C ATOM 898 CD LYS A 55 17.545 9.943 7.385 1.00 0.00 C ATOM 899 CE LYS A 55 18.855 10.570 6.933 1.00 0.00 C ATOM 900 NZ LYS A 55 18.942 12.007 7.312 1.00 0.00 N ATOM 0 H LYS A 55 18.838 7.323 3.584 1.00 0.00 H new ATOM 0 HA LYS A 55 17.971 6.154 6.032 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.591 8.647 5.226 1.00 0.00 H new ATOM 0 HB3 LYS A 55 16.852 8.733 5.021 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.531 8.051 7.382 1.00 0.00 H new ATOM 0 HG3 LYS A 55 18.267 7.932 7.592 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.711 10.459 6.909 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.430 10.077 8.461 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.690 10.026 7.376 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.950 10.473 5.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 19.849 12.398 6.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.160 12.531 6.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 18.877 12.098 8.346 1.00 0.00 H new ATOM 914 N VAL A 56 15.838 6.425 3.562 1.00 0.00 N ATOM 915 CA VAL A 56 14.515 6.029 3.102 1.00 0.00 C ATOM 916 C VAL A 56 14.326 4.530 3.293 1.00 0.00 C ATOM 917 O VAL A 56 13.428 4.097 4.014 1.00 0.00 O ATOM 918 CB VAL A 56 14.293 6.391 1.616 1.00 0.00 C ATOM 919 CG1 VAL A 56 12.922 5.925 1.146 1.00 0.00 C ATOM 920 CG2 VAL A 56 14.456 7.890 1.399 1.00 0.00 C ATOM 0 H VAL A 56 16.446 6.795 2.832 1.00 0.00 H new ATOM 0 HA VAL A 56 13.782 6.575 3.696 1.00 0.00 H new ATOM 0 HB VAL A 56 15.048 5.875 1.023 1.00 0.00 H new ATOM 0 HG11 VAL A 56 12.787 6.190 0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.847 4.844 1.259 1.00 0.00 H new ATOM 0 HG13 VAL A 56 12.149 6.407 1.744 1.00 0.00 H new ATOM 0 HG21 VAL A 56 14.296 8.125 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 56 13.727 8.427 2.006 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.462 8.192 1.689 1.00 0.00 H new ATOM 930 N MET A 57 15.193 3.740 2.663 1.00 0.00 N ATOM 931 CA MET A 57 15.125 2.290 2.793 1.00 0.00 C ATOM 932 C MET A 57 15.237 1.891 4.265 1.00 0.00 C ATOM 933 O MET A 57 14.775 0.824 4.670 1.00 0.00 O ATOM 934 CB MET A 57 16.232 1.621 1.969 1.00 0.00 C ATOM 935 CG MET A 57 17.615 1.716 2.597 1.00 0.00 C ATOM 936 SD MET A 57 18.270 0.108 3.089 1.00 0.00 S ATOM 937 CE MET A 57 18.010 -0.841 1.592 1.00 0.00 C ATOM 0 H MET A 57 15.945 4.078 2.062 1.00 0.00 H new ATOM 0 HA MET A 57 14.163 1.950 2.409 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.980 0.570 1.827 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.261 2.078 0.980 1.00 0.00 H new ATOM 0 HG2 MET A 57 18.300 2.181 1.888 1.00 0.00 H new ATOM 0 HG3 MET A 57 17.569 2.367 3.470 1.00 0.00 H new ATOM 0 HE1 MET A 57 18.697 -1.687 1.573 1.00 0.00 H new ATOM 0 HE2 MET A 57 16.984 -1.207 1.567 1.00 0.00 H new ATOM 0 HE3 MET A 57 18.191 -0.207 0.724 1.00 0.00 H new ATOM 947 N GLU A 58 15.848 2.768 5.058 1.00 0.00 N ATOM 948 CA GLU A 58 16.019 2.533 6.486 1.00 0.00 C ATOM 949 C GLU A 58 14.740 2.882 7.239 1.00 0.00 C ATOM 950 O GLU A 58 14.360 2.203 8.193 1.00 0.00 O ATOM 951 CB GLU A 58 17.188 3.368 7.019 1.00 0.00 C ATOM 952 CG GLU A 58 18.404 2.540 7.401 1.00 0.00 C ATOM 953 CD GLU A 58 18.598 2.447 8.902 1.00 0.00 C ATOM 954 OE1 GLU A 58 17.585 2.436 9.633 1.00 0.00 O ATOM 955 OE2 GLU A 58 19.764 2.386 9.348 1.00 0.00 O ATOM 0 H GLU A 58 16.235 3.653 4.731 1.00 0.00 H new ATOM 0 HA GLU A 58 16.237 1.477 6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 58 17.478 4.096 6.262 1.00 0.00 H new ATOM 0 HB3 GLU A 58 16.854 3.931 7.891 1.00 0.00 H new ATOM 0 HG2 GLU A 58 18.299 1.536 6.989 1.00 0.00 H new ATOM 0 HG3 GLU A 58 19.294 2.979 6.950 1.00 0.00 H new ATOM 962 N THR A 59 14.079 3.947 6.795 1.00 0.00 N ATOM 963 CA THR A 59 12.836 4.398 7.413 1.00 0.00 C ATOM 964 C THR A 59 11.673 3.473 7.049 1.00 0.00 C ATOM 965 O THR A 59 10.569 3.616 7.576 1.00 0.00 O ATOM 966 CB THR A 59 12.522 5.833 6.972 1.00 0.00 C ATOM 967 OG1 THR A 59 13.464 6.739 7.518 1.00 0.00 O ATOM 968 CG2 THR A 59 11.141 6.307 7.381 1.00 0.00 C ATOM 0 H THR A 59 14.385 4.516 6.006 1.00 0.00 H new ATOM 0 HA THR A 59 12.965 4.373 8.495 1.00 0.00 H new ATOM 0 HB THR A 59 12.569 5.814 5.883 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.314 6.657 7.036 1.00 0.00 H new ATOM 0 HG21 THR A 59 10.990 7.330 7.035 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.387 5.658 6.935 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.052 6.274 8.467 1.00 0.00 H new ATOM 976 N LEU A 60 11.920 2.532 6.141 1.00 0.00 N ATOM 977 CA LEU A 60 10.886 1.601 5.707 1.00 0.00 C ATOM 978 C LEU A 60 11.193 0.170 6.147 1.00 0.00 C ATOM 979 O LEU A 60 10.328 -0.703 6.076 1.00 0.00 O ATOM 980 CB LEU A 60 10.737 1.661 4.189 1.00 0.00 C ATOM 981 CG LEU A 60 10.712 3.072 3.602 1.00 0.00 C ATOM 982 CD1 LEU A 60 11.390 3.100 2.242 1.00 0.00 C ATOM 983 CD2 LEU A 60 9.281 3.573 3.496 1.00 0.00 C ATOM 0 H LEU A 60 12.826 2.395 5.693 1.00 0.00 H new ATOM 0 HA LEU A 60 9.949 1.899 6.178 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.560 1.109 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 60 9.816 1.150 3.908 1.00 0.00 H new ATOM 0 HG LEU A 60 11.263 3.734 4.270 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.361 4.113 1.842 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.427 2.780 2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 60 10.869 2.426 1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.278 4.579 3.076 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.710 2.908 2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.828 3.592 4.487 1.00 0.00 H new ATOM 995 N ASP A 61 12.421 -0.070 6.605 1.00 0.00 N ATOM 996 CA ASP A 61 12.821 -1.401 7.055 1.00 0.00 C ATOM 997 C ASP A 61 11.783 -1.978 8.014 1.00 0.00 C ATOM 998 O ASP A 61 11.428 -1.348 9.010 1.00 0.00 O ATOM 999 CB ASP A 61 14.192 -1.344 7.734 1.00 0.00 C ATOM 1000 CG ASP A 61 15.213 -2.229 7.049 1.00 0.00 C ATOM 1001 OD1 ASP A 61 15.841 -1.766 6.073 1.00 0.00 O ATOM 1002 OD2 ASP A 61 15.385 -3.386 7.487 1.00 0.00 O ATOM 0 H ASP A 61 13.153 0.637 6.674 1.00 0.00 H new ATOM 0 HA ASP A 61 12.888 -2.052 6.183 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.551 -0.315 7.736 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.091 -1.649 8.776 1.00 0.00 H new ATOM 1007 N ASN A 62 11.294 -3.174 7.703 1.00 0.00 N ATOM 1008 CA ASN A 62 10.288 -3.821 8.539 1.00 0.00 C ATOM 1009 C ASN A 62 10.822 -5.113 9.146 1.00 0.00 C ATOM 1010 O ASN A 62 10.736 -5.321 10.357 1.00 0.00 O ATOM 1011 CB ASN A 62 9.027 -4.109 7.719 1.00 0.00 C ATOM 1012 CG ASN A 62 7.851 -3.253 8.147 1.00 0.00 C ATOM 1013 OD1 ASN A 62 7.965 -2.033 8.259 1.00 0.00 O ATOM 1014 ND2 ASN A 62 6.712 -3.891 8.390 1.00 0.00 N ATOM 0 H ASN A 62 11.575 -3.712 6.884 1.00 0.00 H new ATOM 0 HA ASN A 62 10.040 -3.141 9.354 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.235 -3.934 6.664 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.763 -5.162 7.821 1.00 0.00 H new ATOM 0 HD21 ASN A 62 5.887 -3.368 8.682 1.00 0.00 H new ATOM 0 HD22 ASN A 62 6.662 -4.904 8.284 1.00 0.00 H new ATOM 1021 N ASP A 63 11.366 -5.982 8.302 1.00 0.00 N ATOM 1022 CA ASP A 63 11.904 -7.253 8.767 1.00 0.00 C ATOM 1023 C ASP A 63 12.992 -7.767 7.828 1.00 0.00 C ATOM 1024 O ASP A 63 13.024 -8.949 7.484 1.00 0.00 O ATOM 1025 CB ASP A 63 10.780 -8.286 8.890 1.00 0.00 C ATOM 1026 CG ASP A 63 10.714 -8.908 10.271 1.00 0.00 C ATOM 1027 OD1 ASP A 63 11.603 -9.721 10.599 1.00 0.00 O ATOM 1028 OD2 ASP A 63 9.774 -8.579 11.026 1.00 0.00 O ATOM 0 H ASP A 63 11.446 -5.830 7.297 1.00 0.00 H new ATOM 0 HA ASP A 63 12.352 -7.094 9.748 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.826 -7.810 8.663 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.929 -9.071 8.148 1.00 0.00 H new ATOM 1033 N GLY A 64 13.888 -6.873 7.423 1.00 0.00 N ATOM 1034 CA GLY A 64 14.969 -7.261 6.538 1.00 0.00 C ATOM 1035 C GLY A 64 16.327 -7.132 7.196 1.00 0.00 C ATOM 1036 O GLY A 64 17.358 -7.281 6.539 1.00 0.00 O ATOM 0 H GLY A 64 13.884 -5.889 7.691 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.820 -8.292 6.217 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.942 -6.641 5.642 1.00 0.00 H new ATOM 1040 N ASP A 65 16.332 -6.848 8.496 1.00 0.00 N ATOM 1041 CA ASP A 65 17.578 -6.691 9.236 1.00 0.00 C ATOM 1042 C ASP A 65 18.414 -5.564 8.640 1.00 0.00 C ATOM 1043 O ASP A 65 19.637 -5.540 8.782 1.00 0.00 O ATOM 1044 CB ASP A 65 18.374 -7.997 9.218 1.00 0.00 C ATOM 1045 CG ASP A 65 17.631 -9.138 9.886 1.00 0.00 C ATOM 1046 OD1 ASP A 65 16.513 -9.462 9.434 1.00 0.00 O ATOM 1047 OD2 ASP A 65 18.168 -9.706 10.859 1.00 0.00 O ATOM 0 H ASP A 65 15.489 -6.722 9.056 1.00 0.00 H new ATOM 0 HA ASP A 65 17.335 -6.439 10.268 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.598 -8.268 8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 65 19.328 -7.844 9.722 1.00 0.00 H new ATOM 1052 N GLY A 66 17.741 -4.634 7.969 1.00 0.00 N ATOM 1053 CA GLY A 66 18.428 -3.518 7.354 1.00 0.00 C ATOM 1054 C GLY A 66 18.068 -3.355 5.890 1.00 0.00 C ATOM 1055 O GLY A 66 18.247 -2.279 5.318 1.00 0.00 O ATOM 0 H GLY A 66 16.729 -4.636 7.841 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.181 -2.602 7.891 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.505 -3.661 7.447 1.00 0.00 H new ATOM 1059 N GLU A 67 17.555 -4.422 5.282 1.00 0.00 N ATOM 1060 CA GLU A 67 17.165 -4.389 3.885 1.00 0.00 C ATOM 1061 C GLU A 67 15.705 -3.983 3.750 1.00 0.00 C ATOM 1062 O GLU A 67 15.022 -3.731 4.743 1.00 0.00 O ATOM 1063 CB GLU A 67 17.390 -5.761 3.243 1.00 0.00 C ATOM 1064 CG GLU A 67 18.499 -5.771 2.205 1.00 0.00 C ATOM 1065 CD GLU A 67 19.704 -6.583 2.643 1.00 0.00 C ATOM 1066 OE1 GLU A 67 20.075 -6.498 3.831 1.00 0.00 O ATOM 1067 OE2 GLU A 67 20.272 -7.303 1.796 1.00 0.00 O ATOM 0 H GLU A 67 17.402 -5.320 5.741 1.00 0.00 H new ATOM 0 HA GLU A 67 17.781 -3.651 3.370 1.00 0.00 H new ATOM 0 HB2 GLU A 67 17.628 -6.484 4.024 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.462 -6.091 2.775 1.00 0.00 H new ATOM 0 HG2 GLU A 67 18.113 -6.177 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 67 18.811 -4.746 2.002 1.00 0.00 H new ATOM 1074 N CYS A 68 15.235 -3.922 2.515 1.00 0.00 N ATOM 1075 CA CYS A 68 13.860 -3.549 2.235 1.00 0.00 C ATOM 1076 C CYS A 68 13.145 -4.663 1.483 1.00 0.00 C ATOM 1077 O CYS A 68 13.359 -4.846 0.290 1.00 0.00 O ATOM 1078 CB CYS A 68 13.824 -2.263 1.409 1.00 0.00 C ATOM 1079 SG CYS A 68 13.758 -0.751 2.399 1.00 0.00 S ATOM 0 H CYS A 68 15.791 -4.128 1.685 1.00 0.00 H new ATOM 0 HA CYS A 68 13.349 -3.383 3.183 1.00 0.00 H new ATOM 0 HB2 CYS A 68 14.707 -2.229 0.771 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.956 -2.291 0.750 1.00 0.00 H new ATOM 0 HG CYS A 68 14.650 -0.811 3.343 1.00 0.00 H new ATOM 1085 N ASP A 69 12.289 -5.400 2.180 1.00 0.00 N ATOM 1086 CA ASP A 69 11.541 -6.481 1.557 1.00 0.00 C ATOM 1087 C ASP A 69 10.177 -5.973 1.116 1.00 0.00 C ATOM 1088 O ASP A 69 9.870 -4.793 1.272 1.00 0.00 O ATOM 1089 CB ASP A 69 11.374 -7.666 2.515 1.00 0.00 C ATOM 1090 CG ASP A 69 11.344 -7.256 3.977 1.00 0.00 C ATOM 1091 OD1 ASP A 69 10.928 -6.113 4.264 1.00 0.00 O ATOM 1092 OD2 ASP A 69 11.735 -8.078 4.831 1.00 0.00 O ATOM 0 H ASP A 69 12.097 -5.269 3.173 1.00 0.00 H new ATOM 0 HA ASP A 69 12.101 -6.827 0.688 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.451 -8.192 2.273 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.192 -8.369 2.359 1.00 0.00 H new ATOM 1097 N PHE A 70 9.350 -6.859 0.584 1.00 0.00 N ATOM 1098 CA PHE A 70 8.012 -6.474 0.150 1.00 0.00 C ATOM 1099 C PHE A 70 7.216 -5.901 1.318 1.00 0.00 C ATOM 1100 O PHE A 70 6.216 -5.205 1.130 1.00 0.00 O ATOM 1101 CB PHE A 70 7.276 -7.675 -0.441 1.00 0.00 C ATOM 1102 CG PHE A 70 6.079 -7.294 -1.257 1.00 0.00 C ATOM 1103 CD1 PHE A 70 6.233 -6.769 -2.528 1.00 0.00 C ATOM 1104 CD2 PHE A 70 4.801 -7.458 -0.753 1.00 0.00 C ATOM 1105 CE1 PHE A 70 5.131 -6.414 -3.283 1.00 0.00 C ATOM 1106 CE2 PHE A 70 3.697 -7.104 -1.503 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.862 -6.581 -2.769 1.00 0.00 C ATOM 0 H PHE A 70 9.577 -7.843 0.442 1.00 0.00 H new ATOM 0 HA PHE A 70 8.110 -5.708 -0.619 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.966 -8.244 -1.064 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.961 -8.333 0.368 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.225 -6.635 -2.934 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.665 -7.867 0.237 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.263 -6.006 -4.274 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.704 -7.237 -1.099 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.999 -6.303 -3.356 1.00 0.00 H new ATOM 1117 N GLN A 71 7.674 -6.202 2.526 1.00 0.00 N ATOM 1118 CA GLN A 71 7.018 -5.720 3.737 1.00 0.00 C ATOM 1119 C GLN A 71 7.083 -4.200 3.817 1.00 0.00 C ATOM 1120 O GLN A 71 6.105 -3.542 4.180 1.00 0.00 O ATOM 1121 CB GLN A 71 7.669 -6.336 4.979 1.00 0.00 C ATOM 1122 CG GLN A 71 8.063 -7.793 4.806 1.00 0.00 C ATOM 1123 CD GLN A 71 8.297 -8.496 6.128 1.00 0.00 C ATOM 1124 OE1 GLN A 71 8.162 -7.897 7.195 1.00 0.00 O ATOM 1125 NE2 GLN A 71 8.648 -9.775 6.064 1.00 0.00 N ATOM 0 H GLN A 71 8.498 -6.778 2.695 1.00 0.00 H new ATOM 0 HA GLN A 71 5.972 -6.023 3.699 1.00 0.00 H new ATOM 0 HB2 GLN A 71 8.556 -5.758 5.237 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.979 -6.253 5.818 1.00 0.00 H new ATOM 0 HG2 GLN A 71 7.280 -8.314 4.256 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.969 -7.851 4.203 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.748 -10.232 5.157 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.817 -10.301 6.921 1.00 0.00 H new ATOM 1134 N GLU A 72 8.238 -3.643 3.465 1.00 0.00 N ATOM 1135 CA GLU A 72 8.418 -2.196 3.493 1.00 0.00 C ATOM 1136 C GLU A 72 7.766 -1.555 2.272 1.00 0.00 C ATOM 1137 O GLU A 72 7.436 -0.372 2.283 1.00 0.00 O ATOM 1138 CB GLU A 72 9.904 -1.834 3.563 1.00 0.00 C ATOM 1139 CG GLU A 72 10.647 -2.024 2.253 1.00 0.00 C ATOM 1140 CD GLU A 72 10.748 -0.742 1.446 1.00 0.00 C ATOM 1141 OE1 GLU A 72 10.198 0.286 1.892 1.00 0.00 O ATOM 1142 OE2 GLU A 72 11.377 -0.769 0.367 1.00 0.00 O ATOM 0 H GLU A 72 9.058 -4.168 3.159 1.00 0.00 H new ATOM 0 HA GLU A 72 7.932 -1.808 4.388 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.000 -0.794 3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.380 -2.443 4.331 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.650 -2.398 2.460 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.139 -2.784 1.659 1.00 0.00 H new ATOM 1149 N PHE A 73 7.558 -2.356 1.228 1.00 0.00 N ATOM 1150 CA PHE A 73 6.916 -1.878 0.011 1.00 0.00 C ATOM 1151 C PHE A 73 5.564 -1.279 0.358 1.00 0.00 C ATOM 1152 O PHE A 73 5.255 -0.145 -0.007 1.00 0.00 O ATOM 1153 CB PHE A 73 6.727 -3.044 -0.965 1.00 0.00 C ATOM 1154 CG PHE A 73 7.563 -2.981 -2.214 1.00 0.00 C ATOM 1155 CD1 PHE A 73 8.707 -2.199 -2.290 1.00 0.00 C ATOM 1156 CD2 PHE A 73 7.197 -3.730 -3.316 1.00 0.00 C ATOM 1157 CE1 PHE A 73 9.464 -2.169 -3.448 1.00 0.00 C ATOM 1158 CE2 PHE A 73 7.944 -3.706 -4.472 1.00 0.00 C ATOM 1159 CZ PHE A 73 9.082 -2.925 -4.541 1.00 0.00 C ATOM 0 H PHE A 73 7.826 -3.340 1.204 1.00 0.00 H new ATOM 0 HA PHE A 73 7.542 -1.118 -0.456 1.00 0.00 H new ATOM 0 HB2 PHE A 73 6.954 -3.973 -0.443 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.677 -3.088 -1.253 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.009 -1.609 -1.438 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.310 -4.344 -3.270 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.352 -1.556 -3.498 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.641 -4.297 -5.324 1.00 0.00 H new ATOM 0 HZ PHE A 73 9.671 -2.905 -5.446 1.00 0.00 H new ATOM 1169 N MET A 74 4.770 -2.055 1.085 1.00 0.00 N ATOM 1170 CA MET A 74 3.454 -1.613 1.509 1.00 0.00 C ATOM 1171 C MET A 74 3.579 -0.412 2.436 1.00 0.00 C ATOM 1172 O MET A 74 2.973 0.631 2.199 1.00 0.00 O ATOM 1173 CB MET A 74 2.720 -2.749 2.217 1.00 0.00 C ATOM 1174 CG MET A 74 2.518 -3.974 1.341 1.00 0.00 C ATOM 1175 SD MET A 74 1.248 -3.726 0.085 1.00 0.00 S ATOM 1176 CE MET A 74 2.182 -2.868 -1.179 1.00 0.00 C ATOM 0 H MET A 74 5.018 -2.995 1.392 1.00 0.00 H new ATOM 0 HA MET A 74 2.881 -1.320 0.629 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.281 -3.036 3.106 