USER MOD reduce.3.24.130724 H: found=0, std=0, add=1358, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1361 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 NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 192 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 192 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD21 : A 97 ASN OD1 : A 221 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD22 : A 97 ASN OD1 : A 221 CACA :(metal ligand) USER MOD Set 1.1: A 70 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 74 LYS NZ :NH3+ -169:sc= 0.354 (180deg=-0.647!) USER MOD Set 2.1: A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -1.63! C(o=-1.6!,f=-6.7!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -123:sc= -1.27 (180deg=-3.2!) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.26) USER MOD Single : A 42 ASN :FLIP amide:sc= -0.497 F(o=-2.5,f=-0.5) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0226 USER MOD Single : A 49 GLN :FLIP amide:sc= -0.174 F(o=-0.98,f=-0.17) USER MOD Single : A 51 MET CE :methyl 153:sc= -0.0113 (180deg=-0.197) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 84:sc= -1.96! USER MOD Single : A 72 MET CE :methyl 166:sc= -0.464 (180deg=-0.892) USER MOD Single : A 75 LYS NZ :NH3+ -169:sc= -0.0619 (180deg=-0.159) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.294! USER MOD Single : A 86 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.12) USER MOD Single : A 90 LYS NZ :NH3+ -162:sc= -0.0212 (180deg=-0.333) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN :FLIP amide:sc= -2.04! C(o=-2.7!,f=-2!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl -112:sc=-0.00579 (180deg=-2.32!) USER MOD Single : A 111 ASN : amide:sc= -0.0714 K(o=-0.071,f=-0.62) USER MOD Single : A 115 LYS NZ :NH3+ -144:sc= 0.168 (180deg=0.000367) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.059 USER MOD Single : A 123 GLN : amide:sc=-0.00233 K(o=-0.0023,f=-1.4!) USER MOD Single : A 124 MET CE :methyl 165:sc= -2.6! (180deg=-3.66!) USER MOD Single : A 126 LYS NZ :NH3+ 160:sc= -0.0386 (180deg=-0.472) USER MOD Single : A 135 GLN : amide:sc= -0.0463 K(o=-0.046,f=-1.2!) USER MOD Single : A 137 ASN :FLIP amide:sc= -1.28! C(o=-5.5!,f=-1.3!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 MET CE :methyl -133:sc= -1.65 (180deg=-5.09!) USER MOD Single : A 145 MET CE :methyl -176:sc= -1.06 (180deg=-1.1) USER MOD Single : A 146 MET CE :methyl -151:sc= -0.13 (180deg=-1.06) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0818 USER MOD Single : B 21 GLN :FLIP amide:sc= -0.499 F(o=-2.8!,f=-0.5) USER MOD Single : B 25 SER OG : rot 66:sc= 0.824 USER MOD Single : B 26 SER OG : rot 180:sc=-0.00895 USER MOD Single : B 28 SER OG : rot 180:sc= -0.552 USER MOD Single : B 31 LYS NZ :NH3+ 143:sc= -0.471 (180deg=-2.39!) USER MOD Single : B 32 ASN :FLIP amide:sc= -0.0984 F(o=-0.99,f=-0.098) USER MOD Single : B 39 MET CE :methyl -152:sc= -0.337 (180deg=-1.81!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 ASN : amide:sc= -1.53 K(o=-1.5,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -1.424 -10.742 -8.270 1.00 0.00 N ATOM 2 CA ALA A 1 -1.974 -9.358 -8.205 1.00 0.00 C ATOM 3 C ALA A 1 -2.579 -8.993 -9.556 1.00 0.00 C ATOM 4 O ALA A 1 -2.078 -8.110 -10.254 1.00 0.00 O ATOM 5 CB ALA A 1 -0.850 -8.381 -7.855 1.00 0.00 C ATOM 0 H1 ALA A 1 -1.010 -10.995 -7.350 1.00 0.00 H new ATOM 0 H2 ALA A 1 -2.188 -11.409 -8.501 1.00 0.00 H new ATOM 0 H3 ALA A 1 -0.689 -10.789 -9.005 1.00 0.00 H new ATOM 0 HA ALA A 1 -2.747 -9.303 -7.438 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -1.250 -7.368 -7.807 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -0.423 -8.649 -6.888 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -0.075 -8.429 -8.620 1.00 0.00 H new ATOM 13 N ASP A 2 -3.657 -9.678 -9.921 1.00 0.00 N ATOM 14 CA ASP A 2 -4.327 -9.422 -11.191 1.00 0.00 C ATOM 15 C ASP A 2 -5.757 -9.952 -11.162 1.00 0.00 C ATOM 16 O ASP A 2 -6.671 -9.270 -10.702 1.00 0.00 O ATOM 17 CB ASP A 2 -3.546 -10.083 -12.329 1.00 0.00 C ATOM 18 CG ASP A 2 -3.213 -11.527 -11.962 1.00 0.00 C ATOM 19 OD1 ASP A 2 -3.518 -11.917 -10.848 1.00 0.00 O ATOM 20 OD2 ASP A 2 -2.662 -12.219 -12.800 1.00 0.00 O ATOM 0 H ASP A 2 -4.085 -10.413 -9.357 1.00 0.00 H new ATOM 0 HA ASP A 2 -4.363 -8.345 -11.356 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -4.133 -10.058 -13.247 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -2.629 -9.527 -12.523 1.00 0.00 H new ATOM 25 N ILE A 3 -5.946 -11.170 -11.660 1.00 0.00 N ATOM 26 CA ILE A 3 -7.270 -11.765 -11.689 1.00 0.00 C ATOM 27 C ILE A 3 -7.833 -11.867 -10.295 1.00 0.00 C ATOM 28 O ILE A 3 -8.914 -11.348 -10.040 1.00 0.00 O ATOM 29 CB ILE A 3 -7.192 -13.163 -12.303 1.00 0.00 C ATOM 30 CG1 ILE A 3 -6.518 -13.085 -13.680 1.00 0.00 C ATOM 31 CG2 ILE A 3 -8.597 -13.747 -12.447 1.00 0.00 C ATOM 32 CD1 ILE A 3 -7.251 -12.081 -14.584 1.00 0.00 C ATOM 0 H ILE A 3 -5.205 -11.756 -12.044 1.00 0.00 H new ATOM 0 HA ILE A 3 -7.922 -11.132 -12.290 1.00 0.00 H new ATOM 0 HB ILE A 3 -6.604 -13.808 -11.650 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -5.476 -12.786 -13.565 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -6.517 -14.070 -14.147 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -8.534 -14.743 -12.885 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -9.067 -13.811 -11.465 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -9.194 -13.104 -13.093 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -6.759 -12.039 -15.556 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -8.286 -12.397 -14.715 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.229 -11.093 -14.124 1.00 0.00 H new ATOM 44 N LEU A 4 -7.106 -12.541 -9.403 1.00 0.00 N ATOM 45 CA LEU A 4 -7.558 -12.710 -8.024 1.00 0.00 C ATOM 46 C LEU A 4 -6.724 -13.775 -7.310 1.00 0.00 C ATOM 47 O LEU A 4 -7.152 -14.915 -7.142 1.00 0.00 O ATOM 48 CB LEU A 4 -9.071 -13.081 -7.988 1.00 0.00 C ATOM 49 CG LEU A 4 -9.915 -11.876 -7.518 1.00 0.00 C ATOM 50 CD1 LEU A 4 -11.350 -12.046 -8.001 1.00 0.00 C ATOM 51 CD2 LEU A 4 -9.885 -11.809 -5.990 1.00 0.00 C ATOM 0 H LEU A 4 -6.207 -12.976 -9.610 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.424 -11.764 -7.499 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -9.397 -13.396 -8.979 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -9.228 -13.926 -7.317 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.506 -10.953 -7.929 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -11.948 -11.197 -7.671 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -11.364 -12.098 -9.090 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -11.766 -12.965 -7.589 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -10.479 -10.960 -5.651 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.299 -12.729 -5.577 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.856 -11.690 -5.651 1.00 0.00 H new ATOM 63 N SER A 5 -5.530 -13.391 -6.891 1.00 0.00 N ATOM 64 CA SER A 5 -4.658 -14.319 -6.195 1.00 0.00 C ATOM 65 C SER A 5 -5.165 -14.581 -4.779 1.00 0.00 C ATOM 66 O SER A 5 -5.964 -13.816 -4.239 1.00 0.00 O ATOM 67 CB SER A 5 -3.239 -13.759 -6.142 1.00 0.00 C ATOM 68 OG SER A 5 -2.637 -13.889 -7.420 1.00 0.00 O ATOM 0 H SER A 5 -5.147 -12.455 -7.019 1.00 0.00 H new ATOM 0 HA SER A 5 -4.654 -15.263 -6.741 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.260 -12.711 -5.842 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.652 -14.293 -5.395 1.00 0.00 H new ATOM 0 HG SER A 5 -1.726 -13.529 -7.391 1.00 0.00 H new ATOM 74 N GLU A 6 -4.695 -15.673 -4.184 1.00 0.00 N ATOM 75 CA GLU A 6 -5.105 -16.028 -2.831 1.00 0.00 C ATOM 76 C GLU A 6 -4.816 -14.878 -1.868 1.00 0.00 C ATOM 77 O GLU A 6 -5.429 -14.779 -0.807 1.00 0.00 O ATOM 78 CB GLU A 6 -4.353 -17.279 -2.368 1.00 0.00 C ATOM 79 CG GLU A 6 -4.791 -18.483 -3.208 1.00 0.00 C ATOM 80 CD GLU A 6 -4.203 -18.380 -4.612 1.00 0.00 C ATOM 81 OE1 GLU A 6 -3.204 -17.696 -4.768 1.00 0.00 O ATOM 82 OE2 GLU A 6 -4.759 -18.991 -5.510 1.00 0.00 O ATOM 0 H GLU A 6 -4.036 -16.322 -4.613 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.176 -16.228 -2.836 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -3.278 -17.126 -2.466 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.554 -17.467 -1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.461 -19.407 -2.734 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -5.879 -18.523 -3.262 1.00 0.00 H new ATOM 89 N GLU A 7 -3.889 -14.005 -2.249 1.00 0.00 N ATOM 90 CA GLU A 7 -3.544 -12.862 -1.410 1.00 0.00 C ATOM 91 C GLU A 7 -4.761 -11.959 -1.235 1.00 0.00 C ATOM 92 O GLU A 7 -5.154 -11.645 -0.114 1.00 0.00 O ATOM 93 CB GLU A 7 -2.397 -12.078 -2.063 1.00 0.00 C ATOM 94 CG GLU A 7 -1.124 -12.929 -2.046 1.00 0.00 C ATOM 95 CD GLU A 7 0.006 -12.196 -2.762 1.00 0.00 C ATOM 96 OE1 GLU A 7 -0.224 -11.084 -3.207 1.00 0.00 O ATOM 97 OE2 GLU A 7 1.087 -12.758 -2.855 1.00 0.00 O ATOM 0 H GLU A 7 -3.368 -14.065 -3.124 1.00 0.00 H new ATOM 0 HA GLU A 7 -3.226 -13.216 -0.429 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -2.659 -11.816 -3.088 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -2.230 -11.143 -1.528 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.834 -13.144 -1.017 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.311 -13.887 -2.531 1.00 0.00 H new ATOM 104 N GLN A 8 -5.345 -11.535 -2.350 1.00 0.00 N ATOM 105 CA GLN A 8 -6.510 -10.659 -2.299 1.00 0.00 C ATOM 106 C GLN A 8 -7.534 -11.219 -1.322 1.00 0.00 C ATOM 107 O GLN A 8 -8.161 -10.472 -0.572 1.00 0.00 O ATOM 108 CB GLN A 8 -7.128 -10.547 -3.698 1.00 0.00 C ATOM 109 CG GLN A 8 -6.305 -9.586 -4.563 1.00 0.00 C ATOM 110 CD GLN A 8 -4.815 -9.880 -4.402 1.00 0.00 C ATOM 111 OE1 GLN A 8 -4.355 -10.961 -4.768 1.00 0.00 O ATOM 112 NE2 GLN A 8 -4.035 -8.983 -3.868 1.00 0.00 N ATOM 0 H GLN A 8 -5.036 -11.780 -3.291 1.00 0.00 H new ATOM 0 HA GLN A 8 -6.204 -9.669 -1.961 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -7.165 -11.530 -4.167 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -8.156 -10.191 -3.623 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.593 -9.689 -5.609 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.514 -8.556 -4.275 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.419 -8.088 -3.566 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.040 -9.176 -3.752 1.00 0.00 H new ATOM 121 N ILE A 9 -7.686 -12.537 -1.329 1.00 0.00 N ATOM 122 CA ILE A 9 -8.622 -13.191 -0.427 1.00 0.00 C ATOM 123 C ILE A 9 -8.121 -13.104 1.013 1.00 0.00 C ATOM 124 O ILE A 9 -8.897 -12.843 1.931 1.00 0.00 O ATOM 125 CB ILE A 9 -8.809 -14.665 -0.834 1.00 0.00 C ATOM 126 CG1 ILE A 9 -9.745 -14.743 -2.047 1.00 0.00 C ATOM 127 CG2 ILE A 9 -9.426 -15.462 0.328 1.00 0.00 C ATOM 128 CD1 ILE A 9 -9.237 -13.820 -3.156 1.00 0.00 C ATOM 0 H ILE A 9 -7.176 -13.170 -1.945 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.583 -12.682 -0.494 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.836 -15.089 -1.084 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.798 -15.769 -2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -10.756 -14.455 -1.757 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.553 -16.502 0.028 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.766 -15.412 1.194 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.396 -15.037 0.586 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -9.906 -13.880 -4.014 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.207 -12.794 -2.790 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.235 -14.128 -3.455 1.00 0.00 H new ATOM 140 N VAL A 10 -6.829 -13.340 1.203 1.00 0.00 N ATOM 141 CA VAL A 10 -6.257 -13.294 2.538 1.00 0.00 C ATOM 142 C VAL A 10 -6.415 -11.900 3.129 1.00 0.00 C ATOM 143 O VAL A 10 -6.884 -11.748 4.257 1.00 0.00 O ATOM 144 CB VAL A 10 -4.766 -13.671 2.462 1.00 0.00 C ATOM 145 CG1 VAL A 10 -4.055 -13.286 3.760 1.00 0.00 C ATOM 146 CG2 VAL A 10 -4.625 -15.182 2.240 1.00 0.00 C ATOM 0 H VAL A 10 -6.167 -13.562 0.459 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.779 -14.003 3.181 1.00 0.00 H new ATOM 0 HB VAL A 10 -4.312 -13.132 1.631 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.002 -13.558 3.692 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.143 -12.211 3.918 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.513 -13.814 4.596 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.569 -15.445 2.187 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -5.091 -15.716 3.068 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -5.116 -15.460 1.307 1.00 0.00 H new ATOM 156 N ASP A 11 -6.025 -10.883 2.367 1.00 0.00 N ATOM 157 CA ASP A 11 -6.136 -9.516 2.848 1.00 0.00 C ATOM 158 C ASP A 11 -7.599 -9.171 3.108 1.00 0.00 C ATOM 159 O ASP A 11 -7.949 -8.653 4.169 1.00 0.00 O ATOM 160 CB ASP A 11 -5.542 -8.557 1.809 1.00 0.00 C ATOM 161 CG ASP A 11 -4.017 -8.660 1.809 1.00 0.00 C ATOM 162 OD1 ASP A 11 -3.485 -9.309 2.695 1.00 0.00 O ATOM 163 OD2 ASP A 11 -3.402 -8.084 0.923 1.00 0.00 O ATOM 0 H ASP A 11 -5.636 -10.979 1.429 1.00 0.00 H new ATOM 0 HA ASP A 11 -5.584 -9.417 3.782 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -5.930 -8.796 0.819 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -5.845 -7.534 2.032 1.00 0.00 H new ATOM 168 N PHE A 12 -8.441 -9.471 2.132 1.00 0.00 N ATOM 169 CA PHE A 12 -9.867 -9.191 2.253 1.00 0.00 C ATOM 170 C PHE A 12 -10.423 -9.921 3.466 1.00 0.00 C ATOM 171 O PHE A 12 -11.209 -9.365 4.235 1.00 0.00 O ATOM 172 CB PHE A 12 -10.604 -9.630 0.976 1.00 0.00 C ATOM 173 CG PHE A 12 -10.481 -8.555 -0.091 1.00 0.00 C ATOM 174 CD1 PHE A 12 -9.255 -7.920 -0.329 1.00 0.00 C ATOM 175 CD2 PHE A 12 -11.604 -8.191 -0.835 1.00 0.00 C ATOM 176 CE1 PHE A 12 -9.157 -6.928 -1.304 1.00 0.00 C ATOM 177 CE2 PHE A 12 -11.509 -7.194 -1.815 1.00 0.00 C ATOM 178 CZ PHE A 12 -10.282 -6.562 -2.047 1.00 0.00 C ATOM 0 H PHE A 12 -8.166 -9.906 1.251 1.00 0.00 H new ATOM 0 HA PHE A 12 -10.016 -8.119 2.382 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -10.186 -10.567 0.609 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -11.655 -9.815 1.198 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -8.383 -8.200 0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -12.550 -8.680 -0.655 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.210 -6.442 -1.485 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.380 -6.914 -2.389 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.205 -5.792 -2.800 1.00 0.00 H new ATOM 188 N LYS A 13 -9.997 -11.164 3.637 1.00 0.00 N ATOM 189 CA LYS A 13 -10.446 -11.956 4.763 1.00 0.00 C ATOM 190 C LYS A 13 -9.960 -11.343 6.072 1.00 0.00 C ATOM 191 O LYS A 13 -10.650 -11.394 7.089 1.00 0.00 O ATOM 192 CB LYS A 13 -9.926 -13.387 4.634 1.00 0.00 C ATOM 193 CG LYS A 13 -10.505 -14.247 5.757 1.00 0.00 C ATOM 194 CD LYS A 13 -10.004 -15.690 5.629 1.00 0.00 C ATOM 195 CE LYS A 13 -10.688 -16.386 4.447 1.00 0.00 C ATOM 196 NZ LYS A 13 -10.531 -17.856 4.578 1.00 0.00 N ATOM 0 H LYS A 13 -9.345 -11.640 3.013 1.00 0.00 H new ATOM 0 HA LYS A 13 -11.536 -11.970 4.767 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -10.206 -13.800 3.665 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -8.837 -13.394 4.681 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -10.215 -13.838 6.725 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.594 -14.227 5.716 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.923 -15.696 5.488 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -10.208 -16.236 6.550 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -11.746 -16.124 4.420 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -10.251 -16.045 3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -10.995 -18.328 3.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -9.520 -18.098 4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -10.968 -18.174 5.467 1.00 0.00 H new ATOM 210 N GLU A 14 -8.765 -10.772 6.033 1.00 0.00 N ATOM 211 CA GLU A 14 -8.193 -10.154 7.223 1.00 0.00 C ATOM 212 C GLU A 14 -9.089 -9.016 7.711 1.00 0.00 C ATOM 213 O GLU A 14 -9.430 -8.939 8.893 1.00 0.00 O ATOM 214 CB GLU A 14 -6.791 -9.613 6.910 1.00 0.00 C ATOM 215 CG GLU A 14 -6.053 -9.279 8.214 1.00 0.00 C ATOM 216 CD GLU A 14 -6.641 -8.016 8.834 1.00 0.00 C ATOM 217 OE1 GLU A 14 -7.075 -7.158 8.084 1.00 0.00 O ATOM 218 OE2 GLU A 14 -6.652 -7.928 10.051 1.00 0.00 O ATOM 0 H GLU A 14 -8.177 -10.723 5.201 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.120 -10.907 8.007 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.226 -10.352 6.342 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.867 -8.722 6.287 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.137 -10.111 8.913 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -4.991 -9.136 8.015 1.00 0.00 H new ATOM 225 N ALA A 15 -9.466 -8.134 6.793 1.00 0.00 N ATOM 226 CA ALA A 15 -10.322 -7.005 7.141 1.00 0.00 C ATOM 227 C ALA A 15 -11.674 -7.509 7.645 1.00 0.00 C ATOM 228 O ALA A 15 -12.264 -6.934 8.564 1.00 0.00 O ATOM 229 CB ALA A 15 -10.510 -6.093 5.898 1.00 0.00 C ATOM 0 H ALA A 15 -9.196 -8.177 5.810 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.852 -6.426 7.936 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -11.150 -5.250 6.159 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.539 -5.724 5.568 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -10.973 -6.665 5.094 1.00 0.00 H new ATOM 235 N PHE A 16 -12.159 -8.588 7.037 1.00 0.00 N ATOM 236 CA PHE A 16 -13.442 -9.148 7.432 1.00 0.00 C ATOM 237 C PHE A 16 -13.415 -9.569 8.900 1.00 0.00 C ATOM 238 O PHE A 16 -14.294 -9.201 9.680 1.00 0.00 O ATOM 239 CB PHE A 16 -13.768 -10.359 6.550 1.00 0.00 C ATOM 240 CG PHE A 16 -14.940 -11.113 7.136 1.00 0.00 C ATOM 241 CD1 PHE A 16 -16.228 -10.568 7.075 1.00 0.00 C ATOM 242 CD2 PHE A 16 -14.734 -12.353 7.755 1.00 0.00 C ATOM 243 CE1 PHE A 16 -17.309 -11.264 7.628 1.00 0.00 C ATOM 244 CE2 PHE A 16 -15.812 -13.046 8.310 1.00 0.00 C ATOM 245 CZ PHE A 16 -17.103 -12.502 8.245 1.00 0.00 C ATOM 0 H PHE A 16 -11.689 -9.084 6.280 1.00 0.00 H new ATOM 0 HA PHE A 16 -14.211 -8.386 7.304 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -14.003 -10.031 5.537 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.900 -11.014 6.479 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -16.387 -9.611 6.601 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.740 -12.773 7.803 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -18.303 -10.845 7.578 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -15.652 -14.001 8.789 1.00 0.00 H new ATOM 0 HZ PHE A 16 -17.938 -13.039 8.671 1.00 0.00 H new ATOM 255 N GLY A 17 -12.403 -10.343 9.264 1.00 0.00 N ATOM 256 CA GLY A 17 -12.271 -10.810 10.634 1.00 0.00 C ATOM 257 C GLY A 17 -12.136 -9.639 11.588 1.00 0.00 C ATOM 258 O GLY A 17 -12.563 -9.706 12.739 1.00 0.00 O ATOM 0 H GLY A 17 -11.666 -10.659 8.633 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.141 -11.408 10.905 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -11.399 -11.458 10.720 1.00 0.00 H new ATOM 262 N LEU A 18 -11.537 -8.560 11.105 1.00 0.00 N ATOM 263 CA LEU A 18 -11.352 -7.385 11.945 1.00 0.00 C ATOM 264 C LEU A 18 -12.708 -6.816 12.365 1.00 0.00 C ATOM 265 O LEU A 18 -12.968 -6.602 13.548 1.00 0.00 O ATOM 266 CB LEU A 18 -10.547 -6.328 11.173 1.00 0.00 C ATOM 267 CG LEU A 18 -9.862 -5.346 12.149 1.00 0.00 C ATOM 268 CD1 LEU A 18 -8.706 -4.641 11.442 1.00 0.00 C ATOM 269 CD2 LEU A 18 -10.869 -4.303 12.667 1.00 0.00 C ATOM 0 H LEU A 18 -11.177 -8.473 10.155 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.805 -7.668 12.844 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -9.795 -6.817 10.553 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.207 -5.780 10.501 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.480 -5.911 12.999 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.225 -3.949 12.133 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.980 -5.381 11.105 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.087 -4.089 10.583 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.366 -3.621 13.353 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -11.274 -3.739 11.826 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.681 -4.809 13.189 1.00 0.00 H new ATOM 281 N PHE A 19 -13.563 -6.572 11.385 1.00 0.00 N ATOM 282 CA PHE A 19 -14.888 -6.024 11.669 1.00 0.00 C ATOM 283 C PHE A 19 -15.663 -6.977 12.570 1.00 0.00 C ATOM 284 O PHE A 19 -16.505 -6.554 13.359 1.00 0.00 O ATOM 285 CB PHE A 19 -15.661 -5.787 10.346 1.00 0.00 C ATOM 286 CG PHE A 19 -15.743 -4.314 10.044 1.00 0.00 C ATOM 287 CD1 PHE A 19 -16.731 -3.536 10.654 1.00 0.00 C ATOM 288 CD2 PHE A 19 -14.836 -3.728 9.163 1.00 0.00 C ATOM 289 CE1 PHE A 19 -16.812 -2.168 10.381 1.00 0.00 C ATOM 290 CE2 PHE A 19 -14.916 -2.361 8.893 1.00 0.00 C ATOM 291 CZ PHE A 19 -15.903 -1.581 9.501 1.00 0.00 C ATOM 0 H PHE A 19 -13.371 -6.740 10.397 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.774 -5.069 12.183 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.162 -6.305 9.527 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -16.664 -6.205 10.423 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -17.432 -3.992 11.337 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -14.074 -4.330 8.691 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.577 -1.567 10.850 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -14.213 -1.905 8.212 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.962 -0.524 9.290 1.00 0.00 H new ATOM 301 N ASP A 20 -15.372 -8.265 12.443 1.00 0.00 N ATOM 302 CA ASP A 20 -16.047 -9.275 13.246 1.00 0.00 C ATOM 303 C ASP A 20 -15.233 -9.604 14.488 1.00 0.00 C ATOM 304 O ASP A 20 -14.503 -10.595 14.520 1.00 0.00 O ATOM 305 CB ASP A 20 -16.253 -10.546 12.416 1.00 0.00 C ATOM 306 CG ASP A 20 -17.294 -11.439 13.082 1.00 0.00 C ATOM 307 OD1 ASP A 20 -17.577 -11.214 14.248 1.00 0.00 O ATOM 308 OD2 ASP A 20 -17.797 -12.331 12.419 1.00 0.00 O ATOM 0 H ASP A 20 -14.676 -8.634 11.795 1.00 0.00 H new ATOM 0 HA ASP A 20 -17.015 -8.880 13.556 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -16.577 -10.284 11.409 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -15.310 -11.083 12.318 1.00 0.00 H new ATOM 313 N LYS A 21 -15.363 -8.766 15.507 1.00 0.00 N ATOM 314 CA LYS A 21 -14.636 -8.972 16.752 1.00 0.00 C ATOM 315 C LYS A 21 -15.235 -10.130 17.537 1.00 0.00 C ATOM 316 O LYS A 21 -14.612 -10.656 18.455 1.00 0.00 O ATOM 317 CB LYS A 21 -14.676 -7.699 17.604 1.00 0.00 C ATOM 318 CG LYS A 21 -16.081 -7.100 17.555 1.00 0.00 C ATOM 319 CD LYS A 21 -16.183 -5.955 18.562 1.00 0.00 C ATOM 320 CE LYS A 21 -15.126 -4.883 18.246 1.00 0.00 C ATOM 321 NZ LYS A 21 -13.858 -5.223 18.950 1.00 0.00 N ATOM 0 H LYS A 21 -15.962 -7.941 15.497 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.601 -9.210 16.508 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.402 -7.929 18.634 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.948 -6.977 17.234 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.298 -6.735 16.551 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.822 -7.866 17.783 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -17.180 -5.516 18.527 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -16.037 -6.335 19.573 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.956 -4.829 17.171 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.480 -3.902 18.