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.748 -2.389 2.555 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.460 -4.228 0.855 1.00 0.00 H new ATOM 0 HG3 MET A 74 2.244 -4.823 1.967 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.815 -1.846 -1.271 1.00 0.00 H new ATOM 0 HE2 MET A 74 3.237 -2.852 -0.904 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.063 -3.384 -2.132 1.00 0.00 H new ATOM 1186 N ALA A 75 4.382 -0.561 3.487 1.00 0.00 N ATOM 1187 CA ALA A 75 4.595 0.522 4.441 1.00 0.00 C ATOM 1188 C ALA A 75 5.100 1.773 3.731 1.00 0.00 C ATOM 1189 O ALA A 75 4.784 2.895 4.123 1.00 0.00 O ATOM 1190 CB ALA A 75 5.575 0.091 5.521 1.00 0.00 C ATOM 0 H ALA A 75 4.894 -1.418 3.698 1.00 0.00 H new ATOM 0 HA ALA A 75 3.641 0.758 4.912 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.724 0.910 6.225 1.00 0.00 H new ATOM 0 HB2 ALA A 75 5.176 -0.775 6.050 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.529 -0.171 5.063 1.00 0.00 H new ATOM 1196 N PHE A 76 5.882 1.566 2.678 1.00 0.00 N ATOM 1197 CA PHE A 76 6.432 2.669 1.898 1.00 0.00 C ATOM 1198 C PHE A 76 5.320 3.427 1.193 1.00 0.00 C ATOM 1199 O PHE A 76 4.943 4.525 1.601 1.00 0.00 O ATOM 1200 CB PHE A 76 7.422 2.132 0.864 1.00 0.00 C ATOM 1201 CG PHE A 76 7.849 3.147 -0.157 1.00 0.00 C ATOM 1202 CD1 PHE A 76 8.880 4.030 0.112 1.00 0.00 C ATOM 1203 CD2 PHE A 76 7.213 3.216 -1.383 1.00 0.00 C ATOM 1204 CE1 PHE A 76 9.271 4.966 -0.828 1.00 0.00 C ATOM 1205 CE2 PHE A 76 7.597 4.150 -2.328 1.00 0.00 C ATOM 1206 CZ PHE A 76 8.628 5.026 -2.049 1.00 0.00 C ATOM 0 H PHE A 76 6.151 0.641 2.343 1.00 0.00 H new ATOM 0 HA PHE A 76 6.948 3.350 2.575 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.306 1.759 1.382 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.971 1.283 0.351 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.385 3.988 1.066 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.407 2.532 -1.605 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.078 5.649 -0.608 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.092 4.194 -3.282 1.00 0.00 H new ATOM 0 HZ PHE A 76 8.931 5.757 -2.784 1.00 0.00 H new ATOM 1216 N VAL A 77 4.795 2.827 0.130 1.00 0.00 N ATOM 1217 CA VAL A 77 3.721 3.443 -0.631 1.00 0.00 C ATOM 1218 C VAL A 77 2.572 3.853 0.279 1.00 0.00 C ATOM 1219 O VAL A 77 1.815 4.760 -0.042 1.00 0.00 O ATOM 1220 CB VAL A 77 3.175 2.493 -1.714 1.00 0.00 C ATOM 1221 CG1 VAL A 77 4.028 2.565 -2.970 1.00 0.00 C ATOM 1222 CG2 VAL A 77 3.094 1.064 -1.194 1.00 0.00 C ATOM 0 H VAL A 77 5.096 1.918 -0.221 1.00 0.00 H new ATOM 0 HA VAL A 77 4.145 4.326 -1.110 1.00 0.00 H new ATOM 0 HB VAL A 77 2.165 2.814 -1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.626 1.887 -3.722 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.019 3.584 -3.358 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.052 2.276 -2.732 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.706 0.413 -1.977 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.088 0.726 -0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.430 1.028 -0.330 1.00 0.00 H new ATOM 1232 N ALA A 78 2.443 3.169 1.409 1.00 0.00 N ATOM 1233 CA ALA A 78 1.365 3.453 2.358 1.00 0.00 C ATOM 1234 C ALA A 78 1.686 4.623 3.285 1.00 0.00 C ATOM 1235 O ALA A 78 0.848 5.500 3.495 1.00 0.00 O ATOM 1236 CB ALA A 78 1.051 2.212 3.180 1.00 0.00 C ATOM 0 H ALA A 78 3.068 2.415 1.693 1.00 0.00 H new ATOM 0 HA ALA A 78 0.493 3.740 1.770 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.248 2.435 3.883 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.740 1.405 2.516 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.940 1.906 3.731 1.00 0.00 H new ATOM 1242 N MET A 79 2.890 4.635 3.848 1.00 0.00 N ATOM 1243 CA MET A 79 3.286 5.704 4.760 1.00 0.00 C ATOM 1244 C MET A 79 3.486 7.006 4.002 1.00 0.00 C ATOM 1245 O MET A 79 2.894 8.034 4.333 1.00 0.00 O ATOM 1246 CB MET A 79 4.572 5.330 5.502 1.00 0.00 C ATOM 1247 CG MET A 79 4.365 4.297 6.598 1.00 0.00 C ATOM 1248 SD MET A 79 5.868 3.977 7.543 1.00 0.00 S ATOM 1249 CE MET A 79 7.087 3.903 6.233 1.00 0.00 C ATOM 0 H MET A 79 3.604 3.923 3.691 1.00 0.00 H new ATOM 0 HA MET A 79 2.487 5.841 5.489 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.297 4.945 4.784 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.004 6.230 5.940 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.582 4.641 7.274 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.015 3.366 6.153 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.016 3.488 6.623 1.00 0.00 H new ATOM 0 HE2 MET A 79 6.717 3.270 5.427 1.00 0.00 H new ATOM 0 HE3 MET A 79 7.271 4.907 5.850 1.00 0.00 H new ATOM 1259 N VAL A 80 4.321 6.947 2.978 1.00 0.00 N ATOM 1260 CA VAL A 80 4.609 8.106 2.151 1.00 0.00 C ATOM 1261 C VAL A 80 3.325 8.695 1.568 1.00 0.00 C ATOM 1262 O VAL A 80 3.147 9.915 1.527 1.00 0.00 O ATOM 1263 CB VAL A 80 5.570 7.720 1.010 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.837 8.905 0.090 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.874 7.170 1.576 1.00 0.00 C ATOM 0 H VAL A 80 4.815 6.100 2.698 1.00 0.00 H new ATOM 0 HA VAL A 80 5.081 8.861 2.780 1.00 0.00 H new ATOM 0 HB VAL A 80 5.094 6.940 0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.518 8.602 -0.705 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.898 9.245 -0.347 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.286 9.716 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.542 6.902 0.757 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.349 7.928 2.198 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.665 6.286 2.178 1.00 0.00 H new ATOM 1275 N THR A 81 2.435 7.817 1.117 1.00 0.00 N ATOM 1276 CA THR A 81 1.167 8.234 0.533 1.00 0.00 C ATOM 1277 C THR A 81 0.266 8.908 1.567 1.00 0.00 C ATOM 1278 O THR A 81 -0.117 10.068 1.407 1.00 0.00 O ATOM 1279 CB THR A 81 0.461 7.011 -0.070 1.00 0.00 C ATOM 1280 OG1 THR A 81 1.055 6.657 -1.306 1.00 0.00 O ATOM 1281 CG2 THR A 81 -1.023 7.188 -0.320 1.00 0.00 C ATOM 0 H THR A 81 2.571 6.806 1.146 1.00 0.00 H new ATOM 0 HA THR A 81 1.371 8.966 -0.248 1.00 0.00 H new ATOM 0 HB THR A 81 0.578 6.234 0.685 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.198 5.688 -1.334 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.432 6.272 -0.746 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.527 7.407 0.621 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.179 8.013 -1.015 1.00 0.00 H new ATOM 1289 N THR A 82 -0.085 8.158 2.608 1.00 0.00 N ATOM 1290 CA THR A 82 -0.969 8.650 3.664 1.00 0.00 C ATOM 1291 C THR A 82 -0.635 10.074 4.091 1.00 0.00 C ATOM 1292 O THR A 82 -1.516 10.815 4.527 1.00 0.00 O ATOM 1293 CB THR A 82 -0.911 7.719 4.876 1.00 0.00 C ATOM 1294 OG1 THR A 82 0.425 7.337 5.151 1.00 0.00 O ATOM 1295 CG2 THR A 82 -1.723 6.454 4.699 1.00 0.00 C ATOM 0 H THR A 82 0.232 7.198 2.744 1.00 0.00 H new ATOM 0 HA THR A 82 -1.979 8.662 3.253 1.00 0.00 H new ATOM 0 HB THR A 82 -1.336 8.292 5.700 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.578 6.426 4.825 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.638 5.839 5.595 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.769 6.713 4.534 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.347 5.898 3.840 1.00 0.00 H new ATOM 1303 N ALA A 83 0.627 10.458 3.975 1.00 0.00 N ATOM 1304 CA ALA A 83 1.032 11.801 4.362 1.00 0.00 C ATOM 1305 C ALA A 83 0.641 12.826 3.305 1.00 0.00 C ATOM 1306 O ALA A 83 -0.269 13.628 3.511 1.00 0.00 O ATOM 1307 CB ALA A 83 2.528 11.860 4.621 1.00 0.00 C ATOM 0 H ALA A 83 1.380 9.868 3.621 1.00 0.00 H new ATOM 0 HA ALA A 83 0.507 12.048 5.285 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.808 12.873 4.909 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.786 11.170 5.425 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.065 11.579 3.715 1.00 0.00 H new ATOM 1313 N CYS A 84 1.344 12.806 2.177 1.00 0.00 N ATOM 1314 CA CYS A 84 1.071 13.754 1.098 1.00 0.00 C ATOM 1315 C CYS A 84 0.029 13.240 0.115 1.00 0.00 C ATOM 1316 O CYS A 84 -0.986 13.896 -0.118 1.00 0.00 O ATOM 1317 CB CYS A 84 2.360 14.130 0.359 1.00 0.00 C ATOM 1318 SG CYS A 84 3.425 12.730 -0.062 1.00 0.00 S ATOM 0 H CYS A 84 2.101 12.150 1.985 1.00 0.00 H new ATOM 0 HA CYS A 84 0.658 14.646 1.568 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.097 14.657 -0.558 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.926 14.827 0.976 1.00 0.00 H new ATOM 0 HG CYS A 84 3.000 11.663 0.547 1.00 0.00 H new ATOM 1324 N HIS A 85 0.273 12.067 -0.463 1.00 0.00 N ATOM 1325 CA HIS A 85 -0.656 11.481 -1.426 1.00 0.00 C ATOM 1326 C HIS A 85 -2.099 11.622 -0.948 1.00 0.00 C ATOM 1327 O HIS A 85 -3.033 11.660 -1.748 1.00 0.00 O ATOM 1328 CB HIS A 85 -0.315 10.012 -1.645 1.00 0.00 C ATOM 1329 CG HIS A 85 -1.136 9.342 -2.701 1.00 0.00 C ATOM 1330 ND1 HIS A 85 -2.470 9.138 -2.790 1.00 0.00 N flip ATOM 1331 CD2 HIS A 85 -0.586 8.762 -3.824 1.00 0.00 C flip ATOM 1332 CE1 HIS A 85 -2.701 8.442 -3.950 1.00 0.00 C flip ATOM 1333 NE2 HIS A 85 -1.546 8.229 -4.555 1.00 0.00 N flip ATOM 0 H HIS A 85 1.104 11.504 -0.282 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.559 12.017 -2.370 1.00 0.00 H new ATOM 0 HB2 HIS A 85 0.738 9.931 -1.914 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.446 9.476 -0.705 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -3.174 9.445 -2.119 1.00 0.00 H new ATOM 0 HD2 HIS A 85 0.466 8.746 -4.067 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -3.668 8.121 -4.309 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.263 11.706 0.366 1.00 0.00 N ATOM 1343 CA GLU A 86 -3.574 11.853 0.976 1.00 0.00 C ATOM 1344 C GLU A 86 -4.372 12.975 0.324 1.00 0.00 C ATOM 1345 O GLU A 86 -5.418 12.737 -0.282 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.402 12.129 2.473 1.00 0.00 C ATOM 1347 CG GLU A 86 -4.690 12.526 3.182 1.00 0.00 C ATOM 1348 CD GLU A 86 -4.465 12.899 4.634 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -3.640 13.800 4.896 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -5.113 12.290 5.511 1.00 0.00 O ATOM 0 H GLU A 86 -1.493 11.674 1.035 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.131 10.927 0.829 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.996 11.238 2.952 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.668 12.924 2.603 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.143 13.369 2.660 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.399 11.700 3.129 1.00 0.00 H new ATOM 1357 N PHE A 87 -3.877 14.198 0.454 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.549 15.353 -0.122 1.00 0.00 C ATOM 1359 C PHE A 87 -3.716 15.959 -1.245 1.00 0.00 C ATOM 1360 O PHE A 87 -4.254 16.583 -2.160 1.00 0.00 O ATOM 1361 CB PHE A 87 -4.832 16.399 0.959 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.297 16.624 1.210 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.189 15.560 1.234 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -6.783 17.905 1.423 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -8.535 15.774 1.465 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -8.128 18.122 1.655 1.00 0.00 C ATOM 1367 CZ PHE A 87 -9.005 17.055 1.676 1.00 0.00 C ATOM 0 H PHE A 87 -3.014 14.415 0.952 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.498 15.022 -0.543 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.356 16.086 1.889 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.373 17.344 0.668 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.828 14.555 1.071 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.102 18.743 1.407 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.219 14.939 1.480 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.493 19.125 1.820 1.00 0.00 H new ATOM 0 HZ PHE A 87 -10.056 17.222 1.857 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.401 15.765 -1.180 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.513 16.290 -2.206 1.00 0.00 C ATOM 1379 C PHE A 88 -1.750 15.578 -3.536 1.00 0.00 C ATOM 1380 O PHE A 88 -1.417 16.109 -4.595 1.00 0.00 O ATOM 1381 CB PHE A 88 -0.042 16.157 -1.785 1.00 0.00 C ATOM 1382 CG PHE A 88 0.588 17.465 -1.404 1.00 0.00 C ATOM 1383 CD1 PHE A 88 0.109 18.191 -0.325 1.00 0.00 C ATOM 1384 CD2 PHE A 88 1.660 17.970 -2.124 1.00 0.00 C ATOM 1385 CE1 PHE A 88 0.686 19.396 0.029 1.00 0.00 C ATOM 1386 CE2 PHE A 88 2.241 19.174 -1.774 1.00 0.00 C ATOM 1387 CZ PHE A 88 1.754 19.887 -0.696 1.00 0.00 C ATOM 0 H PHE A 88 -1.933 15.252 -0.433 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.736 17.350 -2.332 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.026 15.470 -0.942 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.524 15.714 -2.604 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.725 17.811 0.246 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.045 17.416 -2.968 1.00 0.00 H new ATOM 0 HE1 PHE A 88 0.302 19.953 0.871 1.00 0.00 H new ATOM 0 HE2 PHE A 88 3.075 19.557 -2.343 1.00 0.00 H new ATOM 0 HZ PHE A 88 2.208 20.827 -0.420 1.00 0.00 H new ATOM 1447 N SER B 1 7.390 1.587 -14.440 1.00 0.00 N ATOM 1448 CA SER B 1 6.305 2.599 -14.539 1.00 0.00 C ATOM 1449 C SER B 1 5.013 2.094 -13.900 1.00 0.00 C ATOM 1450 O SER B 1 4.122 2.879 -13.579 1.00 0.00 O ATOM 1451 CB SER B 1 6.073 2.922 -16.016 1.00 0.00 C ATOM 1452 OG SER B 1 5.399 1.860 -16.671 1.00 0.00 O ATOM 0 H1 SER B 1 8.314 2.064 -14.476 1.00 0.00 H new ATOM 0 H2 SER B 1 7.302 1.070 -13.542 1.00 0.00 H new ATOM 0 H3 SER B 1 7.315 0.919 -15.233 1.00 0.00 H new ATOM 0 HA SER B 1 6.606 3.497 -13.999 1.00 0.00 H new ATOM 0 HB2 SER B 1 5.488 3.837 -16.104 1.00 0.00 H new ATOM 0 HB3 SER B 1 7.029 3.107 -16.506 1.00 0.00 H new ATOM 0 HG SER B 1 5.261 2.092 -17.613 1.00 0.00 H new ATOM 1460 N GLU B 2 4.920 0.781 -13.720 1.00 0.00 N ATOM 1461 CA GLU B 2 3.737 0.173 -13.120 1.00 0.00 C ATOM 1462 C GLU B 2 3.442 0.781 -11.757 1.00 0.00 C ATOM 1463 O GLU B 2 2.284 0.973 -11.384 1.00 0.00 O ATOM 1464 CB GLU B 2 3.925 -1.341 -12.989 1.00 0.00 C ATOM 1465 CG GLU B 2 4.995 -1.751 -11.989 1.00 0.00 C ATOM 1466 CD GLU B 2 6.399 -1.612 -12.544 1.00 0.00 C ATOM 1467 OE1 GLU B 2 6.898 -0.469 -12.617 1.00 0.00 O ATOM 1468 OE2 GLU B 2 7.000 -2.645 -12.906 1.00 0.00 O ATOM 0 H GLU B 2 5.649 0.117 -13.981 1.00 0.00 H new ATOM 0 HA GLU B 2 2.888 0.371 -13.775 1.00 0.00 H new ATOM 0 HB2 GLU B 2 2.976 -1.790 -12.694 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.181 -1.750 -13.966 1.00 0.00 H new ATOM 0 HG2 GLU B 2 4.901 -1.139 -11.092 1.00 0.00 H new ATOM 0 HG3 GLU B 2 4.828 -2.785 -11.688 1.00 0.00 H new ATOM 1475 N LEU B 3 4.500 1.080 -11.022 1.00 0.00 N ATOM 1476 CA LEU B 3 4.378 1.670 -9.692 1.00 0.00 C ATOM 1477 C LEU B 3 3.517 2.929 -9.732 1.00 0.00 C ATOM 1478 O LEU B 3 2.752 3.200 -8.806 1.00 0.00 O ATOM 1479 CB LEU B 3 5.759 2.002 -9.126 1.00 0.00 C ATOM 1480 CG LEU B 3 6.705 0.806 -8.978 1.00 0.00 C ATOM 1481 CD1 LEU B 3 7.822 0.873 -10.008 1.00 0.00 C ATOM 1482 CD2 LEU B 3 7.280 0.751 -7.570 1.00 0.00 C ATOM 0 H LEU B 3 5.462 0.924 -11.324 1.00 0.00 H new ATOM 0 HA LEU B 3 3.895 0.940 -9.043 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.231 2.741 -9.773 1.00 0.00 H new ATOM 0 HB3 LEU B 3 5.632 2.468 -8.149 1.00 0.00 H new ATOM 0 HG LEU B 3 6.133 -0.105 -9.153 1.00 0.00 H new ATOM 0 HD11 LEU B 3 8.482 0.014 -9.885 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.394 0.861 -11.010 1.00 0.00 H new ATOM 0 HD13 LEU B 3 8.392 1.792 -9.868 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.949 -0.105 -7.484 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.834 1.667 -7.367 1.00 0.00 H new ATOM 0 HD23 LEU B 3 6.468 0.651 -6.849 1.00 0.00 H new ATOM 1494 N GLU B 4 3.646 3.693 -10.812 1.00 0.00 N ATOM 1495 CA GLU B 4 2.879 4.922 -10.975 1.00 0.00 C ATOM 1496 C GLU B 4 1.417 4.610 -11.277 1.00 0.00 C ATOM 1497 O GLU B 4 0.516 5.324 -10.837 1.00 0.00 O ATOM 1498 CB GLU B 4 3.475 5.775 -12.096 1.00 0.00 C ATOM 1499 CG GLU B 4 4.702 6.565 -11.672 1.00 0.00 C ATOM 1500 CD GLU B 4 5.993 5.961 -12.188 1.00 0.00 C ATOM 1501 OE1 GLU B 4 6.029 5.556 -13.369 1.00 0.00 O ATOM 1502 OE2 GLU B 4 6.969 5.892 -11.411 1.00 0.00 O ATOM 0 H GLU B 4 4.275 3.482 -11.587 1.00 0.00 H new ATOM 0 HA GLU B 4 2.928 5.481 -10.040 1.00 0.00 H new ATOM 0 HB2 GLU B 4 3.741 5.128 -12.932 1.00 0.00 H new ATOM 0 HB3 GLU B 4 2.715 6.467 -12.458 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.614 7.589 -12.036 1.00 0.00 H new ATOM 0 HG3 GLU B 4 4.739 6.615 -10.584 1.00 0.00 H new ATOM 1509 N LYS B 5 1.190 3.537 -12.028 1.00 0.00 N ATOM 1510 CA LYS B 5 -0.162 3.126 -12.387 1.00 0.00 C ATOM 1511 C LYS B 5 -0.845 2.430 -11.215 1.00 0.00 C ATOM 1512 O LYS B 5 -2.042 2.604 -10.988 1.00 0.00 O ATOM 1513 CB LYS B 5 -0.129 2.193 -13.600 1.00 0.00 C ATOM 1514 CG LYS B 5 0.374 2.863 -14.869 1.00 0.00 C ATOM 1515 CD LYS B 5 1.564 2.123 -15.461 1.00 0.00 C ATOM 1516 CE LYS B 5 1.199 0.698 -15.846 1.00 0.00 C ATOM 1517 NZ LYS B 5 2.354 -0.030 -16.439 1.00 0.00 N ATOM 0 H LYS B 5 1.926 2.936 -12.400 1.00 0.00 H new ATOM 0 HA LYS B 5 -0.733 4.019 -12.640 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.508 1.338 -13.373 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -1.132 1.805 -13.777 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.431 2.904 -15.603 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.658 3.892 -14.649 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.925 2.657 -16.340 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.380 2.108 -14.739 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.846 0.163 -14.964 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.375 0.714 -16.560 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.180 -1.054 -16.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 2.471 0.255 -17.432 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 3.219 0.200 -15.908 1.00 0.00 H new ATOM 1531 N ALA B 6 -0.075 1.642 -10.473 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.603 0.920 -9.321 1.00 0.00 C ATOM 1533 C ALA B 6 -1.063 1.884 -8.236 1.00 0.00 C ATOM 1534 O ALA B 6 -2.048 1.629 -7.543 1.00 0.00 O ATOM 1535 CB ALA B 6 0.450 -0.034 -8.774 1.00 0.00 C ATOM 0 H ALA B 6 0.918 1.487 -10.649 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.468 0.342 -9.646 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.046 -0.568 -7.914 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.729 -0.750 -9.547 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.330 0.532 -8.469 1.00 0.00 H new ATOM 1541 N MET B 7 -0.348 2.993 -8.097 1.00 0.00 N ATOM 1542 CA MET B 7 -0.690 3.996 -7.099 1.00 0.00 C ATOM 1543 C MET B 7 -2.017 4.664 -7.442 1.00 0.00 C ATOM 1544 O MET B 7 -2.909 4.756 -6.600 1.00 0.00 O ATOM 1545 CB MET B 7 0.420 5.044 -6.996 1.00 0.00 C ATOM 1546 CG MET B 7 1.260 4.917 -5.735 1.00 0.00 C ATOM 1547 SD MET B 7 2.768 5.904 -5.803 1.00 0.00 S ATOM 1548 CE MET B 7 2.620 6.852 -4.291 1.00 0.00 C ATOM 0 H MET B 7 0.471 3.220 -8.662 1.00 0.00 H new ATOM 0 HA MET B 7 -0.793 3.499 -6.134 1.00 0.00 H new ATOM 0 HB2 MET B 7 1.071 4.959 -7.866 1.00 0.00 H new ATOM 0 HB3 MET B 7 -0.026 6.038 -7.027 1.00 0.00 H new ATOM 0 HG2 MET B 7 0.666 5.226 -4.875 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.522 3.870 -5.581 1.00 0.00 H new ATOM 0 HE1 MET B 7 2.982 7.866 -4.461 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.575 6.886 -3.984 1.00 0.00 H new ATOM 0 HE3 MET B 7 3.213 6.382 -3.507 1.00 0.00 H new ATOM 1558 N VAL B 8 -2.136 5.132 -8.683 1.00 0.00 N ATOM 1559 CA VAL B 8 -3.351 5.798 -9.144 1.00 0.00 C ATOM 1560 C VAL B 8 -4.467 4.802 -9.423 1.00 0.00 C ATOM 1561 O VAL B 8 -5.646 5.139 -9.311 1.00 0.00 O ATOM 1562 CB VAL B 8 -3.090 6.628 -10.417 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -4.314 7.460 -10.774 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -1.867 7.517 -10.238 1.00 0.00 C ATOM 0 H VAL B 8 -1.403 5.062 -9.389 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.662 6.463 -8.338 1.00 0.00 H new ATOM 0 HB VAL B 8 -2.893 5.941 -11.240 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -4.110 8.039 -11.675 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -5.163 6.800 -10.951 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -4.546 8.138 -9.952 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.700 8.094 -11.148 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -2.031 8.197 -9.402 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.993 6.897 -10.036 1.00 0.00 H new ATOM 1574 N ALA B 9 -4.104 3.571 -9.768 1.00 0.00 N ATOM 1575 CA ALA B 9 -5.101 2.546 -10.034 1.00 0.00 C ATOM 1576 C ALA B 9 -5.995 2.389 -8.816 1.00 0.00 C ATOM 1577 O ALA B 9 -7.223 2.301 -8.921 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.432 1.226 -10.385 1.00 0.00 C ATOM 0 H ALA B 9 -3.137 3.263 -9.869 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.709 2.848 -10.887 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -5.195 0.472 -10.580 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.814 1.356 -11.274 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.807 0.902 -9.553 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.361 2.397 -7.651 1.00 0.00 N ATOM 1585 CA LEU B 10 -6.085 2.288 -6.398 1.00 0.00 C ATOM 1586 C LEU B 10 -6.982 3.501 -6.230 1.00 0.00 C ATOM 1587 O LEU B 10 -8.188 3.377 -6.020 1.00 0.00 O ATOM 1588 CB LEU B 10 -5.112 2.192 -5.221 1.00 0.00 C ATOM 1589 CG LEU B 10 -4.249 0.929 -5.197 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.836 1.257 -4.740 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.875 -0.125 -4.293 1.00 0.00 C ATOM 0 H LEU B 10 -4.349 2.478 -7.551 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.692 1.383 -6.416 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -4.456 3.062 -5.240 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.682 2.242 -4.293 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.196 0.527 -6.209 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.237 0.347 -4.729 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.390 1.977 -5.426 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.868 1.683 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.249 -1.017 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.957 0.267 -3.279 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.867 -0.381 -4.665 1.00 0.00 H new ATOM 1603 N ILE B 11 -6.379 4.679 -6.344 1.00 0.00 N ATOM 1604 CA ILE B 11 -7.112 5.931 -6.220 1.00 0.00 C ATOM 1605 C ILE B 11 -8.328 5.942 -7.132 1.00 0.00 C ATOM 1606 O ILE B 11 -9.446 6.181 -6.680 1.00 0.00 O ATOM 1607 CB ILE B 11 -6.249 7.166 -6.552 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -4.770 6.928 -6.262 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -6.740 8.350 -5.757 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -3.890 8.104 -6.630 1.00 0.00 C ATOM 0 H ILE B 11 -5.381 4.792 -6.523 1.00 0.00 H new ATOM 0 HA ILE B 11 -7.417 5.991 -5.175 1.00 0.00 H new ATOM 0 HB ILE B 11 -6.346 7.362 -7.620 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.646 6.708 -5.202 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.436 6.048 -6.811 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -6.131 9.223 -5.991 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -7.780 8.554 -6.013 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.665 8.130 -4.692 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.851 7.868 -6.398 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.986 8.311 -7.696 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -4.198 8.981 -6.061 1.00 0.00 H new ATOM 1622 N ASP B 12 -8.102 5.679 -8.417 1.00 0.00 N ATOM 1623 CA ASP B 12 -9.184 5.652 -9.398 1.00 0.00 C ATOM 1624 C ASP B 12 -10.401 4.938 -8.824 1.00 0.00 C ATOM 1625 O ASP B 12 -11.541 5.334 -9.064 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.721 4.956 -10.679 1.00 0.00 C ATOM 1627 CG ASP B 12 -8.231 5.938 -11.726 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -9.074 6.490 -12.463 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -7.003 6.154 -11.808 1.00 0.00 O ATOM 0 H ASP B 12 -7.179 5.481 -8.803 1.00 0.00 H new ATOM 0 HA ASP B 12 -9.461 6.679 -9.637 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.921 4.255 -10.440 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -9.544 4.372 -11.090 1.00 0.00 H new ATOM 1634 N VAL B 13 -10.142 3.885 -8.056 1.00 0.00 N ATOM 1635 CA VAL B 13 -11.210 3.114 -7.434 1.00 0.00 C ATOM 1636 C VAL B 13 -11.942 3.930 -6.363 1.00 0.00 C ATOM 1637 O VAL B 13 -13.172 3.973 -6.341 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.662 1.822 -6.799 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -11.800 0.964 -6.273 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.823 1.046 -7.805 1.00 0.00 C ATOM 0 H VAL B 13 -9.202 3.547 -7.850 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.916 2.857 -8.224 1.00 0.00 H new ATOM 0 HB VAL B 13 -10.022 2.094 -5.960 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.395 0.055 -5.828 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.357 1.520 -5.519 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.466 0.700 -7.094 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.444 0.137 -7.338 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.438 0.783 -8.666 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.985 1.662 -8.132 1.00 0.00 H new ATOM 1650 N PHE B 14 -11.183 4.573 -5.478 1.00 0.00 N ATOM 1651 CA PHE B 14 -11.765 5.382 -4.404 1.00 0.00 C ATOM 1652 C PHE B 14 -12.273 6.723 -4.938 1.00 0.00 C ATOM 1653 O PHE B 14 -13.176 7.329 -4.361 1.00 0.00 O ATOM 1654 CB PHE B 14 -10.734 5.574 -3.268 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.427 7.006 -2.902 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -9.972 7.899 -3.860 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -10.601 7.459 -1.601 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.702 9.212 -3.533 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.329 8.769 -1.271 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.882 9.649 -2.238 1.00 0.00 C ATOM 0 H PHE B 14 -10.163 4.551 -5.482 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.627 4.854 -3.995 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -11.100 5.061 -2.379 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -9.804 5.085 -3.559 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.827 7.562 -4.876 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -10.953 6.778 -0.840 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.350 9.897 -4.291 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.465 9.108 -0.255 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.674 10.677 -1.980 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.686 7.184 -6.037 1.00 0.00 N ATOM 1671 CA HIS B 15 -12.077 8.452 -6.641 1.00 0.00 C ATOM 1672 C HIS B 15 -13.328 8.292 -7.499 1.00 0.00 C ATOM 1673 O HIS B 15 -14.004 9.272 -7.812 1.00 0.00 O ATOM 1674 CB HIS B 15 -10.929 9.014 -7.482 1.00 0.00 C ATOM 1675 CG HIS B 15 -10.275 10.213 -6.872 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -8.965 10.566 -7.121 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -10.758 11.147 -6.018 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -8.670 11.664 -6.446 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -9.742 12.036 -5.770 1.00 0.00 N ATOM 0 H HIS B 15 -10.936 6.697 -6.528 1.00 0.00 H new ATOM 0 HA HIS B 15 -12.306 9.152 -5.837 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -10.180 8.235 -7.627 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -11.308 9.279 -8.469 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -11.757 11.185 -5.608 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -7.716 12.170 -6.447 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -9.805 12.852 -5.162 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.637 7.053 -7.872 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.811 6.777 -8.685 1.00 0.00 C ATOM 1690 C GLN B 16 -16.050 6.671 -7.807 1.00 0.00 C ATOM 1691 O GLN B 16 -17.116 7.176 -8.156 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.618 5.485 -9.480 1.00 0.00 C ATOM 1693 CG GLN B 16 -13.925 5.690 -10.818 1.00 0.00 C ATOM 1694 CD GLN B 16 -14.677 6.648 -11.721 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -14.351 7.932 -11.623 1.00 0.00 O flip ATOM 1696 NE2 GLN B 16 -15.538 6.239 -12.499 1.00 0.00 N flip ATOM 0 H GLN B 16 -13.091 6.228 -7.624 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.947 7.601 -9.385 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -14.035 4.784 -8.882 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.591 5.025 -9.651 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -12.918 6.071 -10.647 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -13.821 4.728 -11.321 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -15.756 5.243 -12.541 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -16.034 6.895 -13.102 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.900 6.011 -6.663 1.00 0.00 N ATOM 1706 CA TYR B 17 -17.011 5.844 -5.735 1.00 0.00 C ATOM 1707 C TYR B 17 -17.173 7.071 -4.843 1.00 0.00 C ATOM 1708 O TYR B 17 -18.140 7.822 -4.976 1.00 0.00 O ATOM 1709 CB TYR B 17 -16.812 4.594 -4.880 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.576 3.394 -5.391 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -17.534 3.042 -6.734 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -18.345 2.617 -4.533 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -18.237 1.948 -7.208 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -19.049 1.523 -4.998 1.00 0.00 C ATOM 1715 CZ TYR B 17 -18.991 1.193 -6.335 1.00 0.00 C ATOM 1716 OH TYR B 17 -19.690 0.104 -6.802 1.00 0.00 O ATOM 0 H TYR B 17 -15.025 5.585 -6.358 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.922 5.728 -6.323 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -15.750 4.352 -4.844 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -17.125 4.807 -3.858 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.943 3.631 -7.419 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -18.393 2.873 -3.485 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -18.195 1.687 -8.255 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -19.642 0.930 -4.318 1.00 0.00 H new ATOM 0 HH TYR B 17 -20.169 -0.320 -6.060 1.00 0.00 H new ATOM 1726 N SER B 18 -16.225 7.268 -3.932 1.00 0.00 N ATOM 1727 CA SER B 18 -16.271 8.403 -3.018 1.00 0.00 C ATOM 1728 C SER B 18 -16.272 9.722 -3.785 1.00 0.00 C ATOM 1729 O SER B 18 -15.396 9.975 -4.611 1.00 0.00 O ATOM 1730 CB SER B 18 -15.085 8.356 -2.051 1.00 0.00 C ATOM 1731 OG SER B 18 -14.678 9.658 -1.669 1.00 0.00 O ATOM 0 H SER B 18 -15.417 6.658 -3.807 1.00 0.00 H new ATOM 0 HA SER B 18 -17.197 8.339 -2.446 1.00 0.00 H new ATOM 0 HB2 SER B 18 -15.359 7.784 -1.165 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.251 7.836 -2.521 1.00 0.00 H new ATOM 0 HG SER B 18 -14.123 10.048 -2.376 1.00 0.00 H new ATOM 1737 N GLY B 19 -17.265 10.557 -3.501 1.00 0.00 N ATOM 1738 CA GLY B 19 -17.369 11.843 -4.166 1.00 0.00 C ATOM 1739 C GLY B 19 -18.764 12.110 -4.694 1.00 0.00 C ATOM 1740 O GLY B 19 -19.189 13.261 -4.795 1.00 0.00 O ATOM 0 H GLY B 19 -18.001 10.366 -2.821 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -17.090 12.633 -3.469 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -16.658 11.881 -4.991 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.910 12.841 0.147 1.00 0.00 N ATOM 1802 CA LYS B 24 -15.723 12.538 -0.643 1.00 0.00 C ATOM 1803 C LYS B 24 -14.531 12.236 0.262 1.00 0.00 C ATOM 1804 O LYS B 24 -14.505 12.642 1.423 1.00 0.00 O ATOM 1805 CB LYS B 24 -15.394 13.706 -1.576 1.00 0.00 C ATOM 1806 CG LYS B 24 -14.448 13.334 -2.707 1.00 0.00 C ATOM 1807 CD LYS B 24 -13.073 13.955 -2.514 1.00 0.00 C ATOM 1808 CE LYS B 24 -12.094 13.483 -3.579 1.00 0.00 C ATOM 1809 NZ LYS B 24 -12.447 14.002 -4.929 1.00 0.00 N ATOM 0 HA LYS B 24 -15.931 11.653 -1.244 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -16.320 14.093 -2.001 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.950 14.512 -0.992 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -14.354 12.249 -2.761 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -14.867 13.665 -3.657 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -13.155 15.041 -2.549 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -12.691 13.696 -1.527 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -11.088 13.809 -3.317 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -12.080 12.393 -3.