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.578 -4.431 19.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.000 -6.075 19.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.109 -5.400 18.250 1.00 0.00 H new ATOM 335 N ASP A 22 -16.449 -10.519 17.170 1.00 0.00 N ATOM 336 CA ASP A 22 -17.146 -11.620 17.845 1.00 0.00 C ATOM 337 C ASP A 22 -17.300 -12.806 16.917 1.00 0.00 C ATOM 338 O ASP A 22 -18.219 -13.593 17.092 1.00 0.00 O ATOM 339 CB ASP A 22 -18.528 -11.147 18.320 1.00 0.00 C ATOM 340 CG ASP A 22 -19.142 -10.212 17.288 1.00 0.00 C ATOM 341 OD1 ASP A 22 -18.630 -10.160 16.182 1.00 0.00 O ATOM 342 OD2 ASP A 22 -20.116 -9.559 17.619 1.00 0.00 O ATOM 0 H ASP A 22 -16.977 -10.092 16.409 1.00 0.00 H new ATOM 0 HA ASP A 22 -16.553 -11.930 18.705 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -19.181 -12.006 18.479 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -18.437 -10.635 19.278 1.00 0.00 H new ATOM 347 N GLY A 23 -16.384 -12.934 15.948 1.00 0.00 N ATOM 348 CA GLY A 23 -16.401 -14.046 14.994 1.00 0.00 C ATOM 349 C GLY A 23 -17.782 -14.679 14.884 1.00 0.00 C ATOM 350 O GLY A 23 -17.961 -15.860 15.194 1.00 0.00 O ATOM 0 H GLY A 23 -15.618 -12.276 15.805 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.087 -13.688 14.014 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.679 -14.801 15.304 1.00 0.00 H new ATOM 354 N ASP A 24 -18.760 -13.889 14.453 1.00 0.00 N ATOM 355 CA ASP A 24 -20.123 -14.390 14.324 1.00 0.00 C ATOM 356 C ASP A 24 -20.338 -14.967 12.935 1.00 0.00 C ATOM 357 O ASP A 24 -21.162 -15.855 12.751 1.00 0.00 O ATOM 358 CB ASP A 24 -21.119 -13.253 14.551 1.00 0.00 C ATOM 359 CG ASP A 24 -20.880 -12.592 15.900 1.00 0.00 C ATOM 360 OD1 ASP A 24 -20.557 -13.300 16.841 1.00 0.00 O ATOM 361 OD2 ASP A 24 -21.038 -11.385 15.979 1.00 0.00 O ATOM 0 H ASP A 24 -18.637 -12.911 14.190 1.00 0.00 H new ATOM 0 HA ASP A 24 -20.279 -15.169 15.070 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -21.022 -12.514 13.756 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -22.137 -13.640 14.505 1.00 0.00 H new ATOM 366 N GLY A 25 -19.584 -14.448 11.965 1.00 0.00 N ATOM 367 CA GLY A 25 -19.684 -14.911 10.579 1.00 0.00 C ATOM 368 C GLY A 25 -20.292 -13.840 9.680 1.00 0.00 C ATOM 369 O GLY A 25 -20.425 -14.037 8.472 1.00 0.00 O ATOM 0 H GLY A 25 -18.898 -13.708 12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -18.694 -15.179 10.210 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -20.294 -15.813 10.538 1.00 0.00 H new ATOM 373 N CYS A 26 -20.664 -12.709 10.271 1.00 0.00 N ATOM 374 CA CYS A 26 -21.259 -11.616 9.510 1.00 0.00 C ATOM 375 C CYS A 26 -21.137 -10.309 10.277 1.00 0.00 C ATOM 376 O CYS A 26 -20.834 -10.308 11.471 1.00 0.00 O ATOM 377 CB CYS A 26 -22.730 -11.912 9.229 1.00 0.00 C ATOM 378 SG CYS A 26 -23.604 -12.166 10.790 1.00 0.00 S ATOM 0 H CYS A 26 -20.565 -12.526 11.269 1.00 0.00 H new ATOM 0 HA CYS A 26 -20.725 -11.522 8.564 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -23.179 -11.085 8.679 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -22.820 -12.799 8.601 1.00 0.00 H new ATOM 0 HG CYS A 26 -24.857 -12.416 10.550 1.00 0.00 H new ATOM 384 N ILE A 27 -21.372 -9.195 9.585 1.00 0.00 N ATOM 385 CA ILE A 27 -21.284 -7.878 10.221 1.00 0.00 C ATOM 386 C ILE A 27 -22.675 -7.284 10.355 1.00 0.00 C ATOM 387 O ILE A 27 -23.303 -6.939 9.362 1.00 0.00 O ATOM 388 CB ILE A 27 -20.416 -6.951 9.374 1.00 0.00 C ATOM 389 CG1 ILE A 27 -19.075 -7.636 9.087 1.00 0.00 C ATOM 390 CG2 ILE A 27 -20.164 -5.651 10.139 1.00 0.00 C ATOM 391 CD1 ILE A 27 -18.277 -6.808 8.077 1.00 0.00 C ATOM 0 H ILE A 27 -21.622 -9.175 8.596 1.00 0.00 H new ATOM 0 HA ILE A 27 -20.837 -7.987 11.209 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.925 -6.730 8.436 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -18.507 -7.746 10.011 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -19.245 -8.639 8.696 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.544 -4.988 9.535 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.116 -5.164 10.352 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -19.652 -5.873 11.075 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -17.325 -7.299 7.876 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.843 -6.721 7.150 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -18.094 -5.814 8.485 1.00 0.00 H new ATOM 403 N THR A 28 -23.144 -7.168 11.591 1.00 0.00 N ATOM 404 CA THR A 28 -24.477 -6.617 11.852 1.00 0.00 C ATOM 405 C THR A 28 -24.458 -5.090 11.803 1.00 0.00 C ATOM 406 O THR A 28 -23.481 -4.482 11.360 1.00 0.00 O ATOM 407 CB THR A 28 -24.989 -7.103 13.230 1.00 0.00 C ATOM 408 OG1 THR A 28 -24.279 -8.273 13.598 1.00 0.00 O ATOM 409 CG2 THR A 28 -26.490 -7.418 13.161 1.00 0.00 C ATOM 0 H THR A 28 -22.629 -7.445 12.427 1.00 0.00 H new ATOM 0 HA THR A 28 -25.153 -6.971 11.074 1.00 0.00 H new ATOM 0 HB THR A 28 -24.829 -6.318 13.969 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.596 -8.587 14.471 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.836 -7.758 14.137 1.00 0.00 H new ATOM 0 HG22 THR A 28 -27.037 -6.520 12.875 1.00 0.00 H new ATOM 0 HG23 THR A 28 -26.664 -8.200 12.422 1.00 0.00 H new ATOM 417 N VAL A 29 -25.548 -4.482 12.265 1.00 0.00 N ATOM 418 CA VAL A 29 -25.650 -3.031 12.282 1.00 0.00 C ATOM 419 C VAL A 29 -24.929 -2.462 13.499 1.00 0.00 C ATOM 420 O VAL A 29 -24.115 -1.546 13.379 1.00 0.00 O ATOM 421 CB VAL A 29 -27.119 -2.613 12.304 1.00 0.00 C ATOM 422 CG1 VAL A 29 -27.214 -1.089 12.334 1.00 0.00 C ATOM 423 CG2 VAL A 29 -27.815 -3.139 11.046 1.00 0.00 C ATOM 0 H VAL A 29 -26.366 -4.970 12.629 1.00 0.00 H new ATOM 0 HA VAL A 29 -25.179 -2.637 11.381 1.00 0.00 H new ATOM 0 HB VAL A 29 -27.602 -3.026 13.190 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -28.262 -0.790 12.350 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -26.715 -0.711 13.226 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -26.732 -0.677 11.447 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -28.864 -2.842 11.059 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -27.331 -2.724 10.162 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -27.746 -4.227 11.020 1.00 0.00 H new ATOM 433 N GLU A 30 -25.232 -3.007 14.675 1.00 0.00 N ATOM 434 CA GLU A 30 -24.606 -2.535 15.903 1.00 0.00 C ATOM 435 C GLU A 30 -23.097 -2.758 15.844 1.00 0.00 C ATOM 436 O GLU A 30 -22.315 -1.870 16.184 1.00 0.00 O ATOM 437 CB GLU A 30 -25.192 -3.282 17.107 1.00 0.00 C ATOM 438 CG GLU A 30 -24.702 -2.636 18.408 1.00 0.00 C ATOM 439 CD GLU A 30 -25.371 -1.278 18.595 1.00 0.00 C ATOM 440 OE1 GLU A 30 -26.247 -0.956 17.808 1.00 0.00 O ATOM 441 OE2 GLU A 30 -24.998 -0.579 19.523 1.00 0.00 O ATOM 0 H GLU A 30 -25.900 -3.767 14.801 1.00 0.00 H new ATOM 0 HA GLU A 30 -24.803 -1.468 16.010 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -26.281 -3.258 17.066 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -24.894 -4.330 17.076 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -24.930 -3.284 19.255 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -23.619 -2.517 18.380 1.00 0.00 H new ATOM 448 N GLU A 31 -22.700 -3.942 15.397 1.00 0.00 N ATOM 449 CA GLU A 31 -21.282 -4.268 15.292 1.00 0.00 C ATOM 450 C GLU A 31 -20.570 -3.200 14.470 1.00 0.00 C ATOM 451 O GLU A 31 -19.522 -2.689 14.871 1.00 0.00 O ATOM 452 CB GLU A 31 -21.114 -5.635 14.628 1.00 0.00 C ATOM 453 CG GLU A 31 -21.629 -6.726 15.569 1.00 0.00 C ATOM 454 CD GLU A 31 -21.618 -8.069 14.852 1.00 0.00 C ATOM 455 OE1 GLU A 31 -21.413 -8.070 13.652 1.00 0.00 O ATOM 456 OE2 GLU A 31 -21.823 -9.079 15.508 1.00 0.00 O ATOM 0 H GLU A 31 -23.332 -4.687 15.104 1.00 0.00 H new ATOM 0 HA GLU A 31 -20.845 -4.301 16.290 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.662 -5.664 13.686 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -20.064 -5.810 14.391 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -21.005 -6.774 16.461 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -22.640 -6.487 15.899 1.00 0.00 H new ATOM 463 N LEU A 32 -21.147 -2.866 13.326 1.00 0.00 N ATOM 464 CA LEU A 32 -20.563 -1.855 12.463 1.00 0.00 C ATOM 465 C LEU A 32 -20.508 -0.510 13.178 1.00 0.00 C ATOM 466 O LEU A 32 -19.520 0.214 13.081 1.00 0.00 O ATOM 467 CB LEU A 32 -21.392 -1.720 11.180 1.00 0.00 C ATOM 468 CG LEU A 32 -20.550 -1.039 10.074 1.00 0.00 C ATOM 469 CD1 LEU A 32 -19.718 -2.088 9.320 1.00 0.00 C ATOM 470 CD2 LEU A 32 -21.476 -0.315 9.088 1.00 0.00 C ATOM 0 H LEU A 32 -22.013 -3.277 12.977 1.00 0.00 H new ATOM 0 HA LEU A 32 -19.548 -2.162 12.209 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -21.721 -2.704 10.844 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -22.290 -1.134 11.377 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.878 -0.317 10.538 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -19.130 -1.597 8.545 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -19.050 -2.592 10.018 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -20.384 -2.820 8.862 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -20.879 0.163 8.312 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -22.156 -1.035 8.632 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -22.053 0.442 9.619 1.00 0.00 H new ATOM 482 N ALA A 33 -21.576 -0.184 13.889 1.00 0.00 N ATOM 483 CA ALA A 33 -21.638 1.083 14.610 1.00 0.00 C ATOM 484 C ALA A 33 -20.455 1.208 15.567 1.00 0.00 C ATOM 485 O ALA A 33 -19.743 2.213 15.562 1.00 0.00 O ATOM 486 CB ALA A 33 -22.947 1.167 15.397 1.00 0.00 C ATOM 0 H ALA A 33 -22.405 -0.771 13.984 1.00 0.00 H new ATOM 0 HA ALA A 33 -21.595 1.899 13.888 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -22.989 2.115 15.934 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -23.790 1.102 14.709 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -22.996 0.344 16.110 1.00 0.00 H new ATOM 492 N THR A 34 -20.257 0.190 16.397 1.00 0.00 N ATOM 493 CA THR A 34 -19.165 0.214 17.363 1.00 0.00 C ATOM 494 C THR A 34 -17.834 0.431 16.644 1.00 0.00 C ATOM 495 O THR A 34 -17.034 1.288 17.037 1.00 0.00 O ATOM 496 CB THR A 34 -19.122 -1.116 18.123 1.00 0.00 C ATOM 497 OG1 THR A 34 -20.332 -1.290 18.849 1.00 0.00 O ATOM 498 CG2 THR A 34 -17.939 -1.117 19.091 1.00 0.00 C ATOM 0 H THR A 34 -20.831 -0.653 16.421 1.00 0.00 H new ATOM 0 HA THR A 34 -19.330 1.032 18.065 1.00 0.00 H new ATOM 0 HB THR A 34 -19.007 -1.934 17.412 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.304 -2.142 19.333 1.00 0.00 H new ATOM 0 HG21 THR A 34 -17.911 -2.064 19.630 1.00 0.00 H new ATOM 0 HG22 THR A 34 -17.012 -0.990 18.532 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.050 -0.298 19.802 1.00 0.00 H new ATOM 506 N VAL A 35 -17.610 -0.334 15.578 1.00 0.00 N ATOM 507 CA VAL A 35 -16.383 -0.205 14.807 1.00 0.00 C ATOM 508 C VAL A 35 -16.284 1.193 14.210 1.00 0.00 C ATOM 509 O VAL A 35 -15.230 1.828 14.262 1.00 0.00 O ATOM 510 CB VAL A 35 -16.357 -1.253 13.693 1.00 