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -11.719 13.714 -5.613 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -13.368 13.615 -5.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -12.502 15.040 -4.898 1.00 0.00 H new ATOM 1823 N HIS B 25 -13.553 11.511 -0.281 1.00 0.00 N ATOM 1824 CA HIS B 25 -12.344 11.128 0.456 1.00 0.00 C ATOM 1825 C HIS B 25 -12.575 9.875 1.299 1.00 0.00 C ATOM 1826 O HIS B 25 -11.682 9.046 1.444 1.00 0.00 O ATOM 1827 CB HIS B 25 -11.845 12.269 1.347 1.00 0.00 C ATOM 1828 CG HIS B 25 -10.461 12.045 1.870 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -9.779 12.977 2.625 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -9.629 10.984 1.744 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -8.589 12.498 2.940 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.473 11.290 2.418 1.00 0.00 N ATOM 0 H HIS B 25 -13.574 11.172 -1.243 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.578 10.909 -0.288 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -11.866 13.200 0.780 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -12.529 12.391 2.187 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -9.836 10.067 1.212 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -7.838 13.008 3.525 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.657 10.683 2.502 1.00 0.00 H new ATOM 1841 N LYS B 26 -13.773 9.738 1.858 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.098 8.583 2.684 1.00 0.00 C ATOM 1843 C LYS B 26 -15.116 7.698 1.979 1.00 0.00 C ATOM 1844 O LYS B 26 -15.762 8.120 1.021 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.653 9.032 4.038 1.00 0.00 C ATOM 1846 CG LYS B 26 -13.653 8.923 5.180 1.00 0.00 C ATOM 1847 CD LYS B 26 -13.095 10.284 5.571 1.00 0.00 C ATOM 1848 CE LYS B 26 -12.470 10.996 4.382 1.00 0.00 C ATOM 1849 NZ LYS B 26 -11.167 11.629 4.729 1.00 0.00 N ATOM 0 H LYS B 26 -14.532 10.411 1.754 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.184 8.012 2.849 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.987 10.066 3.958 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.530 8.431 4.278 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -14.135 8.466 6.044 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -12.835 8.265 4.886 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.893 10.900 5.986 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.348 10.160 6.355 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.322 10.284 3.571 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.157 11.759 4.015 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.014 12.462 4.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.178 11.922 5.727 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.398 10.946 4.577 1.00 0.00 H new ATOM 1863 N LEU B 27 -15.246 6.466 2.453 1.00 0.00 N ATOM 1864 CA LEU B 27 -16.179 5.519 1.857 1.00 0.00 C ATOM 1865 C LEU B 27 -16.945 4.769 2.941 1.00 0.00 C ATOM 1866 O LEU B 27 -16.390 4.422 3.979 1.00 0.00 O ATOM 1867 CB LEU B 27 -15.429 4.546 0.943 1.00 0.00 C ATOM 1868 CG LEU B 27 -14.788 5.188 -0.300 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -13.321 5.546 -0.051 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -14.914 4.263 -1.504 1.00 0.00 C ATOM 0 H LEU B 27 -14.719 6.100 3.246 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.902 6.069 1.254 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -14.648 4.054 1.523 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -16.121 3.770 0.617 1.00 0.00 H new ATOM 0 HG LEU B 27 -15.325 6.113 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -12.899 5.997 -0.949 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -13.254 6.253 0.776 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -12.763 4.643 0.198 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -14.455 4.733 -2.374 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -14.409 3.320 -1.293 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -15.968 4.073 -1.708 1.00 0.00 H new ATOM 1882 N LYS B 28 -18.227 4.531 2.704 1.00 0.00 N ATOM 1883 CA LYS B 28 -19.060 3.835 3.682 1.00 0.00 C ATOM 1884 C LYS B 28 -19.294 2.384 3.286 1.00 0.00 C ATOM 1885 O LYS B 28 -18.898 1.951 2.203 1.00 0.00 O ATOM 1886 CB LYS B 28 -20.402 4.553 3.851 1.00 0.00 C ATOM 1887 CG LYS B 28 -20.995 5.064 2.547 1.00 0.00 C ATOM 1888 CD LYS B 28 -22.512 4.959 2.546 1.00 0.00 C ATOM 1889 CE LYS B 28 -23.145 5.991 1.628 1.00 0.00 C ATOM 1890 NZ LYS B 28 -23.673 5.375 0.379 1.00 0.00 N ATOM 0 H LYS B 28 -18.713 4.806 1.850 1.00 0.00 H new ATOM 0 HA LYS B 28 -18.526 3.844 4.632 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -21.112 3.871 4.319 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -20.270 5.393 4.533 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -20.701 6.102 2.395 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -20.589 4.492 1.713 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -22.808 3.959 2.228 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -22.887 5.095 3.560 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -23.955 6.496 2.154 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -22.407 6.752 1.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -24.242 6.074 -0.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -22.879 5.064 -0.217 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -24.266 4.556 0.620 1.00 0.00 H new ATOM 1904 N LYS B 29 -19.944 1.638 4.176 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.242 0.231 3.932 1.00 0.00 C ATOM 1906 C LYS B 29 -20.861 0.040 2.552 1.00 0.00 C ATOM 1907 O LYS B 29 -20.723 -1.017 1.938 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.191 -0.305 5.006 1.00 0.00 C ATOM 1909 CG LYS B 29 -20.720 -0.029 6.427 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.831 0.566 7.278 1.00 0.00 C ATOM 1911 CE LYS B 29 -21.289 1.579 8.273 1.00 0.00 C ATOM 1912 NZ LYS B 29 -22.193 1.745 9.443 1.00 0.00 N ATOM 0 H LYS B 29 -20.275 1.987 5.075 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.306 -0.326 3.973 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.175 0.142 4.865 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.307 -1.381 4.873 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -20.369 -0.956 6.881 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -19.872 0.656 6.404 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -22.567 1.046 6.633 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -22.347 -0.231 7.813 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -20.305 1.260 8.617 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -21.157 2.541 7.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -21.788 2.444 10.098 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -23.125 2.074 9.118 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -22.299 0.833 9.932 1.00 0.00 H new ATOM 1926 N SER B 30 -21.538 1.075 2.067 1.00 0.00 N ATOM 1927 CA SER B 30 -22.171 1.024 0.759 1.00 0.00 C ATOM 1928 C SER B 30 -21.147 1.257 -0.345 1.00 0.00 C ATOM 1929 O SER B 30 -21.097 0.517 -1.322 1.00 0.00 O ATOM 1930 CB SER B 30 -23.285 2.066 0.665 1.00 0.00 C ATOM 1931 OG SER B 30 -24.018 2.140 1.876 1.00 0.00 O ATOM 0 H SER B 30 -21.661 1.958 2.562 1.00 0.00 H new ATOM 0 HA SER B 30 -22.603 0.032 0.629 1.00 0.00 H new ATOM 0 HB2 SER B 30 -22.856 3.042 0.436 1.00 0.00 H new ATOM 0 HB3 SER B 30 -23.956 1.812 -0.155 1.00 0.00 H new ATOM 0 HG SER B 30 -24.724 2.815 1.791 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.329 2.291 -0.187 1.00 0.00 N ATOM 1938 CA GLU B 31 -19.313 2.614 -1.181 1.00 0.00 C ATOM 1939 C GLU B 31 -18.294 1.486 -1.318 1.00 0.00 C ATOM 1940 O GLU B 31 -18.230 0.818 -2.348 1.00 0.00 O ATOM 1941 CB GLU B 31 -18.601 3.916 -0.809 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.509 5.133 -0.827 1.00 0.00 C ATOM 1943 CD GLU B 31 -19.780 5.638 -2.230 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -20.349 4.873 -3.038 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -19.424 6.800 -2.522 1.00 0.00 O ATOM 0 H GLU B 31 -20.349 2.918 0.617 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.814 2.740 -2.141 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.167 3.812 0.186 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.775 4.079 -1.501 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.455 4.883 -0.346 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.053 5.930 -0.240 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.492 1.288 -0.276 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.463 0.250 -0.278 1.00 0.00 C ATOM 1954 C LEU B 32 -17.022 -1.105 -0.709 1.00 0.00 C ATOM 1955 O LEU B 32 -16.677 -1.619 -1.772 1.00 0.00 O ATOM 1956 CB LEU B 32 -15.830 0.132 1.110 1.00 0.00 C ATOM 1957 CG LEU B 32 -14.628 -0.809 1.195 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -13.619 -0.300 2.213 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -15.081 -2.218 1.549 1.00 0.00 C ATOM 0 H LEU B 32 -17.534 1.834 0.584 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.704 0.544 -1.003 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -15.519 1.124 1.436 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -16.591 -0.210 1.812 1.00 0.00 H new ATOM 0 HG LEU B 32 -14.143 -0.837 0.219 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -12.771 -0.984 2.258 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -13.271 0.690 1.917 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -14.090 -0.241 3.194 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -14.214 -2.876 1.606 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -15.590 -2.205 2.513 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -15.764 -2.584 0.783 1.00 0.00 H new ATOM 1971 N LYS B 33 -17.875 -1.686 0.131 1.00 0.00 N ATOM 1972 CA LYS B 33 -18.473 -2.992 -0.151 1.00 0.00 C ATOM 1973 C LYS B 33 -18.969 -3.093 -1.593 1.00 0.00 C ATOM 1974 O LYS B 33 -18.438 -3.874 -2.383 1.00 0.00 O ATOM 1975 CB LYS B 33 -19.626 -3.263 0.814 1.00 0.00 C ATOM 1976 CG LYS B 33 -19.834 -4.742 1.109 1.00 0.00 C ATOM 1977 CD LYS B 33 -20.783 -4.973 2.279 1.00 0.00 C ATOM 1978 CE LYS B 33 -20.498 -4.042 3.452 1.00 0.00 C ATOM 1979 NZ LYS B 33 -21.041 -4.577 4.731 1.00 0.00 N ATOM 0 H LYS B 33 -18.170 -1.273 1.016 1.00 0.00 H new ATOM 0 HA LYS B 33 -17.696 -3.744 -0.013 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -19.438 -2.737 1.750 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -20.544 -2.851 0.396 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -20.230 -5.235 0.221 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -18.872 -5.205 1.328 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -21.810 -4.827 1.944 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -20.700 -6.008 2.612 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.422 -3.897 3.547 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -20.935 -3.063 3.253 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -20.631 -4.051 5.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -22.075 -4.471 4.740 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.796 -5.584 4.818 1.00 0.00 H new ATOM 1993 N GLU B 34 -19.990 -2.306 -1.934 1.00 0.00 N ATOM 1994 CA GLU B 34 -20.549 -2.325 -3.286 1.00 0.00 C ATOM 1995 C GLU B 34 -19.443 -2.270 -4.334 1.00 0.00 C ATOM 1996 O GLU B 34 -19.477 -2.996 -5.327 1.00 0.00 O ATOM 1997 CB GLU B 34 -21.516 -1.157 -3.492 1.00 0.00 C ATOM 1998 CG GLU B 34 -22.725 -1.197 -2.572 1.00 0.00 C ATOM 1999 CD GLU B 34 -23.942 -1.815 -3.233 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -23.770 -2.532 -4.240 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -25.067 -1.580 -2.743 1.00 0.00 O ATOM 0 H GLU B 34 -20.444 -1.651 -1.297 1.00 0.00 H new ATOM 0 HA GLU B 34 -21.096 -3.260 -3.403 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -20.980 -0.221 -3.334 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -21.858 -1.158 -4.527 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -22.476 -1.765 -1.675 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -22.966 -0.184 -2.251 1.00 0.00 H new ATOM 2008 N LEU B 35 -18.455 -1.412 -4.100 1.00 0.00 N ATOM 2009 CA LEU B 35 -17.334 -1.274 -5.020 1.00 0.00 C ATOM 2010 C LEU B 35 -16.592 -2.592 -5.151 1.00 0.00 C ATOM 2011 O LEU B 35 -16.261 -3.034 -6.251 1.00 0.00 O ATOM 2012 CB LEU B 35 -16.376 -0.184 -4.537 1.00 0.00 C ATOM 2013 CG LEU B 35 -15.516 0.456 -5.624 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -14.491 1.390 -5.003 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -14.832 -0.614 -6.464 1.00 0.00 C ATOM 0 H LEU B 35 -18.409 -0.804 -3.283 1.00 0.00 H new ATOM 0 HA LEU B 35 -17.726 -0.990 -5.997 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -16.958 0.598 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -15.718 -0.611 -3.780 1.00 0.00 H new ATOM 0 HG LEU B 35 -16.162 1.040 -6.280 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.885 1.839 -5.789 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -15.004 2.175 -4.447 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -13.848 0.827 -4.327 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -14.224 -0.139 -7.233 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -14.196 -1.227 -5.825 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -15.586 -1.244 -6.936 1.00 0.00 H new ATOM 2027 N ILE B 36 -16.348 -3.216 -4.013 1.00 0.00 N ATOM 2028 CA ILE B 36 -15.654 -4.495 -3.967 1.00 0.00 C ATOM 2029 C ILE B 36 -16.362 -5.507 -4.863 1.00 0.00 C ATOM 2030 O ILE B 36 -15.768 -6.040 -5.801 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.550 -5.022 -2.512 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -14.229 -4.551 -1.892 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -15.667 -6.542 -2.452 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -13.827 -5.302 -0.640 1.00 0.00 C ATOM 0 H ILE B 36 -16.622 -2.856 -3.099 1.00 0.00 H new ATOM 0 HA ILE B 36 -14.639 -4.350 -4.338 1.00 0.00 H new ATOM 0 HB ILE B 36 -16.383 -4.616 -1.938 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -13.436 -4.653 -2.633 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -14.310 -3.490 -1.655 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -15.589 -6.872 -1.416 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -16.630 -6.849 -2.860 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -14.865 -6.992 -3.037 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -12.882 -4.907 -0.266 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -14.598 -5.180 0.121 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -13.711 -6.361 -0.872 1.00 0.00 H new ATOM 2046 N ASN B 37 -17.638 -5.749 -4.584 1.00 0.00 N ATOM 2047 CA ASN B 37 -18.423 -6.678 -5.386 1.00 0.00 C ATOM 2048 C ASN B 37 -18.499 -6.196 -6.832 1.00 0.00 C ATOM 2049 O ASN B 37 -18.781 -6.975 -7.743 1.00 0.00 O ATOM 2050 CB ASN B 37 -19.832 -6.821 -4.806 1.00 0.00 C ATOM 2051 CG ASN B 37 -20.377 -8.228 -4.953 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -20.960 -8.753 -3.880 1.00 0.00 O flip ATOM 2053 ND2 ASN B 37 -20.277 -8.837 -6.018 1.00 0.00 N flip ATOM 0 H ASN B 37 -18.148 -5.317 -3.813 1.00 0.00 H new ATOM 0 HA ASN B 37 -17.934 -7.652 -5.366 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -19.817 -6.548 -3.751 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -20.501 -6.121 -5.307 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.822 -8.396 -6.817 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -20.650 -9.783 -6.102 1.00 0.00 H new ATOM 2060 N ASN B 38 -18.242 -4.904 -7.033 1.00 0.00 N ATOM 2061 CA ASN B 38 -18.276 -4.310 -8.361 1.00 0.00 C ATOM 2062 C ASN B 38 -16.959 -4.540 -9.098 1.00 0.00 C ATOM 2063 O ASN B 38 -16.942 -4.704 -10.318 1.00 0.00 O ATOM 2064 CB ASN B 38 -18.556 -2.808 -8.261 1.00 0.00 C ATOM 2065 CG ASN B 38 -19.007 -2.213 -9.581 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -20.197 -2.207 -9.898 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -18.056 -1.710 -10.359 1.00 0.00 N ATOM 0 H ASN B 38 -18.007 -4.249 -6.287 1.00 0.00 H new ATOM 0 HA ASN B 38 -19.076 -4.790 -8.924 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -19.323 -2.634 -7.507 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -17.655 -2.295 -7.924 