0.00 C ATOM 511 CG1 VAL A 35 -15.139 -1.014 12.790 1.00 0.00 C ATOM 512 CG2 VAL A 35 -16.271 -2.655 14.309 1.00 0.00 C ATOM 0 H VAL A 35 -18.258 -1.043 15.233 1.00 0.00 H new ATOM 0 HA VAL A 35 -15.531 -0.366 15.467 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.268 -1.173 13.100 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.122 -1.761 11.997 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.202 -0.019 12.350 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.227 -1.092 13.381 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.253 -3.401 13.514 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -15.361 -2.736 14.904 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.138 -2.826 14.947 1.00 0.00 H new ATOM 522 N ILE A 36 -17.395 1.678 13.661 1.00 0.00 N ATOM 523 CA ILE A 36 -17.423 3.010 13.075 1.00 0.00 C ATOM 524 C ILE A 36 -17.136 4.059 14.140 1.00 0.00 C ATOM 525 O ILE A 36 -16.384 5.004 13.907 1.00 0.00 O ATOM 526 CB ILE A 36 -18.783 3.279 12.431 1.00 0.00 C ATOM 527 CG1 ILE A 36 -18.920 2.432 11.157 1.00 0.00 C ATOM 528 CG2 ILE A 36 -18.913 4.769 12.074 1.00 0.00 C ATOM 529 CD1 ILE A 36 -20.388 2.381 10.732 1.00 0.00 C ATOM 0 H ILE A 36 -18.279 1.172 13.611 1.00 0.00 H new ATOM 0 HA ILE A 36 -16.653 3.067 12.306 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.571 3.013 13.136 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -18.314 2.858 10.358 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.547 1.424 11.337 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -19.885 4.950 11.616 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -18.821 5.369 12.979 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -18.125 5.045 11.374 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.484 1.780 9.828 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -20.982 1.935 11.529 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.745 3.392 10.535 1.00 0.00 H new ATOM 541 N ARG A 37 -17.739 3.891 15.311 1.00 0.00 N ATOM 542 CA ARG A 37 -17.538 4.836 16.396 1.00 0.00 C ATOM 543 C ARG A 37 -16.049 5.051 16.632 1.00 0.00 C ATOM 544 O ARG A 37 -15.559 6.168 16.546 1.00 0.00 O ATOM 545 CB ARG A 37 -18.191 4.302 17.673 1.00 0.00 C ATOM 546 CG ARG A 37 -18.079 5.344 18.789 1.00 0.00 C ATOM 547 CD ARG A 37 -18.710 4.793 20.067 1.00 0.00 C ATOM 548 NE ARG A 37 -20.144 4.605 19.880 1.00 0.00 N ATOM 549 CZ ARG A 37 -20.974 5.644 19.849 1.00 0.00 C ATOM 550 NH1 ARG A 37 -20.508 6.856 19.983 1.00 0.00 N ATOM 551 NH2 ARG A 37 -22.253 5.451 19.680 1.00 0.00 N ATOM 0 H ARG A 37 -18.365 3.116 15.530 1.00 0.00 H new ATOM 0 HA ARG A 37 -17.996 5.788 16.127 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -19.239 4.068 17.486 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -17.707 3.375 17.979 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -17.032 5.592 18.965 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -18.579 6.266 18.492 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -18.243 3.844 20.332 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -18.531 5.479 20.895 1.00 0.00 H new ATOM 0 HE ARG A 37 -20.516 3.662 19.771 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -19.507 7.006 20.111 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -21.145 7.653 19.959 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -22.616 4.504 19.572 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -22.890 6.247 19.656 1.00 0.00 H new ATOM 565 N SER A 38 -15.339 3.973 16.911 1.00 0.00 N ATOM 566 CA SER A 38 -13.896 4.066 17.138 1.00 0.00 C ATOM 567 C SER A 38 -13.197 4.563 15.875 1.00 0.00 C ATOM 568 O SER A 38 -12.273 5.377 15.940 1.00 0.00 O ATOM 569 CB SER A 38 -13.337 2.705 17.540 1.00 0.00 C ATOM 570 OG SER A 38 -11.923 2.714 17.382 1.00 0.00 O ATOM 0 H SER A 38 -15.725 3.032 16.987 1.00 0.00 H new ATOM 0 HA SER A 38 -13.714 4.775 17.946 1.00 0.00 H new ATOM 0 HB2 SER A 38 -13.598 2.483 18.575 1.00 0.00 H new ATOM 0 HB3 SER A 38 -13.779 1.921 16.925 1.00 0.00 H new ATOM 0 HG SER A 38 -11.559 1.842 17.641 1.00 0.00 H new ATOM 576 N LEU A 39 -13.641 4.064 14.729 1.00 0.00 N ATOM 577 CA LEU A 39 -13.051 4.461 13.453 1.00 0.00 C ATOM 578 C LEU A 39 -13.561 5.848 13.048 1.00 0.00 C ATOM 579 O LEU A 39 -13.139 6.431 12.054 1.00 0.00 O ATOM 580 CB LEU A 39 -13.413 3.428 12.370 1.00 0.00 C ATOM 581 CG LEU A 39 -12.945 3.903 10.983 1.00 0.00 C ATOM 582 CD1 LEU A 39 -11.438 4.197 11.019 1.00 0.00 C ATOM 583 CD2 LEU A 39 -13.236 2.825 9.941 1.00 0.00 C ATOM 0 H LEU A 39 -14.402 3.389 14.654 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.967 4.503 13.558 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -12.951 2.470 12.606 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -14.491 3.268 12.360 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.483 4.813 10.715 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.109 4.533 10.036 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.237 4.976 11.755 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.897 3.291 11.292 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.903 3.167 8.961 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -12.706 1.910 10.206 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -14.308 2.628 9.911 1.00 0.00 H new ATOM 595 N ASP A 40 -14.456 6.395 13.835 1.00 0.00 N ATOM 596 CA ASP A 40 -14.999 7.712 13.525 1.00 0.00 C ATOM 597 C ASP A 40 -15.567 8.363 14.774 1.00 0.00 C ATOM 598 O ASP A 40 -14.993 8.253 15.853 1.00 0.00 O ATOM 599 CB ASP A 40 -16.099 7.565 12.464 1.00 0.00 C ATOM 600 CG ASP A 40 -16.387 8.911 11.812 1.00 0.00 C ATOM 601 OD1 ASP A 40 -16.008 9.917 12.389 1.00 0.00 O ATOM 602 OD2 ASP A 40 -16.984 8.920 10.749 1.00 0.00 O ATOM 0 H ASP A 40 -14.824 5.964 14.683 1.00 0.00 H new ATOM 0 HA ASP A 40 -14.200 8.347 13.142 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.789 6.845 11.706 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -17.007 7.174 12.923 1.00 0.00 H new ATOM 607 N GLN A 41 -16.694 9.050 14.618 1.00 0.00 N ATOM 608 CA GLN A 41 -17.340 9.722 15.746 1.00 0.00 C ATOM 609 C GLN A 41 -18.613 8.989 16.157 1.00 0.00 C ATOM 610 O GLN A 41 -18.598 8.136 17.043 1.00 0.00 O ATOM 611 CB GLN A 41 -17.677 11.164 15.368 1.00 0.00 C ATOM 612 CG GLN A 41 -16.385 11.964 15.180 1.00 0.00 C ATOM 613 CD GLN A 41 -15.666 12.120 16.517 1.00 0.00 C ATOM 614 OE1 GLN A 41 -16.255 12.598 17.486 1.00 0.00 O ATOM 615 NE2 GLN A 41 -14.422 11.740 16.629 1.00 0.00 N ATOM 0 H GLN A 41 -17.179 9.157 13.727 1.00 0.00 H new ATOM 0 HA GLN A 41 -16.649 9.718 16.589 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -18.264 11.182 14.450 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -18.289 11.621 16.146 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -15.735 11.458 14.466 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -16.613 12.945 14.764 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.935 11.344 15.825 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -13.937 11.839 17.521 1.00 0.00 H new ATOM 624 N ASN A 42 -19.717 9.336 15.511 1.00 0.00 N ATOM 625 CA ASN A 42 -20.998 8.709 15.823 1.00 0.00 C ATOM 626 C ASN A 42 -22.046 9.068 14.773 1.00 0.00 C ATOM 627 O ASN A 42 -23.049 9.714 15.078 1.00 0.00 O ATOM 628 CB ASN A 42 -21.473 9.159 17.200 1.00 0.00 C ATOM 629 CG ASN A 42 -22.619 8.267 17.668 1.00 0.00 C ATOM 630 OD1 ASN A 42 -22.578 6.981 17.431 1.00 0.00 O flip ATOM 631 ND2 ASN A 42 -23.578 8.751 18.268 1.00 0.00 N flip ATOM 0 H ASN A 42 -19.755 10.041 14.775 1.00 0.00 H new ATOM 0 HA ASN A 42 -20.862 7.628 15.821 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -20.649 9.112 17.912 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -21.801 10.198 17.160 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -23.611 9.754 18.453 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -24.340 8.150 18.580 1.00 0.00 H new ATOM 638 N PRO A 43 -21.834 8.665 13.546 1.00 0.00 N ATOM 639 CA PRO A 43 -22.785 8.953 12.428 1.00 0.00 C ATOM 640 C PRO A 43 -24.129 8.262 12.640 1.00 0.00 C ATOM 641 O PRO A 43 -24.184 7.121 13.098 1.00 0.00 O ATOM 642 CB PRO A 43 -22.053 8.407 11.179 1.00 0.00 C ATOM 643 CG PRO A 43 -21.087 7.395 11.711 1.00 0.00 C ATOM 644 CD PRO A 43 -20.668 7.891 13.086 1.00 0.00 C ATOM 0 HA PRO A 43 -23.027 10.012 12.344 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -22.753 7.954 10.477 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -21.536 9.204 10.644 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -21.551 6.411 11.777 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -20.224 7.297 11.053 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -20.445 7.064 13.760 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -19.772 8.509 13.033 1.00 0.00 H new ATOM 652 N THR A 44 -25.208 8.959 12.307 1.00 0.00 N ATOM 653 CA THR A 44 -26.543 8.401 12.468 1.00 0.00 C ATOM 654 C THR A 44 -26.638 7.022 11.819 1.00 0.00 C ATOM 655 O THR A 44 -26.195 6.817 10.687 1.00 0.00 O ATOM 656 CB THR A 44 -27.574 9.336 11.831 1.00 0.00 C ATOM 657 OG1 THR A 44 -28.866 8.757 11.942 1.00 0.00 O ATOM 658 CG2 THR A 44 -27.234 9.546 10.353 1.00 0.00 C ATOM 0 H THR A 44 -25.185 9.905 11.926 1.00 0.00 H new ATOM 0 HA THR A 44 -26.746 8.299 13.534 1.00 0.00 H new ATOM 0 HB THR A 44 -27.559 10.297 12.345 1.00 0.00 H new ATOM 0 HG1 THR A 44 -29.528 9.355 11.536 1.00 0.00 H new ATOM 0 HG21 THR A 44 -27.969 10.212 9.902 1.00 0.00 H new ATOM 0 HG22 THR A 44 -26.242 9.989 10.267 1.00 0.00 H new ATOM 0 HG23 THR A 44 -27.248 8.586 9.836 1.00 0.00 H new ATOM 666 N GLU A 45 -27.218 6.080 12.550 1.00 0.00 N ATOM 667 CA GLU A 45 -27.370 4.722 12.040 1.00 0.00 C ATOM 668 C GLU A 45 -28.034 4.740 10.670 1.00 0.00 C ATOM 669 O GLU A 45 -27.936 3.779 9.909 1.00 0.00 O ATOM 670 CB GLU A 45 -28.209 3.888 13.010 1.00 0.00 C ATOM 671 CG GLU A 45 -29.537 4.600 13.273 1.00 0.00 C ATOM 672 CD GLU A 45 -30.361 3.809 14.282 1.00 0.00 C ATOM 673 OE1 GLU A 45 -29.780 3.308 15.230 1.00 0.00 O ATOM 674 OE2 GLU A 45 -31.562 3.718 14.092 1.00 0.00 O ATOM 0 H GLU A 45 -27.588 6.227 13.489 1.00 0.00 H new ATOM 0 HA GLU A 45 -26.380 4.275 11.946 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -28.391 2.898 12.592 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -27.669 3.745 13.946 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -29.352 5.605 13.651 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -30.093 4.707 12.341 1.00 0.00 H new ATOM 681 N GLU A 46 -28.708 5.839 10.360 1.00 0.00 N ATOM 682 CA GLU A 46 -29.382 5.963 9.076 1.00 0.00 C ATOM 683 C GLU A 46 -28.379 5.888 7.931 1.00 0.00 C ATOM 684 O GLU A 46 -28.607 5.195 6.944 1.00 0.00 O ATOM 685 CB GLU A 46 -30.143 7.297 9.013 1.00 0.00 C ATOM 686 CG GLU A 46 -31.177 7.261 7.883 1.00 0.00 C ATOM 687 CD GLU A 46 -30.468 7.270 6.532 1.00 0.00 C ATOM 688 OE1 GLU A 46 -29.414 7.881 6.443 1.00 0.00 O ATOM 689 OE2 GLU A 46 -30.985 6.664 5.609 1.00 0.00 O ATOM 0 H GLU A 46 -28.802 6.649 10.973 1.00 0.00 H new ATOM 0 HA GLU A 46 -30.087 5.138 8.975 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -30.639 7.487 9.965 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -29.443 8.116 8.850 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -31.796 6.369 7.973 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -31.843 8.120 7.960 1.00 0.00 H new ATOM 696 N GLU A 47 -27.270 6.599 8.072 1.00 0.00 N ATOM 697 CA GLU A 47 -26.243 6.599 7.041 1.00 0.00 C ATOM 698 C GLU A 47 -25.589 5.218 6.937 1.00 0.00 C ATOM 699 O GLU A 47 -25.165 4.784 5.855 1.00 0.00 O ATOM 700 CB GLU A 47 -25.179 7.657 7.373 1.00 0.00 C ATOM 701 CG GLU A 47 -24.167 7.743 6.232 1.00 0.00 C ATOM 702 CD GLU A 47 -23.120 8.808 6.536 1.00 0.00 C ATOM 703 OE1 GLU A 47 -23.044 9.228 7.678 1.00 0.00 O ATOM 704 OE2 GLU A 47 -22.403 9.183 5.621 1.00 0.00 O ATOM 0 H GLU A 47 -27.059 7.179 8.884 1.00 0.00 H new ATOM 0 HA GLU A 47 -26.705 6.837 6.083 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -25.652 8.627 7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -24.672 7.398 8.303 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -23.683 6.776 6.092 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -24.679 7.981 5.300 1.00 0.00 H new ATOM 711 N LEU A 48 -25.536 4.517 8.067 1.00 0.00 N ATOM 712 CA LEU A 48 -24.952 3.185 8.102 1.00 0.00 C ATOM 713 C LEU A 48 -25.896 2.160 7.490 1.00 0.00 C ATOM 714 O LEU A 48 -25.482 1.331 6.679 1.00 0.00 O ATOM 715 CB LEU A 48 -24.631 2.805 9.549 1.00 0.00 C ATOM 716 CG LEU A 48 -23.928 3.979 10.246 1.00 0.00 C ATOM 717 CD1 LEU A 48 -23.438 3.538 11.632 1.00 0.00 C ATOM 718 CD2 LEU A 48 -22.739 4.457 9.401 1.00 0.00 C ATOM 0 H LEU A 48 -25.889 4.850 8.964 1.00 0.00 H new ATOM 0 HA LEU A 48 -24.034 3.192 7.515 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -25.548 2.550 10.080 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -23.993 1.921 9.571 1.00 0.00 H new ATOM 0 HG LEU A 48 -24.634 4.801 10.359 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -22.940 4.373 12.124 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -24.289 3.217 12.234 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -22.737 2.710 11.524 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -22.247 5.290 9.904 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -22.030 3.639 9.275 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -23.095 4.782 8.423 1.00 0.00 H new ATOM 730 N GLN A 49 -27.166 2.231 7.871 1.00 0.00 N ATOM 731 CA GLN A 49 -28.161 1.312 7.346 1.00 0.00 C ATOM 732 C GLN A 49 -28.413 1.600 5.872 1.00 0.00 C ATOM 733 O GLN A 49 -28.832 0.721 5.120 1.00 0.00 O ATOM 734 CB GLN A 49 -29.470 1.449 8.126 1.00 0.00 C ATOM 735 CG GLN A 49 -29.277 0.921 9.552 1.00 0.00 C ATOM 736 CD GLN A 49 -30.592 1.001 10.322 1.00 0.00 C ATOM 737 OE1 GLN A 49 -30.613 1.553 11.503 1.00 0.00 O flip ATOM 738 NE2 GLN A 49 -31.627 0.549 9.833 1.00 0.00 N flip ATOM 0 H GLN A 49 -27.527 2.913 8.538 1.00 0.00 H new ATOM 0 HA GLN A 49 -27.786 0.294 7.454 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -29.781 2.493 8.153 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -30.263 0.893 7.626 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -28.926 -0.111 9.522 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -28.511 1.504 10.063 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -31.608 0.118 8.909 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -32.503 0.606 10.352 1.00 0.00 H new ATOM 747 N ASP A 50 -28.126 2.831 5.459 1.00 0.00 N ATOM 748 CA ASP A 50 -28.313 3.211 4.065 1.00 0.00 C ATOM 749 C ASP A 50 -27.313 2.490 3.176 1.00 0.00 C ATOM 750 O ASP A 50 -27.697 1.775 2.249 1.00 0.00 O ATOM 751 CB ASP A 50 -28.138 4.719 3.906 1.00 0.00 C ATOM 752 CG ASP A 50 -28.494 5.147 2.487 1.00 0.00 C ATOM 753 OD1 ASP A 50 -29.523 4.710 1.998 1.00 0.00 O ATOM 754 OD2 ASP A 50 -27.736 5.911 1.911 1.00 0.00 O ATOM 0 H ASP A 50 -27.768 3.572 6.061 1.00 0.00 H new ATOM 0 HA ASP A 50 -29.322 2.928 3.765 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -28.773 5.243 4.621 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -27.108 4.998 4.130 1.00 0.00 H new ATOM 759 N MET A 51 -26.027 2.664 3.467 1.00 0.00 N ATOM 760 CA MET A 51 -24.994 2.005 2.674 1.00 0.00 C ATOM 761 C MET A 51 -25.055 0.493 2.860 1.00 0.00 C ATOM 762 O MET A 51 -24.839 -0.273 1.921 1.00 0.00 O ATOM 763 CB MET A 51 -23.616 2.528 3.074 1.00 0.00 C ATOM 764 CG MET A 51 -22.503 1.758 2.311 1.00 0.00 C ATOM 765 SD MET A 51 -21.687 0.591 3.429 1.00 0.00 S ATOM 766 CE MET A 51 -20.581 1.783 4.224 1.00 0.00 C ATOM 0 H MET A 51 -25.680 3.244 4.231 1.00 0.00 H new ATOM 0 HA MET A 51 -25.169 2.229 1.622 1.00 0.00 H new ATOM 0 HB2 MET A 51 -23.546 3.593 2.854 1.00 0.00 H new ATOM 0 HB3 MET A 51 -23.475 2.414 4.149 1.00 0.00 H new ATOM 0 HG2 MET A 51 -22.933 1.224 1.464 1.00 0.00 H new ATOM 0 HG3 MET A 51 -21.773 2.460 1.908 1.00 0.00 H new ATOM 0 HE1 MET A 51 -20.336 1.438 5.229 1.00 0.00 H new ATOM 0 HE2 MET A 51 -19.666 1.877 3.639 1.00 0.00 H new ATOM 0 HE3 MET A 51 -21.074 2.753 4.284 1.00 0.00 H new ATOM 776 N ILE A 52 -25.345 0.074 4.086 1.00 0.00 N ATOM 777 CA ILE A 52 -25.426 -1.343 4.399 1.00 0.00 C ATOM 778 C ILE A 52 -26.675 -1.953 3.801 1.00 0.00 C ATOM 779 O ILE A 52 -26.803 -3.168 3.741 1.00 0.00 O ATOM 780 CB ILE A 52 -25.433 -1.555 5.915 1.00 0.00 C ATOM 781 CG1 ILE A 52 -24.094 -1.087 6.519 1.00 0.00 C ATOM 782 CG2 ILE A 52 -25.663 -3.041 6.232 1.00 0.00 C ATOM 783 CD1 ILE A 52 -23.029 -2.190 6.409 1.00 0.00 C ATOM 0 H ILE A 52 -25.527 0.694 4.875 1.00 0.00 H new ATOM 0 HA ILE A 52 -24.552 -1.832 3.970 1.00 0.00 H new ATOM 0 HB ILE A 52 -26.241 -0.969 6.353 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -23.750 -0.191 6.002 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -24.237 -0.816 7.565 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -25.667 -3.186 7.312 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -26.621 -3.357 5.820 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -24.864 -3.635 5.789 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -22.093 -1.837 6.842 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -23.366 -3.076 6.947 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -22.872 -2.441 5.360 1.00 0.00 H new ATOM 795 N SER A 53 -27.586 -1.104 3.356 1.00 0.00 N ATOM 796 CA SER A 53 -28.832 -1.573 2.741 1.00 0.00 C ATOM 797 C SER A 53 -28.684 -1.703 1.227 1.00 0.00 C ATOM 798 O SER A 53 -29.250 -2.613 0.615 1.00 0.00 O ATOM 799 CB SER A 53 -29.959 -0.600 3.049 1.00 0.00 C ATOM 800 OG SER A 53 -31.041 -0.838 2.160 1.00 0.00 O ATOM 0 H SER A 53 -27.494 -0.089 3.405 1.00 0.00 H new ATOM 0 HA SER A 53 -29.062 -2.554 3.156 1.00 0.00 H new ATOM 0 HB2 SER A 53 -30.288 -0.722 4.081 1.00 0.00 H new ATOM 0 HB3 SER A 53 -29.607 0.426 2.945 1.00 0.00 H new ATOM 0 HG SER A 53 -31.770 -0.213 2.357 1.00 0.00 H new ATOM 806 N GLU A 54 -27.926 -0.792 0.630 1.00 0.00 N ATOM 807 CA GLU A 54 -27.724 -0.816 -0.821 1.00 0.00 C ATOM 808 C GLU A 54 -26.997 -2.083 -1.260 1.00 0.00 C ATOM 809 O GLU A 54 -27.320 -2.675 -2.292 1.00 0.00 O ATOM 810 CB GLU A 54 -26.905 0.400 -1.258 1.00 0.00 C ATOM 811 CG GLU A 54 -27.733 1.667 -1.074 1.00 0.00 C ATOM 812 CD GLU A 54 -26.898 2.897 -1.413 1.00 0.00 C ATOM 813 OE1 GLU A 54 -25.733 2.729 -1.732 1.00 0.00 O ATOM 814 OE2 GLU A 54 -27.436 3.991 -1.344 1.00 0.00 O ATOM 0 H GLU A 54 -27.445 -0.035 1.116 1.00 0.00 H new ATOM 0 HA GLU A 54 -28.708 -0.794 -1.290 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -25.989 0.464 -0.671 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -26.609 0.296 -2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -28.615 1.630 -1.714 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -28.088 1.732 -0.045 1.00 0.00 H new ATOM 821 N VAL A 55 -26.012 -2.491 -0.475 1.00 0.00 N ATOM 822 CA VAL A 55 -25.231 -3.689 -0.791 1.00 0.00 C ATOM 823 C VAL A 55 -25.931 -4.946 -0.283 1.00 0.00 C ATOM 824 O VAL A 55 -25.554 -6.064 -0.632 1.00 0.00 O ATOM 825 CB VAL A 55 -23.831 -3.582 -0.178 1.00 0.00 C ATOM 826 CG1 VAL A 55 -22.932 -4.661 -0.769 1.00 0.00 C ATOM 827 CG2 VAL A 55 -23.256 -2.197 -0.475 1.00 0.00 C ATOM 0 H VAL A 55 -25.731 -2.016 0.383 1.00 0.00 H new ATOM 0 HA VAL A 55 -25.142 -3.762 -1.875 1.00 0.00 H new ATOM 0 HB VAL A 55 -23.889 -3.723 0.901 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -21.936 -4.584 -0.332 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -23.350 -5.643 -0.549 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -22.866 -4.528 -1.849 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -22.260 -2.116 -0.041 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -23.195 -2.052 -1.554 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -23.903 -1.434 -0.043 1.00 0.00 H new ATOM 837 N ASP A 56 -26.953 -4.756 0.541 1.00 0.00 N ATOM 838 CA ASP A 56 -27.703 -5.887 1.090 1.00 0.00 C ATOM 839 C ASP A 56 -28.710 -6.408 0.075 1.00 0.00 C ATOM 840 O ASP A 56 -29.796 -5.851 -0.075 1.00 0.00 O ATOM 841 CB ASP A 56 -28.440 -5.463 2.359 1.00 0.00 C ATOM 842 CG ASP A 56 -29.202 -6.641 2.945 1.00 0.00 C ATOM 843 OD1 ASP A 56 -29.235 -7.678 2.307 1.00 0.00 O ATOM 844 OD2 ASP A 56 -29.733 -6.490 4.032 1.00 0.00 O ATOM 0 H ASP A 56 -27.283 -3.840 0.844 1.00 0.00 H new ATOM 0 HA ASP A 56 -26.994 -6.681 1.327 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -27.728 -5.081 3.091 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -29.131 -4.651 2.132 1.00 0.00 H new ATOM 849 N ALA A 57 -28.343 -7.485 -0.609 1.00 0.00 N ATOM 850 CA ALA A 57 -29.224 -8.093 -1.605 1.00 0.00 C ATOM 851 C ALA A 57 -30.154 -9.113 -0.954 1.00 0.00 C ATOM 852 O ALA A 57 -30.922 -9.783 -1.640 1.00 0.00 O ATOM 853 CB ALA A 57 -28.395 -8.783 -2.685 1.00 0.00 C ATOM 0 H ALA A 57 -27.445 -7.956 -0.495 1.00 0.00 H new ATOM 0 HA ALA A 57 -29.826 -7.303 -2.054 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -29.060 -9.233 -3.422 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -27.753 -8.051 -3.174 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -27.779 -9.559 -2.231 1.00 0.00 H new ATOM 859 N ASP A 58 -30.080 -9.223 0.371 1.00 0.00 N ATOM 860 CA ASP A 58 -30.922 -10.164 1.118 1.00 0.00 C ATOM 861 C ASP A 58 -31.626 -9.464 2.266 1.00 0.00 C ATOM 862 O ASP A 58 -32.047 -10.122 3.213 1.00 0.00 O ATOM 863 CB ASP A 58 -30.050 -11.308 1.650 1.00 0.00 C ATOM 864 CG ASP A 58 -28.681 -10.767 2.049 1.00 0.00 C ATOM 865 OD1 ASP A 58 -27.971 -10.308 1.172 1.00 0.00 O ATOM 866 OD2 ASP A 58 -28.364 -10.819 3.223 1.00 0.00 O ATOM 0 H ASP A 58 -29.447 -8.674 0.952 1.00 0.00 H new ATOM 0 HA ASP A 58 -31.685 -10.565 0.450 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -30.531 -11.776 2.509 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -29.939 -12.079 0.887 1.00 0.00 H new ATOM 871 N GLY A 59 -31.761 -8.134 2.176 1.00 0.00 N ATOM 872 CA GLY A 59 -32.427 -7.356 3.229 1.00 0.00 C ATOM 873 C GLY A 59 -32.243 -8.020 4.594 1.00 0.00 C ATOM 874 O GLY A 59 -33.167 -8.052 5.407 1.00 0.00 O ATOM 0 H GLY A 59 -31.421 -7.578 1.391 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -32.020 -6.345 3.253 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -33.490 -7.266 3.004 1.00 0.00 H new ATOM 878 N ASN A 60 -31.040 -8.553 4.832 1.00 0.00 N ATOM 879 CA ASN A 60 -30.747 -9.223 6.093 1.00 0.00 C ATOM 880 C ASN A 60 -30.253 -8.223 7.130 1.00 0.00 C ATOM 881 O ASN A 60 -30.416 -8.439 8.329 1.00 0.00 O ATOM 882 CB ASN A 60 -29.682 -10.303 5.877 1.00 0.00 C ATOM 883 CG ASN A 60 -28.349 -9.660 5.519 1.00 0.00 C ATOM 884 OD1 ASN A 60 -28.292 -8.463 5.248 1.00 0.00 O ATOM 885 ND2 ASN A 60 -27.268 -10.389 5.490 1.00 0.00 N ATOM 0 H ASN A 60 -30.263 -8.532 4.172 1.00 0.00 H new ATOM 0 HA ASN A 60 -31.665 -9.684 6.458 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -29.574 -10.904 6.780 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -29.994 -10.978 5.080 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -26.374 -9.966 5.242 