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -18.299 -1.297 -11.260 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.082 -1.736 -10.056 1.00 0.00 H new ATOM 2074 N GLU B 39 -15.856 -4.546 -8.352 1.00 0.00 N ATOM 2075 CA GLU B 39 -14.540 -4.748 -8.949 1.00 0.00 C ATOM 2076 C GLU B 39 -13.903 -6.054 -8.479 1.00 0.00 C ATOM 2077 O GLU B 39 -12.686 -6.220 -8.550 1.00 0.00 O ATOM 2078 CB GLU B 39 -13.621 -3.572 -8.613 1.00 0.00 C ATOM 2079 CG GLU B 39 -13.951 -2.305 -9.387 1.00 0.00 C ATOM 2080 CD GLU B 39 -12.740 -1.706 -10.076 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -11.824 -1.240 -9.367 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -12.707 -1.706 -11.324 1.00 0.00 O ATOM 0 H GLU B 39 -15.848 -4.414 -7.341 1.00 0.00 H new ATOM 0 HA GLU B 39 -14.674 -4.808 -10.029 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -13.686 -3.364 -7.545 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -12.589 -3.857 -8.820 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -14.714 -2.528 -10.133 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -14.377 -1.569 -8.705 1.00 0.00 H new ATOM 2089 N LEU B 40 -14.729 -6.984 -8.005 1.00 0.00 N ATOM 2090 CA LEU B 40 -14.234 -8.275 -7.535 1.00 0.00 C ATOM 2091 C LEU B 40 -15.277 -9.367 -7.750 1.00 0.00 C ATOM 2092 O LEU B 40 -15.136 -10.206 -8.640 1.00 0.00 O ATOM 2093 CB LEU B 40 -13.850 -8.200 -6.054 1.00 0.00 C ATOM 2094 CG LEU B 40 -12.725 -7.218 -5.720 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -12.740 -6.869 -4.240 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -11.376 -7.800 -6.119 1.00 0.00 C ATOM 0 H LEU B 40 -15.740 -6.868 -7.936 1.00 0.00 H new ATOM 0 HA LEU B 40 -13.346 -8.525 -8.115 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -14.734 -7.923 -5.480 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -13.553 -9.195 -5.722 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.888 -6.302 -6.288 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.933 -6.170 -4.023 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.695 -6.411 -3.984 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.603 -7.776 -3.651 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -10.587 -7.089 -5.875 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.207 -8.731 -5.577 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.368 -7.997 -7.191 1.00 0.00 H new ATOM 2225 N LYS B 48 -15.727 -12.360 2.508 1.00 0.00 N ATOM 2226 CA LYS B 48 -16.336 -13.685 2.468 1.00 0.00 C ATOM 2227 C LYS B 48 -17.803 -13.621 2.897 1.00 0.00 C ATOM 2228 O LYS B 48 -18.482 -14.645 2.973 1.00 0.00 O ATOM 2229 CB LYS B 48 -15.567 -14.659 3.365 1.00 0.00 C ATOM 2230 CG LYS B 48 -15.258 -14.106 4.746 1.00 0.00 C ATOM 2231 CD LYS B 48 -13.822 -13.614 4.841 1.00 0.00 C ATOM 2232 CE LYS B 48 -13.613 -12.738 6.066 1.00 0.00 C ATOM 2233 NZ LYS B 48 -13.738 -13.514 7.330 1.00 0.00 N ATOM 0 HA LYS B 48 -16.291 -14.046 1.441 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -16.147 -15.575 3.472 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.632 -14.929 2.874 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -15.940 -13.286 4.972 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -15.429 -14.879 5.495 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -13.146 -14.468 4.883 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.569 -13.051 3.942 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.626 -12.277 6.019 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -14.343 -11.929 6.063 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.810 -12.858 8.134 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -14.591 -14.108 7.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.901 -14.119 7.450 1.00 0.00 H new ATOM 2247 N GLU B 49 -18.285 -12.409 3.173 1.00 0.00 N ATOM 2248 CA GLU B 49 -19.667 -12.204 3.590 1.00 0.00 C ATOM 2249 C GLU B 49 -19.953 -10.716 3.769 1.00 0.00 C ATOM 2250 O GLU B 49 -19.051 -9.885 3.675 1.00 0.00 O ATOM 2251 CB GLU B 49 -19.945 -12.954 4.896 1.00 0.00 C ATOM 2252 CG GLU B 49 -20.892 -14.132 4.731 1.00 0.00 C ATOM 2253 CD GLU B 49 -21.820 -14.305 5.917 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -22.576 -13.359 6.222 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -21.791 -15.386 6.541 1.00 0.00 O ATOM 0 H GLU B 49 -17.734 -11.553 3.114 1.00 0.00 H new ATOM 0 HA GLU B 49 -20.324 -12.596 2.813 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -19.001 -13.312 5.308 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -20.366 -12.259 5.622 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -21.485 -13.992 3.827 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -20.311 -15.044 4.593 1.00 0.00 H new ATOM 2262 N GLN B 50 -21.212 -10.384 4.027 1.00 0.00 N ATOM 2263 CA GLN B 50 -21.604 -8.993 4.220 1.00 0.00 C ATOM 2264 C GLN B 50 -21.183 -8.502 5.601 1.00 0.00 C ATOM 2265 O GLN B 50 -20.820 -7.338 5.777 1.00 0.00 O ATOM 2266 CB GLN B 50 -23.117 -8.839 4.044 1.00 0.00 C ATOM 2267 CG GLN B 50 -23.505 -7.735 3.074 1.00 0.00 C ATOM 2268 CD GLN B 50 -25.005 -7.543 2.980 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -25.755 -7.981 3.852 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -25.451 -6.881 1.917 1.00 0.00 N ATOM 0 H GLN B 50 -21.976 -11.055 4.107 1.00 0.00 H new ATOM 0 HA GLN B 50 -21.098 -8.386 3.469 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -23.532 -9.783 3.692 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -23.569 -8.634 5.015 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -23.042 -6.800 3.389 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -23.110 -7.969 2.086 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -24.793 -6.535 1.218 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -26.451 -6.719 1.800 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.237 -9.399 6.578 1.00 0.00 N ATOM 2280 CA GLU B 51 -20.865 -9.061 7.947 1.00 0.00 C ATOM 2281 C GLU B 51 -19.370 -8.792 8.064 1.00 0.00 C ATOM 2282 O GLU B 51 -18.951 -7.857 8.747 1.00 0.00 O ATOM 2283 CB GLU B 51 -21.268 -10.184 8.907 1.00 0.00 C ATOM 2284 CG GLU B 51 -20.959 -11.580 8.388 1.00 0.00 C ATOM 2285 CD GLU B 51 -21.053 -12.638 9.471 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -21.903 -12.489 10.374 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -20.277 -13.614 9.416 1.00 0.00 O ATOM 0 H GLU B 51 -21.535 -10.366 6.448 1.00 0.00 H new ATOM 0 HA GLU B 51 -21.400 -8.151 8.218 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -20.754 -10.038 9.857 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -22.337 -10.110 9.108 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.652 -11.826 7.583 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -19.957 -11.591 7.960 1.00 0.00 H new ATOM 2294 N VAL B 52 -18.567 -9.613 7.399 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.119 -9.454 7.440 1.00 0.00 C ATOM 2296 C VAL B 52 -16.700 -8.102 6.876 1.00 0.00 C ATOM 2297 O VAL B 52 -15.861 -7.415 7.458 1.00 0.00 O ATOM 2298 CB VAL B 52 -16.395 -10.570 6.664 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -16.598 -11.914 7.350 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -16.877 -10.618 5.222 1.00 0.00 C ATOM 0 H VAL B 52 -18.892 -10.393 6.827 1.00 0.00 H new ATOM 0 HA VAL B 52 -16.830 -9.516 8.489 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.327 -10.350 6.656 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -16.080 -12.691 6.788 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.197 -11.870 8.363 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -17.663 -12.145 7.391 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -16.354 -11.413 4.690 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -17.949 -10.813 5.203 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -16.674 -9.663 4.738 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.286 -7.718 5.742 1.00 0.00 N ATOM 2311 CA VAL B 53 -16.953 -6.437 5.120 1.00 0.00 C ATOM 2312 C VAL B 53 -17.095 -5.299 6.122 1.00 0.00 C ATOM 2313 O VAL B 53 -16.192 -4.475 6.271 1.00 0.00 O ATOM 2314 CB VAL B 53 -17.827 -6.118 3.888 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -17.098 -5.149 2.966 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -18.227 -7.385 3.144 1.00 0.00 C ATOM 0 H VAL B 53 -17.984 -8.267 5.241 1.00 0.00 H new ATOM 0 HA VAL B 53 -15.919 -6.528 4.787 1.00 0.00 H new ATOM 0 HB VAL B 53 -18.746 -5.645 4.235 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -17.723 -4.931 2.100 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -16.887 -4.225 3.503 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -16.162 -5.598 2.634 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -18.841 -7.123 2.283 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -17.332 -7.906 2.806 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -18.795 -8.034 3.810 1.00 0.00 H new ATOM 2326 N ASP B 54 -18.229 -5.261 6.819 1.00 0.00 N ATOM 2327 CA ASP B 54 -18.474 -4.226 7.816 1.00 0.00 C ATOM 2328 C ASP B 54 -17.308 -4.152 8.795 1.00 0.00 C ATOM 2329 O ASP B 54 -16.779 -3.076 9.067 1.00 0.00 O ATOM 2330 CB ASP B 54 -19.777 -4.501 8.568 1.00 0.00 C ATOM 2331 CG ASP B 54 -20.193 -3.339 9.449 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -20.092 -2.181 8.991 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -20.621 -3.587 10.597 1.00 0.00 O ATOM 0 H ASP B 54 -18.989 -5.933 6.711 1.00 0.00 H new ATOM 0 HA ASP B 54 -18.566 -3.268 7.304 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -20.570 -4.711 7.850 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -19.658 -5.394 9.182 1.00 0.00 H new ATOM 2338 N LYS B 55 -16.898 -5.309 9.302 1.00 0.00 N ATOM 2339 CA LYS B 55 -15.780 -5.381 10.226 1.00 0.00 C ATOM 2340 C LYS B 55 -14.487 -5.043 9.496 1.00 0.00 C ATOM 2341 O LYS B 55 -13.566 -4.466 10.074 1.00 0.00 O ATOM 2342 CB LYS B 55 -15.690 -6.774 10.851 1.00 0.00 C ATOM 2343 CG LYS B 55 -15.178 -6.764 12.282 1.00 0.00 C ATOM 2344 CD LYS B 55 -15.128 -8.165 12.873 1.00 0.00 C ATOM 2345 CE LYS B 55 -16.494 -8.832 12.853 1.00 0.00 C ATOM 2346 NZ LYS B 55 -16.460 -10.181 13.485 1.00 0.00 N ATOM 0 H LYS B 55 -17.326 -6.209 9.086 1.00 0.00 H new ATOM 0 HA LYS B 55 -15.936 -4.658 11.026 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -16.676 -7.238 10.830 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -15.033 -7.395 10.242 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -14.182 -6.322 12.309 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -15.823 -6.134 12.895 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -14.418 -8.772 12.311 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -14.762 -8.115 13.899 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -17.213 -8.203 13.377 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -16.840 -8.922 11.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -17.410 -10.604 13.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -15.792 -10.789 12.969 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -16.154 -10.093 14.475 1.00 0.00 H new ATOM 2360 N VAL B 56 -14.433 -5.391 8.210 1.00 0.00 N ATOM 2361 CA VAL B 56 -13.262 -5.108 7.392 1.00 0.00 C ATOM 2362 C VAL B 56 -13.065 -3.602 7.275 1.00 0.00 C ATOM 2363 O VAL B 56 -12.032 -3.070 7.681 1.00 0.00 O ATOM 2364 CB VAL B 56 -13.387 -5.723 5.981 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -12.173 -5.373 5.131 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -13.565 -7.233 6.070 1.00 0.00 C ATOM 0 H VAL B 56 -15.187 -5.868 7.716 1.00 0.00 H new ATOM 0 HA VAL B 56 -12.399 -5.560 7.881 1.00 0.00 H new ATOM 0 HB VAL B 56 -14.270 -5.302 5.501 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -12.282 -5.816 4.141 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -12.095 -4.290 5.037 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -11.272 -5.762 5.606 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -13.651 -7.649 5.066 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -12.703 -7.672 6.572 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -14.469 -7.460 6.636 1.00 0.00 H new ATOM 2376 N MET B 57 -14.071 -2.914 6.738 1.00 0.00 N ATOM 2377 CA MET B 57 -14.004 -1.464 6.598 1.00 0.00 C ATOM 2378 C MET B 57 -13.778 -0.816 7.964 1.00 0.00 C ATOM 2379 O MET B 57 -13.255 0.294 8.061 1.00 0.00 O ATOM 2380 CB MET B 57 -15.287 -0.926 5.953 1.00 0.00 C ATOM 2381 CG MET B 57 -16.482 -0.882 6.893 1.00 0.00 C ATOM 2382 SD MET B 57 -17.036 0.800 7.241 1.00 0.00 S ATOM 2383 CE MET B 57 -17.154 1.472 5.585 1.00 0.00 C ATOM 0 H MET B 57 -14.935 -3.335 6.396 1.00 0.00 H new ATOM 0 HA MET B 57 -13.165 -1.213 5.949 1.00 0.00 H new ATOM 0 HB2 MET B 57 -15.098 0.079 5.576 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.537 -1.547 5.093 1.00 0.00 H new ATOM 0 HG2 MET B 57 -17.304 -1.447 6.455 1.00 0.00 H new ATOM 0 HG3 MET B 57 -16.220 -1.375 7.829 1.00 0.00 H new ATOM 0 HE1 MET B 57 -17.830 2.327 5.587 1.00 0.00 H new ATOM 0 HE2 MET B 57 -16.167 1.791 5.250 1.00 0.00 H new ATOM 0 HE3 MET B 57 -17.537 0.708 4.909 1.00 0.00 H new ATOM 2393 N GLU B 58 -14.170 -1.533 9.017 1.00 0.00 N ATOM 2394 CA GLU B 58 -14.007 -1.052 10.383 1.00 0.00 C ATOM 2395 C GLU B 58 -12.581 -1.294 10.865 1.00 0.00 C ATOM 2396 O GLU B 58 -12.003 -0.469 11.573 1.00 0.00 O ATOM 2397 CB GLU B 58 -15.002 -1.758 11.310 1.00 0.00 C ATOM 2398 CG GLU B 58 -16.112 -0.851 11.817 1.00 0.00 C ATOM 2399 CD GLU B 58 -15.952 -0.498 13.284 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -14.796 -0.384 13.743 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -16.981 -0.337 13.971 1.00 0.00 O ATOM 0 H GLU B 58 -14.604 -2.453 8.946 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.204 0.020 10.401 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -15.446 -2.600 10.779 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -14.462 -2.169 12.163 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -16.126 0.065 11.226 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -17.074 -1.342 11.668 1.00 0.00 H new ATOM 2408 N THR B 59 -12.019 -2.431 10.468 1.00 0.00 N ATOM 2409 CA THR B 59 -10.657 -2.794 10.847 1.00 0.00 C ATOM 2410 C THR B 59 -9.630 -1.969 10.069 1.00 0.00 C ATOM 2411 O THR B 59 -8.433 -2.043 10.340 1.00 0.00 O ATOM 2412 CB THR B 59 -10.426 -4.290 10.599 1.00 0.00 C ATOM 2413 OG1 THR B 59 -11.195 -5.069 11.497 1.00 0.00 O ATOM 2414 CG2 THR B 59 -8.978 -4.714 10.749 1.00 0.00 C ATOM 0 H THR B 59 -12.488 -3.121 9.881 1.00 0.00 H new ATOM 0 HA THR B 59 -10.530 -2.580 11.908 1.00 0.00 H new ATOM 0 HB THR B 59 -10.728 -4.458 9.565 1.00 0.00 H new ATOM 0 HG1 THR B 59 -12.145 -4.990 11.268 1.00 0.00 H new ATOM 0 HG21 THR B 59 -8.891 -5.784 10.559 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.363 -4.167 10.034 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.638 -4.496 11.761 1.00 0.00 H new ATOM 2422 N LEU B 60 -10.102 -1.193 9.095 1.00 0.00 N ATOM 2423 CA LEU B 60 -9.217 -0.372 8.279 1.00 0.00 C ATOM 2424 C LEU B 60 -9.442 1.119 8.525 1.00 0.00 C ATOM 2425 O LEU B 60 -8.637 1.949 8.104 1.00 0.00 O ATOM 2426 CB LEU B 60 -9.426 -0.695 6.801 1.00 0.00 C ATOM 2427 CG LEU B 60 -9.510 -2.187 6.476 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -10.486 -2.433 5.337 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -8.134 -2.728 6.128 1.00 0.00 C ATOM 0 H LEU B 60 -11.090 -1.117 8.854 1.00 0.00 H new ATOM 0 HA LEU B 60 -8.190 -0.603 8.563 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -10.343 -0.212 6.464 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -8.607 -0.258 6.229 1.00 0.00 H new ATOM 0 HG LEU B 60 -9.877 -2.713 7.357 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.531 -3.500 5.121 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -11.476 -2.078 5.623 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.151 -1.897 4.449 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -8.208 -3.791 5.899 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -7.743 -2.196 5.261 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -7.462 -2.585 6.974 1.00 0.00 H new ATOM 2441 N ASP B 61 -10.535 1.459 9.210 1.00 0.00 N ATOM 2442 CA ASP B 61 -10.845 2.856 9.505 1.00 0.00 C ATOM 2443 C ASP B 61 -9.625 3.568 10.081 1.00 0.00 C ATOM 2444 O ASP B 61 -9.032 3.110 