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.317 -11.383 5.715 1.00 0.00 H new ATOM 892 N GLY A 61 -29.645 -7.134 6.662 1.00 0.00 N ATOM 893 CA GLY A 61 -29.116 -6.110 7.561 1.00 0.00 C ATOM 894 C GLY A 61 -27.697 -6.450 7.989 1.00 0.00 C ATOM 895 O GLY A 61 -27.139 -5.803 8.868 1.00 0.00 O ATOM 0 H GLY A 61 -29.507 -6.939 5.670 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -29.128 -5.141 7.063 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -29.755 -6.025 8.440 1.00 0.00 H new ATOM 899 N THR A 62 -27.114 -7.471 7.357 1.00 0.00 N ATOM 900 CA THR A 62 -25.751 -7.885 7.678 1.00 0.00 C ATOM 901 C THR A 62 -24.950 -8.108 6.406 1.00 0.00 C ATOM 902 O THR A 62 -25.515 -8.283 5.324 1.00 0.00 O ATOM 903 CB THR A 62 -25.771 -9.171 8.504 1.00 0.00 C ATOM 904 OG1 THR A 62 -26.137 -10.257 7.666 1.00 0.00 O ATOM 905 CG2 THR A 62 -26.792 -9.046 9.645 1.00 0.00 C ATOM 0 H THR A 62 -27.563 -8.022 6.625 1.00 0.00 H new ATOM 0 HA THR A 62 -25.279 -7.093 8.259 1.00 0.00 H new ATOM 0 HB THR A 62 -24.781 -9.343 8.926 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.345 -10.585 7.191 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.800 -9.967 10.229 1.00 0.00 H new ATOM 0 HG22 THR A 62 -26.518 -8.210 10.289 1.00 0.00 H new ATOM 0 HG23 THR A 62 -27.784 -8.872 9.228 1.00 0.00 H new ATOM 913 N ILE A 63 -23.622 -8.096 6.540 1.00 0.00 N ATOM 914 CA ILE A 63 -22.736 -8.294 5.392 1.00 0.00 C ATOM 915 C ILE A 63 -22.048 -9.649 5.490 1.00 0.00 C ATOM 916 O ILE A 63 -21.501 -10.002 6.535 1.00 0.00 O ATOM 917 CB ILE A 63 -21.672 -7.203 5.356 1.00 0.00 C ATOM 918 CG1 ILE A 63 -22.347 -5.829 5.332 1.00 0.00 C ATOM 919 CG2 ILE A 63 -20.816 -7.356 4.099 1.00 0.00 C ATOM 920 CD1 ILE A 63 -21.296 -4.718 5.508 1.00 0.00 C ATOM 0 H ILE A 63 -23.139 -7.952 7.427 1.00 0.00 H new ATOM 0 HA ILE A 63 -23.336 -8.251 4.483 1.00 0.00 H new ATOM 0 HB ILE A 63 -21.043 -7.292 6.242 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -22.877 -5.692 4.389 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -23.090 -5.767 6.127 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -20.057 -6.574 4.078 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -20.331 -8.332 4.106 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -21.449 -7.271 3.215 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -21.788 -3.746 5.489 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -20.785 -4.848 6.462 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -20.569 -4.773 4.697 1.00 0.00 H new ATOM 932 N GLU A 64 -22.087 -10.401 4.392 1.00 0.00 N ATOM 933 CA GLU A 64 -21.468 -11.728 4.334 1.00 0.00 C ATOM 934 C GLU A 64 -20.207 -11.683 3.486 1.00 0.00 C ATOM 935 O GLU A 64 -20.018 -10.767 2.691 1.00 0.00 O ATOM 936 CB GLU A 64 -22.459 -12.738 3.748 1.00 0.00 C ATOM 937 CG GLU A 64 -23.551 -13.052 4.776 1.00 0.00 C ATOM 938 CD GLU A 64 -24.522 -11.878 4.883 1.00 0.00 C ATOM 939 OE1 GLU A 64 -24.395 -10.951 4.098 1.00 0.00 O ATOM 940 OE2 GLU A 64 -25.376 -11.923 5.751 1.00 0.00 O ATOM 0 H GLU A 64 -22.542 -10.114 3.526 1.00 0.00 H new ATOM 0 HA GLU A 64 -21.199 -12.037 5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -22.907 -12.336 2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -21.937 -13.653 3.468 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -24.089 -13.954 4.483 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -23.100 -13.251 5.748 1.00 0.00 H new ATOM 947 N PHE A 65 -19.342 -12.670 3.674 1.00 0.00 N ATOM 948 CA PHE A 65 -18.084 -12.724 2.934 1.00 0.00 C ATOM 949 C PHE A 65 -18.313 -12.415 1.459 1.00 0.00 C ATOM 950 O PHE A 65 -17.611 -11.596 0.867 1.00 0.00 O ATOM 951 CB PHE A 65 -17.465 -14.115 3.076 1.00 0.00 C ATOM 952 CG PHE A 65 -16.108 -14.131 2.410 1.00 0.00 C ATOM 953 CD1 PHE A 65 -15.022 -13.497 3.026 1.00 0.00 C ATOM 954 CD2 PHE A 65 -15.936 -14.777 1.179 1.00 0.00 C ATOM 955 CE1 PHE A 65 -13.764 -13.510 2.410 1.00 0.00 C ATOM 956 CE2 PHE A 65 -14.679 -14.789 0.564 1.00 0.00 C ATOM 957 CZ PHE A 65 -13.594 -14.155 1.180 1.00 0.00 C ATOM 0 H PHE A 65 -19.484 -13.440 4.327 1.00 0.00 H new ATOM 0 HA PHE A 65 -17.406 -11.976 3.345 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -17.368 -14.376 4.130 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -18.115 -14.862 2.621 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -15.154 -12.999 3.975 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -16.774 -15.266 0.704 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -12.925 -13.022 2.884 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -14.546 -15.287 -0.385 1.00 0.00 H new ATOM 0 HZ PHE A 65 -12.624 -14.164 0.705 1.00 0.00 H new ATOM 967 N ASP A 66 -19.300 -13.070 0.871 1.00 0.00 N ATOM 968 CA ASP A 66 -19.612 -12.851 -0.539 1.00 0.00 C ATOM 969 C ASP A 66 -20.002 -11.394 -0.775 1.00 0.00 C ATOM 970 O ASP A 66 -19.685 -10.810 -1.816 1.00 0.00 O ATOM 971 CB ASP A 66 -20.760 -13.774 -0.967 1.00 0.00 C ATOM 972 CG ASP A 66 -21.921 -13.655 0.012 1.00 0.00 C ATOM 973 OD1 ASP A 66 -21.680 -13.230 1.128 1.00 0.00 O ATOM 974 OD2 ASP A 66 -23.029 -13.995 -0.364 1.00 0.00 O ATOM 0 H ASP A 66 -19.896 -13.752 1.339 1.00 0.00 H new ATOM 0 HA ASP A 66 -18.727 -13.078 -1.134 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -21.093 -13.511 -1.971 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -20.412 -14.806 -1.006 1.00 0.00 H new ATOM 979 N GLU A 67 -20.671 -10.803 0.209 1.00 0.00 N ATOM 980 CA GLU A 67 -21.081 -9.408 0.103 1.00 0.00 C ATOM 981 C GLU A 67 -19.896 -8.479 0.358 1.00 0.00 C ATOM 982 O GLU A 67 -19.706 -7.490 -0.347 1.00 0.00 O ATOM 983 CB GLU A 67 -22.200 -9.114 1.101 1.00 0.00 C ATOM 984 CG GLU A 67 -23.458 -9.885 0.692 1.00 0.00 C ATOM 985 CD GLU A 67 -24.592 -9.594 1.664 1.00 0.00 C ATOM 986 OE1 GLU A 67 -24.419 -8.721 2.496 1.00 0.00 O ATOM 987 OE2 GLU A 67 -25.619 -10.243 1.558 1.00 0.00 O ATOM 0 H GLU A 67 -20.938 -11.262 1.080 1.00 0.00 H new ATOM 0 HA GLU A 67 -21.449 -9.231 -0.908 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -21.892 -9.404 2.106 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -22.408 -8.044 1.127 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -23.754 -9.603 -0.318 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -23.249 -10.955 0.676 1.00 0.00 H new ATOM 994 N PHE A 68 -19.112 -8.800 1.378 1.00 0.00 N ATOM 995 CA PHE A 68 -17.954 -7.991 1.726 1.00 0.00 C ATOM 996 C PHE A 68 -16.970 -7.970 0.565 1.00 0.00 C ATOM 997 O PHE A 68 -16.450 -6.913 0.195 1.00 0.00 O ATOM 998 CB PHE A 68 -17.271 -8.557 2.976 1.00 0.00 C ATOM 999 CG PHE A 68 -16.224 -7.582 3.466 1.00 0.00 C ATOM 1000 CD1 PHE A 68 -16.620 -6.378 4.063 1.00 0.00 C ATOM 1001 CD2 PHE A 68 -14.863 -7.879 3.329 1.00 0.00 C ATOM 1002 CE1 PHE A 68 -15.656 -5.471 4.519 1.00 0.00 C ATOM 1003 CE2 PHE A 68 -13.899 -6.971 3.785 1.00 0.00 C ATOM 1004 CZ PHE A 68 -14.296 -5.768 4.380 1.00 0.00 C ATOM 0 H PHE A 68 -19.257 -9.613 1.977 1.00 0.00 H new ATOM 0 HA PHE A 68 -18.285 -6.973 1.934 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.010 -8.736 3.757 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -16.810 -9.518 2.747 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.670 -6.149 4.172 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -14.556 -8.808 2.872 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.962 -4.542 4.978 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -12.849 -7.199 3.677 1.00 0.00 H new ATOM 0 HZ PHE A 68 -13.552 -5.069 4.732 1.00 0.00 H new ATOM 1014 N LEU A 69 -16.715 -9.144 -0.009 1.00 0.00 N ATOM 1015 CA LEU A 69 -15.785 -9.239 -1.118 1.00 0.00 C ATOM 1016 C LEU A 69 -16.302 -8.424 -2.303 1.00 0.00 C ATOM 1017 O LEU A 69 -15.562 -7.652 -2.919 1.00 0.00 O ATOM 1018 CB LEU A 69 -15.613 -10.718 -1.529 1.00 0.00 C ATOM 1019 CG LEU A 69 -14.223 -10.940 -2.147 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -14.066 -12.409 -2.535 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -14.046 -10.050 -3.385 1.00 0.00 C ATOM 0 H LEU A 69 -17.136 -10.029 0.275 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.819 -8.840 -0.810 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.739 -11.362 -0.658 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.386 -10.996 -2.245 1.00 0.00 H new ATOM 0 HG LEU A 69 -13.460 -10.676 -1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -13.080 -12.566 -2.973 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -14.172 -13.033 -1.648 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -14.833 -12.677 -3.261 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -13.058 -10.216 -3.814 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -14.809 -10.298 -4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -14.146 -9.003 -3.098 1.00 0.00 H new ATOM 1033 N SER A 70 -17.580 -8.589 -2.611 1.00 0.00 N ATOM 1034 CA SER A 70 -18.176 -7.863 -3.723 1.00 0.00 C ATOM 1035 C SER A 70 -18.089 -6.354 -3.495 1.00 0.00 C ATOM 1036 O SER A 70 -17.794 -5.580 -4.419 1.00 0.00 O ATOM 1037 CB SER A 70 -19.640 -8.270 -3.884 1.00 0.00 C ATOM 1038 OG SER A 70 -20.200 -7.584 -4.996 1.00 0.00 O ATOM 0 H SER A 70 -18.218 -9.211 -2.114 1.00 0.00 H new ATOM 0 HA SER A 70 -17.624 -8.112 -4.629 1.00 0.00 H new ATOM 0 HB2 SER A 70 -19.716 -9.347 -4.031 1.00 0.00 H new ATOM 0 HB3 SER A 70 -20.197 -8.032 -2.978 1.00 0.00 H new ATOM 0 HG SER A 70 -21.139 -7.845 -5.102 1.00 0.00 H new ATOM 1044 N LEU A 71 -18.350 -5.940 -2.256 1.00 0.00 N ATOM 1045 CA LEU A 71 -18.314 -4.526 -1.924 1.00 0.00 C ATOM 1046 C LEU A 71 -16.950 -3.931 -2.269 1.00 0.00 C ATOM 1047 O LEU A 71 -16.858 -2.931 -2.981 1.00 0.00 O ATOM 1048 CB LEU A 71 -18.584 -4.334 -0.426 1.00 0.00 C ATOM 1049 CG LEU A 71 -18.420 -2.851 -0.046 1.00 0.00 C ATOM 1050 CD1 LEU A 71 -19.334 -1.982 -0.927 1.00 0.00 C ATOM 1051 CD2 LEU A 71 -18.791 -2.663 1.426 1.00 0.00 C ATOM 0 H LEU A 71 -18.585 -6.557 -1.479 1.00 0.00 H new ATOM 0 HA LEU A 71 -19.083 -4.016 -2.504 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -19.592 -4.670 -0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -17.895 -4.945 0.157 1.00 0.00 H new ATOM 0 HG LEU A 71 -17.385 -2.549 -0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -19.214 -0.934 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -19.065 -2.117 -1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -20.372 -2.279 -0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -18.676 -1.614 1.699 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -19.826 -2.967 1.582 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -18.136 -3.273 2.047 1.00 0.00 H new ATOM 1063 N MET A 72 -15.892 -4.553 -1.763 1.00 0.00 N ATOM 1064 CA MET A 72 -14.538 -4.074 -2.029 1.00 0.00 C ATOM 1065 C MET A 72 -14.149 -4.330 -3.478 1.00 0.00 C ATOM 1066 O MET A 72 -13.485 -3.512 -4.106 1.00 0.00 O ATOM 1067 CB MET A 72 -13.539 -4.770 -1.089 1.00 0.00 C ATOM 1068 CG MET A 72 -13.520 -4.067 0.271 1.00 0.00 C ATOM 1069 SD MET A 72 -12.683 -2.471 0.096 1.00 0.00 S ATOM 1070 CE MET A 72 -13.233 -1.752 1.659 1.00 0.00 C ATOM 0 H MET A 72 -15.942 -5.382 -1.172 1.00 0.00 H new ATOM 0 HA MET A 72 -14.513 -2.999 -1.849 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.815 -5.817 -0.962 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.542 -4.755 -1.529 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.537 -3.921 0.634 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.005 -4.684 1.007 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.640 -0.865 1.880 