11.058 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.018 2.944 10.485 1.00 0.00 C ATOM 2446 CG ASP B 61 -13.189 3.720 9.915 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -14.018 3.108 9.208 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -13.278 4.937 10.176 1.00 0.00 O ATOM 0 H ASP B 61 -11.216 0.789 9.568 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.125 3.349 8.574 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -12.345 1.938 10.747 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -11.683 3.421 11.406 1.00 0.00 H new ATOM 2453 N ASN B 62 -9.246 4.682 9.464 1.00 0.00 N ATOM 2454 CA ASN B 62 -8.087 5.442 9.918 1.00 0.00 C ATOM 2455 C ASN B 62 -8.490 6.831 10.402 1.00 0.00 C ATOM 2456 O ASN B 62 -8.127 7.241 11.505 1.00 0.00 O ATOM 2457 CB ASN B 62 -7.058 5.560 8.789 1.00 0.00 C ATOM 2458 CG ASN B 62 -5.798 4.766 9.072 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -5.858 3.586 9.416 1.00 0.00 O ATOM 2460 ND2 ASN B 62 -4.647 5.412 8.928 1.00 0.00 N ATOM 0 H ASN B 62 -9.721 5.077 8.653 1.00 0.00 H new ATOM 0 HA ASN B 62 -7.642 4.906 10.757 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -7.503 5.211 7.857 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -6.799 6.609 8.645 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -3.766 4.930 9.105 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -4.644 6.391 8.641 1.00 0.00 H new ATOM 2467 N ASP B 63 -9.233 7.552 9.573 1.00 0.00 N ATOM 2468 CA ASP B 63 -9.674 8.896 9.924 1.00 0.00 C ATOM 2469 C ASP B 63 -10.962 9.262 9.191 1.00 0.00 C ATOM 2470 O ASP B 63 -11.097 10.368 8.666 1.00 0.00 O ATOM 2471 CB ASP B 63 -8.574 9.912 9.602 1.00 0.00 C ATOM 2472 CG ASP B 63 -8.200 10.759 10.802 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -9.004 11.636 11.184 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -7.103 10.547 11.361 1.00 0.00 O ATOM 0 H ASP B 63 -9.542 7.231 8.656 1.00 0.00 H new ATOM 0 HA ASP B 63 -9.878 8.918 10.995 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -7.690 9.385 9.243 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -8.908 10.561 8.793 1.00 0.00 H new ATOM 2479 N GLY B 64 -11.909 8.332 9.167 1.00 0.00 N ATOM 2480 CA GLY B 64 -13.174 8.582 8.504 1.00 0.00 C ATOM 2481 C GLY B 64 -14.340 8.596 9.474 1.00 0.00 C ATOM 2482 O GLY B 64 -15.497 8.653 9.060 1.00 0.00 O ATOM 0 H GLY B 64 -11.823 7.410 9.595 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -13.126 9.538 7.983 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -13.343 7.816 7.748 1.00 0.00 H new ATOM 2486 N ASP B 65 -14.035 8.539 10.768 1.00 0.00 N ATOM 2487 CA ASP B 65 -15.071 8.538 11.793 1.00 0.00 C ATOM 2488 C ASP B 65 -15.997 7.343 11.612 1.00 0.00 C ATOM 2489 O ASP B 65 -17.153 7.368 12.038 1.00 0.00 O ATOM 2490 CB ASP B 65 -15.875 9.837 11.739 1.00 0.00 C ATOM 2491 CG ASP B 65 -15.018 11.059 12.008 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -14.043 11.278 11.260 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -15.324 11.798 12.969 1.00 0.00 O ATOM 0 H ASP B 65 -13.082 8.493 11.129 1.00 0.00 H new ATOM 0 HA ASP B 65 -14.590 8.463 12.768 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -16.341 9.932 10.758 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -16.681 9.793 12.472 1.00 0.00 H new ATOM 2498 N GLY B 66 -15.482 6.298 10.973 1.00 0.00 N ATOM 2499 CA GLY B 66 -16.269 5.106 10.737 1.00 0.00 C ATOM 2500 C GLY B 66 -16.258 4.687 9.279 1.00 0.00 C ATOM 2501 O GLY B 66 -16.543 3.533 8.958 1.00 0.00 O ATOM 0 H GLY B 66 -14.528 6.257 10.613 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -15.883 4.291 11.350 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -17.297 5.283 11.054 1.00 0.00 H new ATOM 2505 N GLU B 67 -15.923 5.622 8.395 1.00 0.00 N ATOM 2506 CA GLU B 67 -15.870 5.343 6.972 1.00 0.00 C ATOM 2507 C GLU B 67 -14.474 4.890 6.571 1.00 0.00 C ATOM 2508 O GLU B 67 -13.573 4.798 7.405 1.00 0.00 O ATOM 2509 CB GLU B 67 -16.268 6.588 6.175 1.00 0.00 C ATOM 2510 CG GLU B 67 -17.588 6.443 5.438 1.00 0.00 C ATOM 2511 CD GLU B 67 -18.673 7.341 5.999 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -18.756 7.470 7.238 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -19.440 7.917 5.198 1.00 0.00 O ATOM 0 H GLU B 67 -15.684 6.582 8.645 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.574 4.541 6.749 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -16.332 7.438 6.854 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.482 6.814 5.454 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -17.438 6.676 4.384 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -17.917 5.405 5.491 1.00 0.00 H new ATOM 2520 N CYS B 68 -14.305 4.608 5.291 1.00 0.00 N ATOM 2521 CA CYS B 68 -13.026 4.164 4.765 1.00 0.00 C ATOM 2522 C CYS B 68 -12.528 5.118 3.688 1.00 0.00 C ATOM 2523 O CYS B 68 -13.019 5.098 2.565 1.00 0.00 O ATOM 2524 CB CYS B 68 -13.157 2.755 4.187 1.00 0.00 C ATOM 2525 SG CYS B 68 -12.831 1.434 5.379 1.00 0.00 S ATOM 0 H CYS B 68 -15.044 4.679 4.592 1.00 0.00 H new ATOM 0 HA CYS B 68 -12.304 4.152 5.582 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -14.164 2.630 3.788 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -12.467 2.652 3.349 1.00 0.00 H new ATOM 0 HG CYS B 68 -13.460 1.685 6.488 1.00 0.00 H new ATOM 2531 N ASP B 69 -11.548 5.945 4.028 1.00 0.00 N ATOM 2532 CA ASP B 69 -10.989 6.888 3.071 1.00 0.00 C ATOM 2533 C ASP B 69 -9.755 6.283 2.419 1.00 0.00 C ATOM 2534 O ASP B 69 -9.396 5.143 2.698 1.00 0.00 O ATOM 2535 CB ASP B 69 -10.627 8.216 3.746 1.00 0.00 C ATOM 2536 CG ASP B 69 -10.248 8.062 5.209 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -9.754 6.979 5.583 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -10.445 9.027 5.977 1.00 0.00 O ATOM 0 H ASP B 69 -11.126 5.981 4.956 1.00 0.00 H new ATOM 0 HA ASP B 69 -11.743 7.092 2.310 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -9.797 8.674 3.209 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.473 8.899 3.667 1.00 0.00 H new ATOM 2543 N PHE B 70 -9.093 7.049 1.565 1.00 0.00 N ATOM 2544 CA PHE B 70 -7.887 6.566 0.902 1.00 0.00 C ATOM 2545 C PHE B 70 -6.827 6.187 1.933 1.00 0.00 C ATOM 2546 O PHE B 70 -5.886 5.448 1.639 1.00 0.00 O ATOM 2547 CB PHE B 70 -7.333 7.633 -0.042 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.353 7.092 -1.037 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -6.789 6.361 -2.127 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -4.996 7.315 -0.881 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -5.886 5.860 -3.046 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -4.090 6.815 -1.795 1.00 0.00 C ATOM 2553 CZ PHE B 70 -4.536 6.087 -2.878 1.00 0.00 C ATOM 0 H PHE B 70 -9.366 8.000 1.315 1.00 0.00 H new ATOM 0 HA PHE B 70 -8.148 5.681 0.321 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -8.160 8.102 -0.575 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -6.850 8.413 0.546 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -7.845 6.180 -2.262 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -4.642 7.886 -0.035 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -6.237 5.292 -3.894 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -3.033 6.994 -1.662 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.829 5.695 -3.594 1.00 0.00 H new ATOM 2563 N GLN B 71 -6.998 6.699 3.144 1.00 0.00 N ATOM 2564 CA GLN B 71 -6.067 6.420 4.232 1.00 0.00 C ATOM 2565 C GLN B 71 -6.081 4.937 4.586 1.00 0.00 C ATOM 2566 O GLN B 71 -5.032 4.331 4.819 1.00 0.00 O ATOM 2567 CB GLN B 71 -6.423 7.253 5.467 1.00 0.00 C ATOM 2568 CG GLN B 71 -6.876 8.667 5.143 1.00 0.00 C ATOM 2569 CD GLN B 71 -6.808 9.590 6.343 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -6.416 9.181 7.435 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -7.191 10.846 6.144 1.00 0.00 N ATOM 0 H GLN B 71 -7.773 7.311 3.399 1.00 0.00 H new ATOM 0 HA GLN B 71 -5.065 6.690 3.899 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -7.214 6.746 6.020 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -5.555 7.301 6.124 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -6.254 9.070 4.344 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -7.899 8.640 4.768 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -7.509 11.142 5.221 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -7.167 11.515 6.914 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.274 4.352 4.615 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.414 2.936 4.931 1.00 0.00 C ATOM 2582 C GLU B 72 -7.051 2.082 3.721 1.00 0.00 C ATOM 2583 O GLU B 72 -6.702 0.911 3.859 1.00 0.00 O ATOM 2584 CB GLU B 72 -8.834 2.622 5.407 1.00 0.00 C ATOM 2585 CG GLU B 72 -9.865 2.600 4.295 1.00 0.00 C ATOM 2586 CD GLU B 72 -10.126 1.202 3.766 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -9.466 0.254 4.241 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -10.990 1.055 2.877 1.00 0.00 O ATOM 0 H GLU B 72 -8.153 4.834 4.425 1.00 0.00 H new ATOM 0 HA GLU B 72 -6.726 2.697 5.742 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -8.833 1.654 5.907 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -9.130 3.364 6.149 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -10.799 3.025 4.663 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -9.525 3.236 3.477 1.00 0.00 H new ATOM 2595 N PHE B 73 -7.110 2.687 2.536 1.00 0.00 N ATOM 2596 CA PHE B 73 -6.760 1.995 1.303 1.00 0.00 C ATOM 2597 C PHE B 73 -5.352 1.436 1.423 1.00 0.00 C ATOM 2598 O PHE B 73 -5.114 0.249 1.198 1.00 0.00 O ATOM 2599 CB PHE B 73 -6.828 2.971 0.126 1.00 0.00 C ATOM 2600 CG PHE B 73 -7.931 2.712 -0.864 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -9.045 1.951 -0.537 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -7.847 3.253 -2.134 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -10.049 1.739 -1.463 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -8.843 3.046 -3.061 1.00 0.00 C ATOM 2605 CZ PHE B 73 -9.948 2.289 -2.728 1.00 0.00 C ATOM 0 H PHE B 73 -7.398 3.657 2.407 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.463 1.179 1.132 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -6.946 3.981 0.520 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -5.875 2.944 -0.402 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.128 1.521 0.450 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.986 3.847 -2.403 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -10.911 1.145 -1.199 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.760 3.476 -4.048 1.00 0.00 H new ATOM 0 HZ PHE B 73 -10.732 2.127 -3.453 1.00 0.00 H new ATOM 2615 N MET B 74 -4.426 2.308 1.799 1.00 0.00 N ATOM 2616 CA MET B 74 -3.039 1.919 1.975 1.00 0.00 C ATOM 2617 C MET B 74 -2.919 0.898 3.097 1.00 0.00 C ATOM 2618 O MET B 74 -2.364 -0.182 2.908 1.00 0.00 O ATOM 2619 CB MET B 74 -2.183 3.145 2.284 1.00 0.00 C ATOM 2620 CG MET B 74 -2.217 4.197 1.189 1.00 0.00 C ATOM 2621 SD MET B 74 -1.271 3.711 -0.268 1.00 0.00 S ATOM 2622 CE MET B 74 -2.457 2.667 -1.112 1.00 0.00 C ATOM 0 H MET B 74 -4.614 3.292 1.988 1.00 0.00 H new ATOM 0 HA MET B 74 -2.682 1.467 1.050 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.525 3.592 3.217 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.152 2.829 2.441 1.00 0.00 H new ATOM 0 HG2 MET B 74 -3.252 4.383 0.901 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.821 5.135 1.579 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.101 1.637 -1.111 1.00 0.00 H new ATOM 0 HE2 MET B 74 -3.418 2.719 -0.599 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.575 3.009 -2.140 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.458 1.242 4.265 1.00 0.00 N ATOM 2633 CA ALA B 75 -3.419 0.344 5.412 1.00 0.00 C ATOM 2634 C ALA B 75 -4.051 -1.001 5.067 1.00 0.00 C ATOM 2635 O ALA B 75 -3.628 -2.044 5.560 1.00 0.00 O ATOM 2636 CB ALA B 75 -4.128 0.974 6.602 1.00 0.00 C ATOM 0 H ALA B 75 -3.924 2.132 4.439 1.00 0.00 H new ATOM 0 HA ALA B 75 -2.376 0.173 5.678 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -4.091 0.291 7.451 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -3.634 1.909 6.866 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -5.168 1.173 6.342 1.00 0.00 H new ATOM 2642 N PHE B 76 -5.062 -0.961 4.206 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.755 -2.170 3.777 1.00 0.00 C ATOM 2644 C PHE B 76 -4.824 -3.060 2.973 1.00 0.00 C ATOM 2645 O PHE B 76 -4.340 -4.080 3.463 1.00 0.00 O ATOM 2646 CB PHE B 76 -6.970 -1.797 2.925 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.603 -2.965 2.223 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -8.524 -3.767 2.873 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -7.270 -3.256 0.913 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -9.104 -4.841 2.227 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -7.844 -4.330 0.260 1.00 0.00 C ATOM 2652 CZ PHE B 76 -8.763 -5.124 0.918 1.00 0.00 C ATOM 0 H PHE B 76 -5.421 -0.101 3.790 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.084 -2.714 4.662 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.716 -1.321 3.562 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.668 -1.059 2.182 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.792 -3.551 3.897 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -6.553 -2.637 0.394 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -9.823 -5.459 2.744 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -7.575 -4.548 -0.763 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.214 -5.964 0.411 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.573 -2.663 1.731 1.00 0.00 N ATOM 2663 CA VAL B 77 -3.695 -3.422 0.857 1.00 0.00 C ATOM 2664 C VAL B 77 -2.356 -3.694 1.531 1.00 0.00 C ATOM 2665 O VAL B 77 -1.677 -4.657 1.202 1.00 0.00 O ATOM 2666 CB VAL B 77 -3.436 -2.683 -0.471 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -4.557 -2.953 -1.462 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -3.265 -1.188 -0.237 1.00 0.00 C ATOM 0 H VAL B 77 -4.966 -1.821 1.310 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.202 -4.364 0.648 1.00 0.00 H new ATOM 0 HB VAL B 77 -2.507 -3.063 -0.896 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.355 -2.423 -2.393 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -4.618 -4.023 -1.660 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.503 -2.607 -1.045 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.083 -0.689 -1.189 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -4.170 -0.785 0.217 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -2.419 -1.018 0.429 1.00 0.00 H new ATOM 2678 N ALA B 78 -1.981 -2.826 2.463 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.706 -2.966 3.168 1.00 0.00 C ATOM 2680 C ALA B 78 -0.778 -3.953 4.333 1.00 0.00 C ATOM 2681 O ALA B 78 0.106 -4.797 4.489 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.233 -1.610 3.667 1.00 0.00 C ATOM 0 H ALA B 78 -2.537 -2.020 2.750 1.00 0.00 H new ATOM 0 HA ALA B 78 0.009 -3.369 2.451 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.716 -1.726 4.190 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.101 -0.936 2.820 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -0.975 -1.194 4.349 1.00 0.00 H new ATOM 2688 N MET B 79 -1.816 -3.844 5.154 1.00 0.00 N ATOM 2689 CA MET B 79 -1.966 -4.732 6.304 1.00 0.00 C ATOM 2690 C MET B 79 -2.310 -6.141 5.849 1.00 0.00 C ATOM 2691 O MET B 79 -1.636 -7.108 6.205 1.00 0.00 O ATOM 2692 CB MET B 79 -3.051 -4.210 7.250 1.00 0.00 C ATOM 2693 CG MET B 79 -2.616 -3.008 8.073 1.00 0.00 C ATOM 2694 SD MET B 79 -3.862 -2.500 9.273 1.00 0.00 S ATOM 2695 CE MET B 79 -5.355 -2.627 8.291 1.00 0.00 C ATOM 0 H MET B 79 -2.561 -3.156 5.048 1.00 0.00 H new ATOM 0 HA MET B 79 -1.017 -4.757 6.839 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.931 -3.940 6.666 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.350 -5.012 7.925 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.690 -3.247 8.596 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.399 -2.174 7.405 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.183 -2.163 8.826 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.208 -2.118 7.338 1.00 0.00 H new ATOM 0 HE3 MET B 79 -5.583 -3.677 8.110 1.00 0.00 H new ATOM 2705 N VAL B 80 -3.362 -6.242 5.053 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.812 -7.519 4.528 1.00 0.00 C ATOM 2707 C VAL B 80 -2.687 -8.225 3.771 1.00 0.00 C ATOM 2708 O VAL B 80 -2.499 -9.437 3.900 1.00 0.00 O ATOM 2709 CB VAL B 80 -5.020 -7.315 3.593 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.470 -8.634 2.980 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -6.166 -6.649 4.345 1.00 0.00 C ATOM 0 H VAL B 80 -3.925 -5.445 4.754 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.110 -8.144 5.370 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.712 -6.659 2.779 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -6.324 -8.458 2.325 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.652 -9.065 2.402 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.757 -9.325 3.773 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -7.012 -6.512 3.671 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -6.467 -7.279 5.182 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.840 -5.679 4.720 1.00 0.00 H new ATOM 2721 N THR B 81 -1.946 -7.455 2.982 1.00 0.00 N ATOM 2722 CA THR B 81 -0.840 -7.992 2.197 1.00 0.00 C ATOM 2723 C THR B 81 0.290 -8.498 3.093 1.00 0.00 C ATOM 2724 O THR B 81 0.649 -9.676 3.050 1.00 0.00 O ATOM 2725 CB THR B 81 -0.321 -6.907 1.246 1.00 0.00 C ATOM 2726 OG1 THR B 81 -1.193 -6.758 0.141 1.00 0.00 O ATOM 2727 CG2 THR B 81 1.067 -7.153 0.690 1.00 0.00 C ATOM 0 H THR B 81 -2.092 -6.452 2.869 1.00 0.00 H new ATOM 0 HA THR B 81 -1.205 -8.842 1.621 1.00 0.00 H new ATOM 0 HB THR B 81 -0.276 -6.010 1.864 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.824 -6.029 0.318 1.00 0.00 H new ATOM 0 HG21 THR B 81 1.345 -6.332 0.029 1.00 0.00 H new ATOM 0 HG22 THR B 81 1.782 -7.216 1.511 1.00 0.00 H new ATOM 0 HG23 THR B 81 1.074 -8.088 0.130 1.00 0.00 H new ATOM 2735 N THR B 82 0.859 -7.588 3.878 1.00 0.00 N ATOM 2736 CA THR B 82 1.974 -7.909 4.767 1.00 0.00 C ATOM 2737 C THR B 82 1.779 -9.232 5.499 1.00 0.00 C ATOM 2738 O THR B 82 2.753 -9.906 5.836 1.00 0.00 O ATOM 2739 CB THR B 82 2.183 -6.783 5.780 1.00 0.00 C ATOM 2740 OG1 THR B 82 0.940 -6.332 6.291 1.00 0.00 O ATOM 2741 CG2 THR B 82 2.904 -5.585 5.204 1.00 0.00 C ATOM 0 H THR B 82 0.563 -6.613 3.917 1.00 0.00 H new ATOM 0 HA THR B 82 2.859 -8.013 4.140 1.00 0.00 H new ATOM 0 HB THR B 82 2.802 -7.214 6.567 1.00 0.00 H new ATOM 0 HG1 THR B 82 0.626 -5.569 5.762 1.00 0.00 H new ATOM 0 HG21 THR B 82 3.019 -4.824 5.976 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.887 -5.890 4.846 1.00 0.00 H new ATOM 0 HG23 THR B 82 2.326 -5.177 4.375 1.00 0.00 H new ATOM 2749 N ALA B 83 0.533 -9.604 5.748 1.00 0.00 N ATOM 2750 CA ALA B 83 0.257 -10.852 6.444 1.00 0.00 C ATOM 2751 C ALA B 83 0.411 -12.050 5.516 1.00 0.00 C ATOM 2752 O ALA B 83 1.360 -12.824 5.639 1.00 0.00 O ATOM 2753 CB ALA B 83 -1.136 -10.835 7.052 1.00 0.00 C ATOM 0 H ALA B 83 -0.293 -9.068 5.483 1.00 0.00 H new ATOM 0 HA ALA B 83 0.988 -10.948 7.247 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -1.320 -11.778 7.567 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -1.213 -10.012 7.763 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -1.876 -10.702 6.263 1.00 0.00 H new ATOM 2759 N CYS B 84 -0.535 -12.210 4.598 1.00 0.00 N ATOM 2760 CA CYS B 84 -0.502 -13.334 3.664 1.00 0.00 C ATOM 2761 C CYS B 84 0.271 -13.018 2.392 1.00 0.00 C ATOM 2762 O CYS B 84 1.215 -13.726 2.045 1.00 0.00 O ATOM 2763 CB CYS B 84 -1.921 -13.805 3.322 1.00 0.00 C ATOM 2764 SG CYS B 84 -3.083 -12.477 2.927 1.00 0.00 S ATOM 0 H CYS B 84 -1.330 -11.582 4.479 1.00 0.00 H new ATOM 0 HA CYS B 84 0.028 -14.141 4.170 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -1.868 -14.487 2.474 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -2.313 -14.374 4.165 1.00 0.00 H new ATOM 0 HG CYS B 84 -2.550 -11.330 3.228 1.00 0.00 H new ATOM 2770 N HIS B 85 -0.126 -11.957 1.693 1.00 0.00 N ATOM 2771 CA HIS B 85 0.541 -11.564 0.454 1.00 0.00 C ATOM 2772 C HIS B 85 2.057 -11.651 0.599 1.00 0.00 C ATOM 2773 O HIS B 85 2.779 -11.847 -0.378 1.00 0.00 O ATOM 2774 CB HIS B 85 0.128 -10.147 0.072 1.00 0.00 C ATOM 2775 CG HIS B 85 0.666 -9.687 -1.246 1.00 0.00 C ATOM 2776 ND1 HIS B 85 -0.143 -9.297 -2.290 1.00 0.00 N ATOM 2777 CD2 HIS B 85 1.938 -9.529 -1.676 1.00 0.00 C ATOM 2778 CE1 HIS B 85 0.609 -8.917 -3.307 1.00 0.00 C ATOM 2779 NE2 HIS B 85 1.878 -9.048 -2.960 1.00 0.00 N ATOM 0 H HIS B 85 -0.904 -11.355 1.963 1.00 0.00 H new ATOM 0 HA HIS B 85 0.237 -12.252 -0.335 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -0.960 -10.092 0.047 1.00 0.00 H new ATOM 0 HB3 HIS B 85 0.464 -9.460 0.849 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -1.163 -9.301 -2.279 1.00 0.00 H new ATOM 0 HD2 HIS B 85 2.835 -9.742 -1.113 1.00 0.00 H new ATOM 0 HE1 HIS B 85 0.248 -8.560 -4.260 1.00 0.00 H new ATOM 2788 N GLU B 86 2.526 -11.511 1.833 1.00 0.00 N ATOM 2789 CA GLU B 86 3.945 -11.577 2.136 1.00 0.00 C ATOM 2790 C GLU B 86 4.592 -12.812 1.518 1.00 0.00 C ATOM 2791 O GLU B 86 5.461 -12.704 0.653 1.00 0.00 O ATOM 2792 CB GLU B 86 4.134 -11.588 3.656 1.00 0.00 C ATOM 2793 CG GLU B 86 5.558 -11.885 4.102 1.00 0.00 C ATOM 2794 CD GLU B 86 5.686 -12.000 5.609 1.00 0.00 C ATOM 2795 OE1 GLU B 86 4.965 -12.826 6.205 1.00 0.00 O ATOM 2796 OE2 GLU B 86 6.510 -11.263 6.193 1.00 0.00 O ATOM 0 H GLU B 86 1.933 -11.349 2.647 1.00 0.00 H new ATOM 0 HA GLU B 86 4.432 -10.702 1.707 1.00 0.00 H new ATOM 0 HB2 GLU B 86 3.834 -10.619 4.056 1.00 0.00 H new ATOM 0 HB3 GLU B 86 3.466 -12.333 4.089 1.00 0.00 H new ATOM 0 HG2 GLU B 86 5.893 -12.814 3.641 1.00 0.00 H new ATOM 0 HG3 GLU B 86 6.219 -11.095 3.744 1.00 0.00 H new ATOM 2803 N PHE B 87 4.167 -13.984 1.969 1.00 0.00 N ATOM 2804 CA PHE B 87 4.710 -15.234 1.459 1.00 0.00 C ATOM 2805 C PHE B 87 3.649 -16.007 0.684 1.00 0.00 C ATOM 2806 O PHE B 87 3.972 -16.790 -0.210 1.00 0.00 O ATOM 2807 CB PHE B 87 5.257 -16.084 2.609 1.00 0.00 C ATOM 2808 CG PHE B 87 6.745 -16.293 2.545 1.00 0.00 C ATOM 2809 CD1 PHE B 87 7.596 -15.259 2.176 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.293 -17.527 2.855 1.00 0.00 C ATOM 2811 CE1 PHE B 87 8.963 -15.457 2.120 1.00 0.00 C ATOM 2812 CE2 PHE B 87 8.660 -17.729 2.800 1.00 0.00 C ATOM 2813 CZ PHE B 87 9.496 -16.693 2.431 1.00 0.00 C ATOM 0 H PHE B 87 3.449 -14.095 2.685 1.00 0.00 H new ATOM 0 HA PHE B 87 5.528 -15.001 0.777 1.00 0.00 H new ATOM 0 HB2 PHE B 87 5.006 -15.605 3.556 1.00 0.00 H new ATOM 0 HB3 PHE B 87 4.761 -17.055 2.601 1.00 0.00 H new ATOM 0 HD1 PHE B 87 7.186 -14.291 1.930 1.00 0.00 H new ATOM 0 HD2 PHE B 87 6.645 -18.341 3.143 1.00 0.00 H new ATOM 0 HE1 PHE B 87 9.615 -14.645 1.833 1.00 0.00 H new ATOM 0 HE2 PHE B 87 9.074 -18.696 3.045 1.00 0.00 H new ATOM 0 HZ PHE B 87 10.564 -16.849 2.386 1.00 0.00 H new ATOM 2823 N PHE B 88 2.382 -15.777 1.019 1.00 0.00 N ATOM 2824 CA PHE B 88 1.290 -16.452 0.335 1.00 0.00 C ATOM 2825 C PHE B 88 1.195 -15.984 -1.116 1.00 0.00 C ATOM 2826 O PHE B 88 0.633 -16.681 -1.961 1.00 0.00 O ATOM 2827 CB PHE B 88 -0.044 -16.221 1.059 1.00 0.00 C ATOM 2828 CG PHE B 88 -0.542 -17.431 1.796 1.00 0.00 C ATOM 2829 CD1 PHE B 88 0.191 -17.971 2.840 1.00 0.00 C ATOM 2830 CD2 PHE B 88 -1.741 -18.029 1.443 1.00 0.00 C ATOM 2831 CE1 PHE B 88 -0.264 -19.084 3.521 1.00 0.00 C ATOM 2832 CE2 PHE B 88 -2.201 -19.143 2.121 1.00 0.00 C ATOM 2833 CZ PHE B 88 -1.462 -19.671 3.161 1.00 0.00 C ATOM 0 H PHE B 88 2.091 -15.133 1.754 1.00 0.00 H new ATOM 0 HA PHE B 88 1.500 -17.522 0.344 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.072 -15.398 1.764 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -0.795 -15.914 0.331 1.00 0.00 H new ATOM 0 HD1 PHE B 88 1.129 -17.517 3.125 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -2.323 -17.621 0.630 1.00 0.00 H new ATOM 0 HE1 PHE B 88 0.316 -19.495 4.334 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -3.138 -19.600 1.837 1.00 0.00 H new ATOM 0 HZ PHE B 88 -1.820 -20.541 3.692 1.00 0.00 H new ATOM 2909 N ARG C 2 -0.081 16.383 6.115 1.00 0.00 N ATOM 2910 CA ARG C 2 -0.472 16.657 4.737 1.00 0.00 C ATOM 2911 C ARG C 2 0.759 16.871 3.863 1.00 0.00 C ATOM 2912 O ARG C 2 1.106 16.022 3.046 1.00 0.00 O ATOM 2913 CB ARG C 2 -1.381 17.887 4.676 1.00 0.00 C ATOM 2914 CG ARG C 2 -2.632 17.679 3.838 1.00 0.00 C ATOM 2915 CD ARG C 2 -3.759 18.600 4.278 1.00 0.00 C ATOM 2916 NE ARG C 2 -5.028 17.886 4.411 1.00 0.00 N ATOM 2917 CZ ARG C 2 -6.213 18.487 4.466 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -6.299 19.810 4.397 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -7.318 17.763 4.588 1.00 0.00 N ATOM 0 HA ARG C 2 -1.021 15.795 4.359 1.00 0.00 H new ATOM 0 HB2 ARG C 2 -1.674 18.162 5.689 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -0.816 18.726 4.269 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -2.402 17.860 2.788 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -2.956 16.642 3.919 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -3.500 19.060 5.232 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -3.871 19.407 3.554 1.00 0.00 H new ATOM 0 HE ARG C 2 -5.003 16.868 4.465 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -5.453 20.372 4.301 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -7.211 20.265 4.440 1.00 0.00 H new ATOM 0 HH21 ARG C 2 -7.258 16.746 4.640 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -8.227 18.223 4.630 1.00 0.00 H new ATOM 2932 N THR C 3 1.422 18.004 4.050 1.00 0.00 N ATOM 2933 CA THR C 3 2.622 18.316 3.284 1.00 0.00 C ATOM 2934 C THR C 3 3.884 17.997 4.083 1.00 0.00 C ATOM 2935 O THR C 3 5.000 18.219 3.612 1.00 0.00 O ATOM 2936 CB THR C 3 2.622 19.788 2.867 1.00 0.00 C ATOM 2937 OG1 THR C 3 3.743 20.079 2.051 1.00 0.00 O ATOM 2938 CG2 THR C 3 2.647 20.744 4.040 1.00 0.00 C ATOM 0 H THR C 3 1.151 18.721 4.723 1.00 0.00 H new ATOM 0 HA THR C 3 2.619 17.694 2.389 1.00 0.00 H new ATOM 0 HB THR C 3 1.689 19.932 2.322 1.00 0.00 H new ATOM 0 HG1 THR C 3 4.506 19.535 2.338 1.00 0.00 H new ATOM 0 HG21 THR C 3 2.646 21.770 3.673 1.00 0.00 H new ATOM 0 HG22 THR C 3 1.767 20.580 4.662 1.00 0.00 H new ATOM 0 HG23 THR C 3 3.546 20.571 4.631 1.00 0.00 H new ATOM 2946 N LYS C 4 3.704 17.469 5.292 1.00 0.00 N ATOM 2947 CA LYS C 4 4.827 17.116 6.148 1.00 0.00 C ATOM 2948 C LYS C 4 5.406 15.758 5.760 1.00 0.00 C ATOM 2949 O LYS C 4 6.381 15.303 6.356 1.00 0.00 O ATOM 2950 CB LYS C 4 4.386 17.094 7.613 1.00 0.00 C ATOM 2951 CG LYS C 4 5.534 17.255 8.597 1.00 0.00 C ATOM 2952 CD LYS C 4 6.127 15.909 8.989 1.00 0.00 C ATOM 2953 CE LYS C 4 7.625 15.864 8.733 1.00 0.00 C ATOM 2954 NZ LYS C 4 8.393 16.535 9.818 1.00 0.00 N ATOM 0 H LYS C 4 2.788 17.277 5.699 1.00 0.00 H new ATOM 0 HA LYS C 4 5.603 17.870 6.017 1.00 0.00 H new ATOM 0 HB2 LYS C 4 3.663 17.892 7.778 1.00 0.00 H new ATOM 0 HB3 LYS C 4 3.874 16.153 7.816 1.00 0.00 H new ATOM 0 HG2 LYS C 4 6.309 17.880 8.154 1.00 0.00 H new ATOM 0 HG3 LYS C 4 5.180 17.771 9.489 1.00 0.00 H new ATOM 0 HD2 LYS C 4 5.931 15.717 10.044 1.00 0.00 H new ATOM 0 HD3 LYS C 4 5.636 15.116 8.425 1.00 0.00 H new ATOM 0 HE2 LYS C 4 7.948 14.826 8.648 1.00 0.00 H new ATOM 0 HE3 LYS C 4 7.845 16.346 7.780 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 9.177 17.078 9.404 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 7.765 17.178 10.341 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 8.774 15.818 10.468 1.00 0.00 H new ATOM 2968 N ILE C 5 4.792 15.110 4.760 1.00 0.00 N ATOM 2969 CA ILE C 5 5.227 13.791 4.290 1.00 0.00 C ATOM 2970 C ILE C 5 5.797 12.962 5.431 1.00 0.00 C ATOM 2971 O ILE C 5 6.798 12.269 5.281 1.00 0.00 O ATOM 2972 CB ILE C 5 6.252 13.855 3.139 1.00 0.00 C ATOM 2973 CG1 ILE C 5 7.558 14.493 3.601 1.00 0.00 C ATOM 2974 CG2 ILE C 5 5.671 14.611 1.955 1.00 0.00 C ATOM 2975 CD1 ILE C 5 7.428 15.972 3.857 1.00 0.00 C ATOM 0 H ILE C 5 3.986 15.484 4.259 1.00 0.00 H new ATOM 0 HA ILE C 5 4.330 13.312 3.898 1.00 0.00 H new ATOM 0 HB ILE C 5 6.474 12.835 2.824 1.00 0.00 H new ATOM 0 HG12 ILE C 5 7.895 14.000 4.513 1.00 0.00 H new ATOM 0 HG13 ILE C 5 8.326 14.326 2.845 1.00 0.00 H new ATOM 0 HG21 ILE C 5 6.406 14.648 1.151 1.00 0.00 H new ATOM 0 HG22 ILE C 5 4.773 14.102 1.603 1.00 0.00 H new ATOM 0 HG23 ILE C 5 5.417 15.626 2.261 1.00 0.00 H new ATOM 0 HD11 ILE C 5 8.389 16.371 4.183 1.00 0.00 H new ATOM 0 HD12 ILE C 5 7.119 16.474 2.940 1.00 0.00 H new ATOM 0 HD13 ILE C 5 6.682 16.143 4.633 1.00 0.00 H new ATOM 2987 N ASP C 6 5.153 13.072 6.581 1.00 0.00 N ATOM 2988 CA ASP C 6 5.580 12.360 7.778 1.00 0.00 C ATOM 2989 C ASP C 6 5.628 10.849 7.555 1.00 0.00 C ATOM 2990 O ASP C 6 4.703 10.132 7.937 1.00 0.00 O ATOM 2991 CB ASP C 6 4.639 12.676 8.943 1.00 0.00 C ATOM 2992 CG ASP C 6 5.212 12.256 10.282 1.00 0.00 C ATOM 2993 OD1 ASP C 6 5.914 11.224 10.329 1.00 0.00 O ATOM 2994 OD2 ASP C 6 4.959 12.958 11.283 1.00 0.00 O ATOM 0 H ASP C 6 4.325 13.653 6.713 1.00 0.00 H new ATOM 0 HA ASP C 6 6.589 12.698 8.016 1.00 0.00 H new ATOM 0 HB2 ASP C 6 4.433 13.746 8.959 1.00 0.00 H new ATOM 0 HB3 ASP C 6 3.687 12.170 8.784 1.00 0.00 H new ATOM 2999 N TRP C 7 6.717 10.363 6.961 1.00 0.00 N ATOM 3000 CA TRP C 7 6.871 8.931 6.729 1.00 0.00 C ATOM 3001 C TRP C 7 7.127 8.225 8.053 1.00 0.00 C ATOM 3002 O TRP C 7 6.413 7.295 8.426 1.00 0.00 O ATOM 3003 CB TRP C 7 8.024 8.644 5.765 1.00 0.00 C ATOM 3004 CG TRP C 7 7.878 9.296 4.423 1.00 0.00 C ATOM 3005 CD1 TRP C 7 6.837 10.063 3.986 1.00 0.00 C ATOM 3006 CD2 TRP C 7 8.810 9.232 3.340 1.00 0.00 C ATOM 3007 NE1 TRP C 7 7.075 10.494 2.704 1.00 0.00 N ATOM 3008 CE2 TRP C 7 8.281 9.996 2.286 1.00 0.00 C ATOM 3009 CE3 TRP C 7 10.046 8.608 3.164 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 8.947 10.153 1.073 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 10.705 8.761 1.961 1.00 0.00 C ATOM 3012 CH2 TRP C 7 10.156 9.530 0.929 1.00 0.00 C ATOM 0 H TRP C 7 7.497 10.934 6.635 1.00 0.00 H new ATOM 0 HA TRP C 7 5.951 8.559 6.279 1.00 0.00 H new ATOM 0 HB2 TRP C 7 8.956 8.979 6.220 1.00 0.00 H new ATOM 0 HB3 TRP C 7 8.107 7.566 5.626 1.00 0.00 H new ATOM 0 HD1 TRP C 7 5.955 10.297 4.564 1.00 0.00 H new ATOM 0 HE1 TRP C 7 6.455 11.088 2.153 1.00 0.00 H new ATOM 0 HE3 TRP C 7 10.480 8.015 3.956 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 8.524 10.745 0.275 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 11.660 8.279 1.814 1.00 0.00 H new ATOM 0 HH2 TRP C 7 10.698 9.634 0.000 1.00 0.00 H new ATOM 3023 N ASN C 8 8.153 8.692 8.762 1.00 0.00 N ATOM 3024 CA ASN C 8 8.526 8.134 10.058 1.00 0.00 C ATOM 3025 C ASN C 8 9.844 8.740 10.541 1.00 0.00 C ATOM 3026 O ASN C 8 9.850 9.670 11.344 1.00 0.00 O ATOM 3027 CB ASN C 8 8.635 6.605 9.980 1.00 0.00 C ATOM 3028 CG ASN C 8 9.204 5.990 11.245 1.00 0.00 C ATOM 3029 OD1 ASN C 8 10.408 5.437 11.144 1.00 0.00 O flip ATOM 3030 ND2 ASN C 8 8.571 6.013 12.300 1.00 0.00 N flip ATOM 0 H ASN C 8 8.746 9.464 8.455 1.00 0.00 H new ATOM 0 HA ASN C 8 7.745 8.385 10.776 1.00 0.00 H new ATOM 0 HB2 ASN C 8 7.648 6.184 9.789 1.00 0.00 H new ATOM 0 HB3 ASN C 8 9.266 6.333 9.134 1.00 0.00 H new ATOM 0 HD21 ASN C 8 7.649 6.448 12.332 1.00 0.00 H new ATOM 0 HD22 ASN C 8 8.968 5.597 13.142 1.00 0.00 H new ATOM 3037 N LYS C 9 10.957 8.196 10.056 1.00 0.00 N ATOM 3038 CA LYS C 9 12.282 8.674 10.443 1.00 0.00 C ATOM 3039 C LYS C 9 12.880 9.645 9.417 1.00 0.00 C ATOM 3040 O LYS C 9 13.290 10.751 9.766 1.00 0.00 O ATOM 3041 CB LYS C 9 13.228 7.488 10.642 1.00 0.00 C ATOM 3042 CG LYS C 9 14.365 7.774 11.610 1.00 0.00 C ATOM 3043 CD LYS C 9 15.547 8.420 10.905 1.00 0.00 C ATOM 3044 CE LYS C 9 16.371 9.271 11.859 1.00 0.00 C ATOM 3045 NZ LYS C 9 16.205 10.726 11.591 1.00 0.00 N ATOM 0 H LYS C 9 10.968 7.422 9.392 1.00 0.00 H new ATOM 0 HA LYS C 9 12.164 9.220 11.379 1.00 0.00 H new ATOM 0 HB2 LYS C 9 12.656 6.635 11.008 1.00 0.00 H new ATOM 0 HB3 LYS C 9 13.646 7.201 9.677 1.00 0.00 H new ATOM 0 HG2 LYS C 9 14.011 8.430 12.405 1.00 0.00 H new ATOM 0 HG3 LYS C 9 14.685 6.845 12.082 1.00 0.00 H new ATOM 0 HD2 LYS C 9 16.179 7.646 10.469 1.00 0.00 H new ATOM 0 HD3 LYS C 9 15.187 9.039 10.083 1.00 0.00 H new ATOM 0 HE2 LYS C 9 16.075 9.055 12.886 1.00 0.00 H new ATOM 0 HE3 LYS C 9 17.424 9.003 11.768 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 16.783 11.271 12.262 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 16.511 10.937 10.620 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 15.205 10.988 11.703 1.00 0.00 H new ATOM 3059 N ILE C 10 12.971 9.205 8.160 1.00 0.00 N ATOM 3060 CA ILE C 10 13.570 10.019 7.100 1.00 0.00 C ATOM 3061 C ILE C 10 12.935 11.409 6.981 1.00 0.00 C ATOM 3062 O ILE C 10 13.624 12.416 7.138 1.00 0.00 O ATOM 3063 CB ILE C 10 13.543 9.288 5.733 1.00 0.00 C ATOM 3064 CG1 ILE C 10 14.639 9.848 4.818 1.00 0.00 C ATOM 3065 CG2 ILE C 10 12.177 9.369 5.063 1.00 0.00 C ATOM 3066 CD1 ILE C 10 14.245 11.110 4.078 1.00 0.00 C ATOM 0 H ILE C 10 12.638 8.291 7.852 1.00 0.00 H new ATOM 0 HA ILE C 10 14.610 10.168 7.391 1.00 0.00 H new ATOM 0 HB ILE C 10 13.738 8.231 5.917 1.00 0.00 H new ATOM 0 HG12 ILE C 10 15.527 10.053 5.416 1.00 0.00 H new ATOM 0 HG13 ILE C 10 14.915 9.085 4.090 1.00 0.00 H new ATOM 0 HG21 ILE C 10 12.208 8.843 4.109 1.00 0.00 H new ATOM 0 HG22 ILE C 10 11.428 8.909 5.707 1.00 0.00 H new ATOM 0 HG23 ILE C 10 11.917 10.414 4.893 1.00 0.00 H new ATOM 0 HD11 ILE C 10 15.075 11.440 3.454 1.00 0.00 H new ATOM 0 HD12 ILE C 10 13.377 10.908 3.450 1.00 0.00 H new ATOM 0 HD13 ILE C 10 13.999 11.891 4.797 1.00 0.00 H new ATOM 3078 N LEU C 11 11.633 11.475 6.718 1.00 0.00 N ATOM 3079 CA LEU C 11 10.955 12.753 6.603 1.00 0.00 C ATOM 3080 C LEU C 11 10.485 13.216 7.979 1.00 0.00 C ATOM 3081 O LEU C 11 10.087 14.366 8.163 1.00 0.00 O ATOM 3082 CB LEU C 11 9.774 12.637 5.637 1.00 0.00 C ATOM 3083 CG LEU C 11 10.081 13.006 4.184 1.00 0.00 C ATOM 3084 CD1 LEU C 11 10.439 14.480 4.070 1.00 0.00 C ATOM 3085 CD2 LEU C 11 11.197 12.150 3.614 1.00 0.00 C ATOM 0 H LEU C 11 11.033 10.661 6.582 1.00 0.00 H new ATOM 0 HA LEU C 11 11.650 13.493 6.207 1.00 0.00 H new ATOM 0 HB2 LEU C 11 9.403 11.613 5.664 1.00 0.00 H new ATOM 0 HB3 LEU C 11 8.968 13.278 5.995 1.00 0.00 H new ATOM 0 HG LEU C 11 9.180 12.814 3.601 1.00 0.00 H new ATOM 0 HD11 LEU C 11 10.654 14.723 3.029 1.00 0.00 H new ATOM 0 HD12 LEU C 11 9.602 15.086 4.419 1.00 0.00 H new ATOM 0 HD13 LEU C 11 11.318 14.689 4.680 1.00 0.00 H new ATOM 0 HD21 LEU C 11 11.387 12.441 2.581 1.00 0.00 H new ATOM 0 HD22 LEU C 11 12.103 12.293 4.204 1.00 0.00 H new ATOM 0 HD23 LEU C 11 10.904 11.101 3.648 1.00 0.00 H new ATOM 3097 N SER C 12 10.550 12.301 8.946 1.00 0.00 N ATOM 3098 CA SER C 12 10.152 12.583 10.318 1.00 0.00 C ATOM 3099 C SER C 12 8.772 13.233 10.375 1.00 0.00 C ATOM 3100 O SER C 12 7.842 12.690 9.747 1.00 0.00 O ATOM 3101 CB SER C 12 11.190 13.480 10.996 1.00 0.00 C ATOM 3102 OG SER C 12 11.007 14.838 10.635 1.00 0.00 O ATOM 3103 OXT SER C 12 8.632 14.275 11.050 1.00 0.00 O ATOM 0 H SER C 12 10.880 11.347 8.797 1.00 0.00 H new ATOM 0 HA SER C 12 10.097 11.635 10.853 1.00 0.00 H new ATOM 0 HB2 SER C 12 11.114 13.375 12.078 1.00 0.00 H new ATOM 0 HB3 SER C 12 12.192 13.158 10.714 1.00 0.00 H new ATOM 0 HG SER C 12 10.721 14.892 9.699 1.00 0.00 H new ATOM 3110 N THR D 1 1.488 -14.732 11.324 1.00 0.00 N ATOM 3111 CA THR D 1 1.060 -13.627 10.425 1.00 0.00 C ATOM 3112 C THR D 1 1.042 -14.073 8.968 1.00 0.00 C ATOM 3113 O THR D 1 0.315 -13.512 8.149 1.00 0.00 O ATOM 3114 CB THR D 1 2.022 -12.452 10.604 1.00 0.00 C ATOM 3115 OG1 THR D 1 2.601 -12.468 11.897 1.00 0.00 O ATOM 3116 CG2 THR D 1 1.362 -11.103 10.414 1.00 0.00 C ATOM 0 H1 THR D 1 1.314 -14.462 12.313 1.00 0.00 H new ATOM 0 H2 THR D 1 0.947 -15.592 11.099 1.00 0.00 H new ATOM 0 H3 THR D 1 2.503 -14.916 11.189 1.00 0.00 H new ATOM 0 HA THR D 1 0.045 -13.328 10.688 1.00 0.00 H new ATOM 0 HB THR D 1 2.779 -12.581 9.831 1.00 0.00 H new ATOM 0 HG1 THR D 1 3.214 -11.709 11.990 1.00 0.00 H new ATOM 0 HG21 THR D 1 2.100 -10.314 10.555 1.00 0.00 H new ATOM 0 HG22 THR D 1 0.949 -11.038 9.407 1.00 0.00 H new ATOM 0 HG23 THR D 1 0.560 -10.984 11.143 1.00 0.00 H new ATOM 3126 N ARG D 2 1.843 -15.086 8.648 1.00 0.00 N ATOM 3127 CA ARG D 2 1.908 -15.601 7.285 1.00 0.00 C ATOM 3128 C ARG D 2 0.511 -15.937 6.772 1.00 0.00 C ATOM 3129 O ARG D 2 -0.035 -15.234 5.926 1.00 0.00 O ATOM 3130 CB ARG D 2 2.802 -16.841 7.226 1.00 0.00 C ATOM 3131 CG ARG D 2 3.818 -16.806 6.096 1.00 0.00 C ATOM 3132 CD ARG D 2 5.036 -17.660 6.412 1.00 0.00 C ATOM 3133 NE ARG D 2 6.284 -16.960 6.120 1.00 0.00 N ATOM 3134 CZ ARG D 2 7.462 -17.567 5.999 1.00 0.00 C ATOM 3135 NH1 ARG D 2 7.558 -18.883 6.141 1.00 0.00 N ATOM 3136 NH2 ARG D 2 8.550 -16.855 5.736 1.00 0.00 N ATOM 0 H ARG D 2 2.453 -15.564 9.311 1.00 0.00 H new ATOM 0 HA ARG D 2 2.337 -14.828 6.647 1.00 0.00 H new ATOM 0 HB2 ARG D 2 3.329 -16.944 8.174 1.00 0.00 H new ATOM 0 HB3 ARG D 2 2.175 -17.725 7.112 1.00 0.00 H new ATOM 0 HG2 ARG D 2 3.353 -17.161 5.176 1.00 0.00 H new ATOM 0 HG3 ARG D 2 4.130 -15.777 5.919 1.00 0.00 H new ATOM 0 HD2 ARG D 2 5.017 -17.944 7.464 1.00 0.00 H new ATOM 0 HD3 ARG D 2 4.993 -18.582 5.832 1.00 0.00 H new ATOM 0 HE ARG D 2 6.251 -15.947 6.002 1.00 0.00 H new ATOM 0 HH11 ARG D 2 6.725 -19.436 6.344 1.00 0.00 H new ATOM 0 HH12 ARG D 2 8.464 -19.341 6.047 1.00 0.00 H new ATOM 0 HH21 ARG D 2 8.483 -15.843 5.627 1.00 0.00 H new ATOM 0 HH22 ARG D 2 9.453 -17.319 5.643 1.00 0.00 H new ATOM 3149 N THR D 3 -0.067 -17.007 7.301 1.00 0.00 N ATOM 3150 CA THR D 3 -1.406 -17.421 6.902 1.00 0.00 C ATOM 3151 C THR D 3 -2.453 -16.943 7.907 1.00 0.00 C ATOM 3152 O THR D 3 -3.643 -17.221 7.755 1.00 0.00 O ATOM 3153 CB THR D 3 -1.472 -18.942 6.755 1.00 0.00 C ATOM 3154 OG1 THR D 3 -2.746 -19.347 6.286 1.00 0.00 O ATOM 3155 CG2 THR D 3 -1.203 -19.681 8.048 1.00 0.00 C ATOM 0 H THR D 3 0.368 -17.603 8.005 1.00 0.00 H new ATOM 0 HA THR D 3 -1.626 -16.962 5.938 1.00 0.00 H new ATOM 0 HB THR D 3 -0.689 -19.196 6.040 1.00 0.00 H new ATOM 0 HG1 THR D 3 -3.431 -18.738 6.633 1.00 0.00 H new ATOM 0 HG21 THR D 3 -1.265 -20.755 7.873 1.00 0.00 H new ATOM 0 HG22 THR D 3 -0.206 -19.430 8.410 1.00 0.00 H new ATOM 0 HG23 THR D 3 -1.944 -19.391 8.793 1.00 0.00 H new ATOM 3163 N LYS D 4 -2.007 -16.220 8.930 1.00 0.00 N ATOM 3164 CA LYS D 4 -2.905 -15.702 9.952 1.00 0.00 C ATOM 3165 C LYS D 4 -3.588 -14.420 9.482 1.00 0.00 C ATOM 3166 O LYS D 4 -4.404 -13.849 10.204 1.00 0.00 O ATOM 3167 CB LYS D 4 -2.136 -15.438 11.248 1.00 0.00 C ATOM 3168 CG LYS D 4 -3.018 -15.402 12.485 1.00 0.00 C ATOM 3169 CD LYS D 4 -3.530 -13.998 12.767 1.00 0.00 C ATOM 3170 CE LYS D 4 -5.048 -13.965 12.865 1.00 0.00 C ATOM 3171 NZ LYS D 4 -5.528 -14.426 14.197 1.00 0.00 N ATOM 0 H LYS D 4 -1.026 -15.980 9.072 1.00 0.00 H new ATOM 0 HA LYS D 4 -3.673 -16.452 10.138 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -1.379 -16.212 11.375 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -1.609 -14.488 11.160 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -3.863 -16.078 12.350 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -2.455 -15.764 13.345 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -3.097 -13.632 13.698 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -3.201 -13.324 11.976 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -5.402 -12.950 12.683 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -5.476 -14.596 12.086 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -6.377 -15.015 14.076 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -4.783 -14.984 14.660 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -5.760 -13.601 14.787 1.00 0.00 H new ATOM 3185 N ILE D 5 -3.237 -13.965 8.270 1.00 0.00 N ATOM 3186 CA ILE D 5 -3.797 -12.738 7.696 1.00 0.00 C ATOM 3187 C ILE D 5 -4.101 -11.714 8.779 1.00 0.00 C ATOM 3188 O ILE D 5 -5.124 -11.036 8.749 1.00 0.00 O ATOM 3189 CB ILE D 5 -5.062 -12.978 6.845 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -6.210 -13.501 7.702 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -4.758 -13.937 5.705 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -5.992 -14.914 8.171 1.00 0.00 C ATOM 0 H ILE D 5 -2.562 -14.435 7.666 1.00 0.00 H new ATOM 0 HA ILE D 5 -3.027 -12.352 7.029 1.00 0.00 H new ATOM 0 HB ILE D 5 -5.373 -12.023 6.421 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -6.336 -12.851 8.568 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -7.136 -13.452 7.129 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -5.660 -14.097 5.114 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -3.979 -13.514 5.071 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -4.417 -14.889 6.112 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -6.841 -15.232 8.776 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -5.895 -15.573 7.308 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -5.082 -14.963 8.769 1.00 0.00 H new ATOM 3204 N ASP D 6 -3.204 -11.638 9.748 1.00 0.00 N ATOM 3205 CA ASP D 6 -3.355 -10.722 10.871 1.00 0.00 C ATOM 3206 C ASP D 6 -3.484 -9.271 10.408 1.00 0.00 C ATOM 3207 O ASP D 6 -2.511 -8.518 10.433 1.00 0.00 O ATOM 3208 CB ASP D 6 -2.161 -10.852 11.819 1.00 0.00 C ATOM 3209 CG ASP D 6 -2.414 -10.196 13.163 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -3.107 -9.158 13.196 1.00 0.00 O ATOM 3211 OD2 ASP D 6 -1.920 -10.721 14.183 1.00 0.00 O ATOM 0 H ASP D 6 -2.356 -12.204 9.781 1.00 0.00 H new ATOM 0 HA ASP D 6 -4.273 -10.993 11.392 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -1.934 -11.907 11.970 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -1.283 -10.400 11.357 1.00 0.00 H new ATOM 3216 N TRP D 7 -4.691 -8.872 10.011 1.00 0.00 N ATOM 3217 CA TRP D 7 -4.925 -7.498 9.579 1.00 0.00 C ATOM 3218 C TRP D 7 -4.879 -6.570 10.785 1.00 0.00 C ATOM 3219 O TRP D 7 -4.118 -5.604 10.814 1.00 0.00 O ATOM 3220 CB TRP D 7 -6.278 -7.358 8.875 1.00 0.00 C ATOM 3221 CG TRP D 7 -6.435 -8.233 7.669 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -5.510 -9.084 7.140 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -7.596 -8.338 6.840 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -6.032 -9.726 6.042 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -7.312 -9.282 5.838 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -8.851 -7.728 6.852 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -8.239 -9.631 4.860 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -9.770 -8.072 5.881 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -9.461 -9.018 4.897 1.00 0.00 C ATOM 0 H TRP D 7 -5.513 -9.474 9.980 1.00 0.00 H new ATOM 0 HA TRP D 7 -4.143 -7.226 8.870 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.071 -7.592 9.586 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -6.414 -6.319 8.576 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -4.513 -9.232 7.527 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -5.546 -10.419 5.473 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -9.099 -6.999 7.609 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -8.002 -10.360 4.099 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -10.743 -7.604 5.881 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -10.202 -9.269 4.152 1.00 0.00 H new ATOM 3240 N ASN D 8 -5.700 -6.888 11.783 1.00 0.00 N ATOM 3241 CA ASN D 8 -5.772 -6.108 13.014 1.00 0.00 C ATOM 3242 C ASN D 8 -6.930 -6.595 13.888 1.00 0.00 C ATOM 3243 O ASN D 8 -6.729 -7.373 14.818 1.00 0.00 O ATOM 3244 CB ASN D 8 -5.928 -4.613 12.702 1.00 0.00 C ATOM 3245 CG ASN D 8 -6.200 -3.779 13.941 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -7.404 -3.226 14.030 1.00 0.00 O flip ATOM 3247 ND2 ASN D 8 -5.338 -3.633 14.808 1.00 0.00 N flip ATOM 0 H ASN D 8 -6.331 -7.689 11.761 1.00 0.00 H new ATOM 0 HA ASN D 8 -4.840 -6.247 13.562 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -5.021 -4.251 12.218 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -6.744 -4.478 11.992 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -4.426 -4.076 14.700 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -5.536 -3.069 15.635 1.00 0.00 H new ATOM 3254 N LYS D 9 -8.136 -6.120 13.591 1.00 0.00 N ATOM 3255 CA LYS D 9 -9.324 -6.497 14.351 1.00 0.00 C ATOM 3256 C LYS D 9 -10.124 -7.617 13.677 1.00 0.00 C ATOM 3257 O LYS D 9 -10.418 -8.638 14.297 1.00 0.00 O ATOM 3258 CB LYS D 9 -10.221 -5.276 14.561 1.00 0.00 C ATOM 3259 CG LYS D 9 -11.094 -5.367 15.801 1.00 0.00 C ATOM 3260 CD LYS D 9 -12.395 -6.100 15.513 1.00 0.00 C ATOM 3261 CE LYS D 9 -12.957 -6.757 16.765 1.00 0.00 C ATOM 3262 NZ LYS D 9 -12.827 -8.240 16.719 1.00 0.00 N ATOM 0 H LYS D 9 -8.317 -5.470 12.826 1.00 0.00 H new ATOM 0 HA LYS D 9 -8.980 -6.878 15.313 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -9.597 -4.385 14.631 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -10.859 -5.150 13.686 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -10.551 -5.884 16.592 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -11.313 -4.364 16.167 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -13.126 -5.400 15.110 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -12.225 -6.858 14.749 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -12.435 -6.374 17.642 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -14.007 -6.488 16.876 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -13.221 -8.650 17.590 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -13.346 -8.609 15.897 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -11.823 -8.498 16.639 1.00 0.00 H new ATOM 3276 N ILE D 10 -10.515 -7.398 12.419 1.00 0.00 N ATOM 3277 CA ILE D 10 -11.329 -8.369 11.685 1.00 0.00 C ATOM 3278 C ILE D 10 -10.710 -9.772 11.662 1.00 0.00 C ATOM 3279 O ILE D 10 -11.323 -10.723 12.146 1.00 0.00 O ATOM 3280 CB ILE D 10 -11.637 -7.886 10.244 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -12.904 -8.571 9.722 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -10.464 -8.108 9.298 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -12.669 -9.949 9.139 1.00 0.00 C ATOM 0 H ILE D 10 -10.281 -6.559 11.889 1.00 0.00 H new ATOM 0 HA ILE D 10 -12.269 -8.443 12.232 1.00 0.00 H new ATOM 0 HB ILE D 10 -11.806 -6.810 10.283 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -13.622 -8.652 10.538 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -13.358 -7.938 8.959 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -10.728 -7.754 8.302 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -9.595 -7.558 9.660 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -10.228 -9.171 9.254 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -13.616 -10.364 8.793 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -11.976 -9.876 8.300 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -12.246 -10.600 9.904 1.00 0.00 H new ATOM 3295 N LEU D 11 -9.504 -9.909 11.118 1.00 0.00 N ATOM 3296 CA LEU D 11 -8.846 -11.201 11.068 1.00 0.00 C ATOM 3297 C LEU D 11 -8.060 -11.430 12.355 1.00 0.00 C ATOM 3298 O LEU D 11 -7.605 -12.539 12.636 1.00 0.00 O ATOM 3299 CB LEU D 11 -7.927 -11.278 9.848 1.00 0.00 C ATOM 3300 CG LEU D 11 -8.556 -11.885 8.592 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -8.901 -13.348 8.820 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -9.792 -11.116 8.160 1.00 0.00 C ATOM 0 H LEU D 11 -8.969 -9.143 10.709 1.00 0.00 H new ATOM 0 HA LEU D 11 -9.598 -11.984 10.977 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -7.580 -10.272 9.611 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.047 -11.864 10.113 1.00 0.00 H new ATOM 0 HG LEU D 11 -7.820 -11.816 7.791 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -9.347 -13.762 7.916 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -7.994 -13.902 9.064 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -9.609 -13.431 9.644 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -10.212 -11.575 7.265 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -10.532 -11.137 8.960 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -9.521 -10.083 7.944 1.00 0.00 H new ATOM 3314 N SER D 12 -7.916 -10.361 13.139 1.00 0.00 N ATOM 3315 CA SER D 12 -7.203 -10.412 14.408 1.00 0.00 C ATOM 3316 C SER D 12 -5.835 -11.070 14.252 1.00 0.00 C ATOM 3317 O SER D 12 -5.088 -10.662 13.340 1.00 0.00 O ATOM 3318 CB SER D 12 -8.036 -11.157 15.453 1.00 0.00 C ATOM 3319 OG SER D 12 -7.914 -12.561 15.298 1.00 0.00 O ATOM 3320 OXT SER D 12 -5.520 -11.983 15.044 1.00 0.00 O ATOM 0 H SER D 12 -8.290 -9.440 12.910 1.00 0.00 H new ATOM 0 HA SER D 12 -7.043 -9.388 14.745 1.00 0.00 H new ATOM 0 HB2 SER D 12 -7.712 -10.869 16.453 1.00 0.00 H new ATOM 0 HB3 SER D 12 -9.083 -10.868 15.361 1.00 0.00 H new ATOM 0 HG SER D 12 -8.029 -12.797 14.354 1.00 0.00 H new