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.285 -1.476 1.582 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.107 -2.481 2.459 1.00 0.00 H new ATOM 1080 N ALA A 73 -14.553 -5.477 -4.001 1.00 0.00 N ATOM 1081 CA ALA A 73 -14.221 -5.832 -5.376 1.00 0.00 C ATOM 1082 C ALA A 73 -14.541 -4.679 -6.317 1.00 0.00 C ATOM 1083 O ALA A 73 -13.854 -4.474 -7.316 1.00 0.00 O ATOM 1084 CB ALA A 73 -15.002 -7.071 -5.794 1.00 0.00 C ATOM 0 H ALA A 73 -15.106 -6.174 -3.502 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.153 -6.042 -5.432 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.749 -7.331 -6.822 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.746 -7.902 -5.136 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -16.071 -6.869 -5.723 1.00 0.00 H new ATOM 1090 N LYS A 74 -15.570 -3.917 -5.978 1.00 0.00 N ATOM 1091 CA LYS A 74 -15.948 -2.760 -6.793 1.00 0.00 C ATOM 1092 C LYS A 74 -15.083 -1.555 -6.487 1.00 0.00 C ATOM 1093 O LYS A 74 -14.698 -0.823 -7.395 1.00 0.00 O ATOM 1094 CB LYS A 74 -17.414 -2.416 -6.559 1.00 0.00 C ATOM 1095 CG LYS A 74 -18.306 -3.537 -7.108 1.00 0.00 C ATOM 1096 CD LYS A 74 -19.772 -3.074 -7.120 1.00 0.00 C ATOM 1097 CE LYS A 74 -20.309 -2.967 -5.688 1.00 0.00 C ATOM 1098 NZ LYS A 74 -19.996 -4.219 -4.945 1.00 0.00 N ATOM 0 H LYS A 74 -16.155 -4.071 -5.157 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.796 -3.026 -7.839 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -17.599 -2.280 -5.493 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -17.658 -1.473 -7.048 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -17.991 -3.805 -8.117 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -18.202 -4.431 -6.494 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -19.851 -2.108 -7.618 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -20.378 -3.778 -7.691 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -19.861 -2.111 -5.184 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -21.386 -2.801 -5.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -20.515 -4.227 -4.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -20.280 -5.041 -5.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -18.974 -4.265 -4.756 1.00 0.00 H new ATOM 1112 N LYS A 75 -14.786 -1.351 -5.217 1.00 0.00 N ATOM 1113 CA LYS A 75 -13.965 -0.222 -4.811 1.00 0.00 C ATOM 1114 C LYS A 75 -12.494 -0.611 -4.850 1.00 0.00 C ATOM 1115 O LYS A 75 -12.133 -1.735 -4.547 1.00 0.00 O ATOM 1116 CB LYS A 75 -14.354 0.213 -3.388 1.00 0.00 C ATOM 1117 CG LYS A 75 -15.602 1.102 -3.434 1.00 0.00 C ATOM 1118 CD LYS A 75 -16.775 0.310 -4.016 1.00 0.00 C ATOM 1119 CE LYS A 75 -18.070 1.091 -3.819 1.00 0.00 C ATOM 1120 NZ LYS A 75 -19.205 0.322 -4.402 1.00 0.00 N ATOM 0 H LYS A 75 -15.098 -1.948 -4.451 1.00 0.00 H new ATOM 0 HA LYS A 75 -14.130 0.608 -5.498 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.545 -0.664 -2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -13.529 0.755 -2.926 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -15.848 1.452 -2.432 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.409 1.986 -4.042 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -16.609 0.123 -5.077 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -16.848 -0.662 -3.529 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -18.243 1.268 -2.757 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -17.995 2.068 -4.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -20.051 0.926 -4.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -18.958 0.014 -5.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -19.399 -0.512 -3.811 1.00 0.00 H new ATOM 1134 N VAL A 76 -11.667 0.340 -5.217 1.00 0.00 N ATOM 1135 CA VAL A 76 -10.228 0.142 -5.288 1.00 0.00 C ATOM 1136 C VAL A 76 -9.876 -0.815 -6.421 1.00 0.00 C ATOM 1137 O VAL A 76 -9.010 -1.672 -6.293 1.00 0.00 O ATOM 1138 CB VAL A 76 -9.716 -0.406 -3.954 1.00 0.00 C ATOM 1139 CG1 VAL A 76 -8.187 -0.292 -3.875 1.00 0.00 C ATOM 1140 CG2 VAL A 76 -10.349 0.370 -2.785 1.00 0.00 C ATOM 0 H VAL A 76 -11.969 1.279 -5.477 1.00 0.00 H new ATOM 0 HA VAL A 76 -9.750 1.101 -5.488 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.997 -1.457 -3.886 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.842 -0.687 -2.919 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.737 -0.863 -4.687 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.895 0.755 -3.962 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.978 -0.028 -1.841 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -10.085 1.425 -2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.433 0.264 -2.822 1.00 0.00 H new ATOM 1150 N LYS A 77 -10.564 -0.665 -7.535 1.00 0.00 N ATOM 1151 CA LYS A 77 -10.313 -1.522 -8.684 1.00 0.00 C ATOM 1152 C LYS A 77 -10.805 -0.847 -9.948 1.00 0.00 C ATOM 1153 O LYS A 77 -12.011 -0.719 -10.141 1.00 0.00 O ATOM 1154 CB LYS A 77 -11.034 -2.863 -8.507 1.00 0.00 C ATOM 1155 CG LYS A 77 -10.494 -3.871 -9.524 1.00 0.00 C ATOM 1156 CD LYS A 77 -11.121 -5.242 -9.268 1.00 0.00 C ATOM 1157 CE LYS A 77 -10.562 -6.253 -10.269 1.00 0.00 C ATOM 1158 NZ LYS A 77 -11.157 -7.594 -10.006 1.00 0.00 N ATOM 0 H LYS A 77 -11.294 0.034 -7.672 1.00 0.00 H new ATOM 0 HA LYS A 77 -9.240 -1.699 -8.762 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -10.885 -3.237 -7.494 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.107 -2.732 -8.644 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.722 -3.539 -10.537 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -9.409 -3.936 -9.446 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -10.908 -5.567 -8.250 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.205 -5.181 -9.363 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.789 -5.936 -11.287 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -9.476 -6.302 -10.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -10.777 -8.282 -10.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -10.919 -7.896 -9.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.191 -7.541 -10.108 1.00 0.00 H new ATOM 1172 N ASP A 78 -9.869 -0.422 -10.797 1.00 0.00 N ATOM 1173 CA ASP A 78 -10.211 0.242 -12.055 1.00 0.00 C ATOM 1174 C ASP A 78 -10.610 1.692 -11.801 1.00 0.00 C ATOM 1175 O ASP A 78 -11.292 2.309 -12.617 1.00 0.00 O ATOM 1176 CB ASP A 78 -11.361 -0.497 -12.755 1.00 0.00 C ATOM 1177 CG ASP A 78 -11.171 -2.003 -12.596 1.00 0.00 C ATOM 1178 OD1 ASP A 78 -10.040 -2.449 -12.686 1.00 0.00 O ATOM 1179 OD2 ASP A 78 -12.159 -2.688 -12.386 1.00 0.00 O ATOM 0 H ASP A 78 -8.867 -0.526 -10.636 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.333 0.224 -12.700 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -12.316 -0.193 -12.327 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -11.387 -0.233 -13.812 1.00 0.00 H new ATOM 1184 N THR A 79 -10.179 2.229 -10.663 1.00 0.00 N ATOM 1185 CA THR A 79 -10.501 3.606 -10.313 1.00 0.00 C ATOM 1186 C THR A 79 -9.908 4.572 -11.330 1.00 0.00 C ATOM 1187 O THR A 79 -10.593 5.003 -12.254 1.00 0.00 O ATOM 1188 CB THR A 79 -9.964 3.932 -8.920 1.00 0.00 C ATOM 1189 OG1 THR A 79 -8.556 3.744 -8.902 1.00 0.00 O ATOM 1190 CG2 THR A 79 -10.618 3.013 -7.888 1.00 0.00 C ATOM 0 H THR A 79 -9.611 1.736 -9.974 1.00 0.00 H new ATOM 0 HA THR A 79 -11.585 3.716 -10.317 1.00 0.00 H new ATOM 0 HB THR A 79 -10.196 4.968 -8.675 1.00 0.00 H new ATOM 0 HG1 THR A 79 -8.209 3.954 -8.010 1.00 0.00 H new ATOM 0 HG21 THR A 79 -10.233 3.248 -6.896 1.00 0.00 H new ATOM 0 HG22 THR A 79 -11.698 3.160 -7.902 1.00 0.00 H new ATOM 0 HG23 THR A 79 -10.390 1.975 -8.129 1.00 0.00 H new ATOM 1198 N ASP A 80 -8.628 4.908 -11.151 1.00 0.00 N ATOM 1199 CA ASP A 80 -7.950 5.829 -12.056 1.00 0.00 C ATOM 1200 C ASP A 80 -6.469 5.940 -11.692 1.00 0.00 C ATOM 1201 O ASP A 80 -6.090 5.795 -10.527 1.00 0.00 O ATOM 1202 CB ASP A 80 -8.601 7.206 -11.987 1.00 0.00 C ATOM 1203 CG ASP A 80 -7.935 8.150 -12.973 1.00 0.00 C ATOM 1204 OD1 ASP A 80 -7.765 7.757 -14.116 1.00 0.00 O ATOM 1205 OD2 ASP A 80 -7.607 9.253 -12.575 1.00 0.00 O ATOM 0 H ASP A 80 -8.046 4.556 -10.391 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.036 5.442 -13.071 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -9.665 7.125 -12.211 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.518 7.606 -10.976 1.00 0.00 H new ATOM 1210 N ALA A 81 -5.641 6.191 -12.699 1.00 0.00 N ATOM 1211 CA ALA A 81 -4.204 6.316 -12.477 1.00 0.00 C ATOM 1212 C ALA A 81 -3.888 7.579 -11.678 1.00 0.00 C ATOM 1213 O ALA A 81 -3.242 7.521 -10.634 1.00 0.00 O ATOM 1214 CB ALA A 81 -3.469 6.358 -13.820 1.00 0.00 C ATOM 0 H ALA A 81 -5.935 6.311 -13.668 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.868 5.450 -11.907 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.397 6.451 -13.645 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.668 5.440 -14.373 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.818 7.213 -14.399 1.00 0.00 H new ATOM 1220 N GLU A 82 -4.350 8.715 -12.177 1.00 0.00 N ATOM 1221 CA GLU A 82 -4.103 9.986 -11.504 1.00 0.00 C ATOM 1222 C GLU A 82 -4.574 9.927 -10.051 1.00 0.00 C ATOM 1223 O GLU A 82 -4.119 10.699 -9.204 1.00 0.00 O ATOM 1224 CB GLU A 82 -4.847 11.105 -12.239 1.00 0.00 C ATOM 1225 CG GLU A 82 -4.240 11.310 -13.632 1.00 0.00 C ATOM 1226 CD GLU A 82 -2.814 11.837 -13.508 1.00 0.00 C ATOM 1227 OE1 GLU A 82 -2.498 12.394 -12.470 1.00 0.00 O ATOM 1228 OE2 GLU A 82 -2.061 11.681 -14.454 1.00 0.00 O ATOM 0 H GLU A 82 -4.893 8.786 -13.037 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.031 10.185 -11.515 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.904 10.854 -12.327 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.786 12.031 -11.667 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.242 10.368 -14.181 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.848 12.012 -14.203 1.00 0.00 H new ATOM 1235 N GLU A 83 -5.466 8.988 -9.768 1.00 0.00 N ATOM 1236 CA GLU A 83 -5.982 8.823 -8.414 1.00 0.00 C ATOM 1237 C GLU A 83 -4.991 8.073 -7.536 1.00 0.00 C ATOM 1238 O GLU A 83 -4.561 8.579 -6.497 1.00 0.00 O ATOM 1239 CB GLU A 83 -7.316 8.079 -8.451 1.00 0.00 C ATOM 1240 CG GLU A 83 -7.864 7.921 -7.033 1.00 0.00 C ATOM 1241 CD GLU A 83 -9.251 7.293 -7.079 1.00 0.00 C ATOM 1242 OE1 GLU A 83 -9.832 7.261 -8.152 1.00 0.00 O ATOM 1243 OE2 GLU A 83 -9.713 6.853 -6.040 1.00 0.00 O ATOM 0 H GLU A 83 -5.846 8.333 -10.451 1.00 0.00 H new ATOM 0 HA GLU A 83 -6.133 9.813 -7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.030 8.626 -9.067 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.183 7.099 -8.910 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.193 7.298 -6.442 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.912 8.893 -6.542 1.00 0.00 H new ATOM 1250 N GLU A 84 -4.638 6.864 -7.952 1.00 0.00 N ATOM 1251 CA GLU A 84 -3.702 6.050 -7.186 1.00 0.00 C ATOM 1252 C GLU A 84 -2.307 6.663 -7.227 1.00 0.00 C ATOM 1253 O GLU A 84 -1.556 6.590 -6.255 1.00 0.00 O ATOM 1254 CB GLU A 84 -3.663 4.630 -7.749 1.00 0.00 C ATOM 1255 CG GLU A 84 -5.016 3.952 -7.522 1.00 0.00 C ATOM 1256 CD GLU A 84 -5.016 2.565 -8.155 1.00 0.00 C ATOM 1257 OE1 GLU A 84 -4.005 2.199 -8.730 1.00 0.00 O ATOM 1258 OE2 GLU A 84 -6.027 1.890 -8.053 1.00 0.00 O ATOM 0 H GLU A 84 -4.982 6.428 -8.808 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.038 6.015 -6.150 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -3.432 4.656 -8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -2.872 4.057 -7.265 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -5.218 3.873 -6.454 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -5.813 4.558 -7.953 1.00 0.00 H new ATOM 1265 N LEU A 85 -1.969 7.257 -8.364 1.00 0.00 N ATOM 1266 CA LEU A 85 -0.663 7.880 -8.530 1.00 0.00 C ATOM 1267 C LEU A 85 -0.496 9.064 -7.588 1.00 0.00 C ATOM 1268 O LEU A 85 0.562 9.247 -6.966 1.00 0.00 O ATOM 1269 CB LEU A 85 -0.489 8.350 -9.979 1.00 0.00 C ATOM 1270 CG LEU A 85 -0.357 7.129 -10.908 1.00 0.00 C ATOM 1271 CD1 LEU A 85 -0.465 7.585 -12.368 1.00 0.00 C ATOM 1272 CD2 LEU A 85 0.997 6.414 -10.679 1.00 0.00 C ATOM 0 H LEU A 85 -2.577 7.320 -9.180 1.00 0.00 H new ATOM 0 HA LEU A 85 0.098 7.138 -8.290 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.343 8.957 -10.280 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.396 8.981 -10.063 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.160 6.427 -10.683 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.372 6.722 -13.027 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.432 8.062 -12.530 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.332 8.296 -12.587 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.071 5.554 -11.345 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.813 7.106 -10.887 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.061 6.078 -9.644 1.00 0.00 H new ATOM 1284 N LYS A 86 -1.557 9.863 -7.463 1.00 0.00 N ATOM 1285 CA LYS A 86 -1.512 11.016 -6.586 1.00 0.00 C ATOM 1286 C LYS A 86 -1.752 10.617 -5.137 1.00 0.00 C ATOM 1287 O LYS A 86 -1.119 11.143 -4.222 1.00 0.00 O ATOM 1288 CB LYS A 86 -2.570 12.026 -7.025 1.00 0.00 C ATOM 1289 CG LYS A 86 -2.236 13.413 -6.437 1.00 0.00 C ATOM 1290 CD LYS A 86 -1.290 14.172 -7.393 1.00 0.00 C ATOM 1291 CE LYS A 86 -2.116 14.935 -8.433 1.00 0.00 C ATOM 1292 NZ LYS A 86 -2.673 16.164 -7.803 1.00 0.00 N ATOM 0 H LYS A 86 -2.442 9.730 -7.953 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.520 11.462 -6.653 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.606 12.080 -8.113 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.556 11.705 -6.689 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -3.152 13.985 -6.287 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.767 13.300 -5.460 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -0.666 14.865 -6.829 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.619 13.471 -7.890 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.494 15.199 -9.288 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.923 14.306 -8.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.642 16.321 -8.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.685 16.049 -6.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.081 16.981 -8.054 1.00 0.00 H new ATOM 1306 N GLU A 87 -2.674 9.686 -4.930 1.00 0.00 N ATOM 1307 CA GLU A 87 -2.993 9.238 -3.584 1.00 0.00 C ATOM 1308 C GLU A 87 -1.761 8.622 -2.927 1.00 0.00 C ATOM 1309 O GLU A 87 -1.509 8.830 -1.743 1.00 0.00 O ATOM 1310 CB GLU A 87 -4.128 8.207 -3.633 1.00 0.00 C ATOM 1311 CG GLU A 87 -4.554 7.826 -2.206 1.00 0.00 C ATOM 1312 CD GLU A 87 -3.590 6.799 -1.609 1.00 0.00 C ATOM 1313 OE1 GLU A 87 -2.739 6.310 -2.335 1.00 0.00 O ATOM 1314 OE2 GLU A 87 -3.722 6.513 -0.431 1.00 0.00 O ATOM 0 H GLU A 87 -3.209 9.231 -5.670 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.314 10.097 -2.994 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.979 8.616 -4.178 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -3.800 7.319 -4.173 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.578 8.717 -1.578 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.565 7.418 -2.220 1.00 0.00 H new ATOM 1321 N ALA A 88 -0.997 7.869 -3.707 1.00 0.00 N ATOM 1322 CA ALA A 88 0.204 7.234 -3.196 1.00 0.00 C ATOM 1323 C ALA A 88 1.228 8.293 -2.822 1.00 0.00 C ATOM 1324 O ALA A 88 1.651 8.369 -1.670 1.00 0.00 O ATOM 1325 CB ALA A 88 0.794 6.298 -4.255 1.00 0.00 C ATOM 0 H ALA A 88 -1.189 7.685 -4.692 1.00 0.00 H new ATOM 0 HA ALA A 88 -0.053 6.653 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.695 5.826 -3.862 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.064 5.530 -4.509 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.044 6.871 -5.148 1.00 0.00 H new ATOM 1331 N PHE A 89 1.627 9.113 -3.794 1.00 0.00 N ATOM 1332 CA PHE A 89 2.613 10.152 -3.520 1.00 0.00 C ATOM 1333 C PHE A 89 2.148 11.034 -2.361 1.00 0.00 C ATOM 1334 O PHE A 89 2.963 11.552 -1.592 1.00 0.00 O ATOM 1335 CB PHE A 89 2.816 11.005 -4.769 1.00 0.00 C ATOM 1336 CG PHE A 89 4.045 11.862 -4.606 1.00 0.00 C ATOM 1337 CD1 PHE A 89 5.299 11.365 -4.982 1.00 0.00 C ATOM 1338 CD2 PHE A 89 3.932 13.155 -4.083 1.00 0.00 C ATOM 1339 CE1 PHE A 89 6.439 12.159 -4.834 1.00 0.00 C ATOM 1340 CE2 PHE A 89 5.074 13.949 -3.935 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.327 13.450 -4.311 1.00 0.00 C ATOM 0 H PHE A 89 1.291 9.079 -4.756 1.00 0.00 H new ATOM 0 HA PHE A 89 3.556 9.681 -3.244 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.921 10.365 -5.645 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.942 11.634 -4.937 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.385 10.367 -5.387 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.965 13.539 -3.794 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.406 11.775 -5.124 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.989 14.947 -3.531 1.00 0.00 H new ATOM 0 HZ PHE A 89 7.208 14.064 -4.197 1.00 0.00 H new ATOM 1351 N LYS A 90 0.838 11.197 -2.247 1.00 0.00 N ATOM 1352 CA LYS A 90 0.269 12.016 -1.182 1.00 0.00 C ATOM 1353 C LYS A 90 0.575 11.405 0.180 1.00 0.00 C ATOM 1354 O LYS A 90 0.885 12.118 1.137 1.00 0.00 O ATOM 1355 CB LYS A 90 -1.245 12.143 -1.358 1.00 0.00 C ATOM 1356 CG LYS A 90 -1.807 13.105 -0.309 1.00 0.00 C ATOM 1357 CD LYS A 90 -3.309 13.292 -0.542 1.00 0.00 C ATOM 1358 CE LYS A 90 -3.868 14.274 0.489 1.00 0.00 C ATOM 1359 NZ LYS A 90 -3.810 13.656 1.843 1.00 0.00 N ATOM 0 H LYS A 90 0.151 10.777 -2.873 1.00 0.00 H new ATOM 0 HA LYS A 90 0.719 13.007 -1.237 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.475 12.507 -2.359 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.716 11.165 -1.258 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.629 12.713 0.692 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.296 14.066 -0.370 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.487 13.666 -1.550 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.822 12.334 -0.462 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.293 15.200 0.475 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.897 14.534 0.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.448 14.168 2.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.104 12.660 1.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.837 13.708 2.207 1.00 0.00 H new ATOM 1373 N VAL A 91 0.493 10.082 0.259 1.00 0.00 N ATOM 1374 CA VAL A 91 0.772 9.384 1.513 1.00 0.00 C ATOM 1375 C VAL A 91 2.269 9.372 1.815 1.00 0.00 C ATOM 1376 O VAL A 91 2.695 9.648 2.939 1.00 0.00 O ATOM 1377 CB VAL A 91 0.253 7.945 1.436 1.00 0.00 C ATOM 1378 CG1 VAL A 91 0.613 7.195 2.727 1.00 0.00 C ATOM 1379 CG2 VAL A 91 -1.273 7.956 1.249 1.00 0.00 C ATOM 0 H VAL A 91 0.239 9.475 -0.520 1.00 0.00 H new ATOM 0 HA VAL A 91 0.262 9.916 2.317 1.00 0.00 H new ATOM 0 HB VAL A 91 0.715 7.440 0.588 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.242 6.172 2.669 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.696 7.182 2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.157 7.698 3.579 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.640 6.931 1.194 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.739 8.464 2.093 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.523 8.481 0.327 1.00 0.00 H new ATOM 1389 N PHE A 92 3.064 9.024 0.810 1.00 0.00 N ATOM 1390 CA PHE A 92 4.511 8.951 0.976 1.00 0.00 C ATOM 1391 C PHE A 92 5.085 10.323 1.304 1.00 0.00 C ATOM 1392 O PHE A 92 5.864 10.474 2.246 1.00 0.00 O ATOM 1393 CB PHE A 92 5.157 8.410 -0.308 1.00 0.00 C ATOM 1394 CG PHE A 92 4.963 6.907 -0.396 1.00 0.00 C ATOM 1395 CD1 PHE A 92 3.676 6.356 -0.330 1.00 0.00 C ATOM 1396 CD2 PHE A 92 6.065 6.061 -0.540 1.00 0.00 C ATOM 1397 CE1 PHE A 92 3.492 4.981 -0.404 1.00 0.00 C ATOM 1398 CE2 PHE A 92 5.872 4.680 -0.619 1.00 0.00 C ATOM 1399 CZ PHE A 92 4.586 4.143 -0.551 1.00 0.00 C ATOM 0 H PHE A 92 2.733 8.789 -0.126 1.00 0.00 H new ATOM 0 HA PHE A 92 4.730 8.276 1.804 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.714 8.893 -1.179 1.00 0.00 H new ATOM 0 HB3 PHE A 92 6.221 8.648 -0.318 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.820 7.006 -0.221 1.00 0.00 H new ATOM 0 HD2 PHE A 92 7.062 6.473 -0.590 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.497 4.565 -0.347 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.723 4.024 -0.733 1.00 0.00 H new ATOM 0 HZ PHE A 92 4.443 3.074 -0.613 1.00 0.00 H new ATOM 1409 N ASP A 93 4.701 11.319 0.515 1.00 0.00 N ATOM 1410 CA ASP A 93 5.192 12.670 0.729 1.00 0.00 C ATOM 1411 C ASP A 93 4.457 13.312 1.901 1.00 0.00 C ATOM 1412 O ASP A 93 3.759 14.310 1.730 1.00 0.00 O ATOM 1413 CB ASP A 93 4.982 13.509 -0.538 1.00 0.00 C ATOM 1414 CG ASP A 93 5.892 14.732 -0.513 1.00 0.00 C ATOM 1415 OD1 ASP A 93 6.173 15.215 0.571 1.00 0.00 O ATOM 1416 OD2 ASP A 93 6.291 15.173 -1.580 1.00 0.00 O ATOM 0 H ASP A 93 4.058 11.217 -0.270 1.00 0.00 H new ATOM 0 HA ASP A 93 6.257 12.627 0.957 1.00 0.00 H new ATOM 0 HB2 ASP A 93 5.193 12.907 -1.422 1.00 0.00 H new ATOM 0 HB3 ASP A 93 3.940 13.822 -0.608 1.00 0.00 H new ATOM 1421 N LYS A 94 4.606 12.722 3.080 1.00 0.00 N ATOM 1422 CA LYS A 94 3.934 13.235 4.272 1.00 0.00 C ATOM 1423 C LYS A 94 4.042 14.758 4.349 1.00 0.00 C ATOM 1424 O LYS A 94 3.033 15.460 4.396 1.00 0.00 O ATOM 1425 CB LYS A 94 4.570 12.629 5.517 1.00 0.00 C ATOM 1426 CG LYS A 94 3.693 12.928 6.735 1.00 0.00 C ATOM 1427 CD LYS A 94 4.241 12.189 7.961 1.00 0.00 C ATOM 1428 CE LYS A 94 5.566 12.819 8.411 1.00 0.00 C ATOM 1429 NZ LYS A 94 5.878 12.381 9.796 1.00 0.00 N ATOM 0 H LYS A 94 5.181 11.894 3.239 1.00 0.00 H new ATOM 0 HA LYS A 94 2.881 12.960 4.214 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.684 11.552 5.393 1.00 0.00 H new ATOM 0 HB3 LYS A 94 5.569 13.040 5.665 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.672 14.001 6.925 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.666 12.618 6.541 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.516 12.230 8.774 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.393 11.136 7.722 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.369 12.524 7.735 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.497 13.906 8.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.776 12.808 10.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.116 12.683 10.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 5.961 11.345 9.822 1.00 0.00 H new ATOM 1443 N ASP A 95 5.269 15.259 4.370 1.00 0.00 N ATOM 1444 CA ASP A 95 5.501 16.702 4.446 1.00 0.00 C ATOM 1445 C ASP A 95 5.132 17.385 3.133 1.00 0.00 C ATOM 1446 O ASP A 95 5.310 18.592 2.975 1.00 0.00 O ATOM 1447 CB ASP A 95 6.969 16.976 4.800 1.00 0.00 C ATOM 1448 CG ASP A 95 7.861 15.945 4.122 1.00 0.00 C ATOM 1449 OD1 ASP A 95 7.680 14.773 4.396 1.00 0.00 O ATOM 1450 OD2 ASP A 95 8.714 16.335 3.340 1.00 0.00 O ATOM 0 H ASP A 95 6.118 14.694 4.336 1.00 0.00 H new ATOM 0 HA ASP A 95 4.863 17.114 5.228 1.00 0.00 H new ATOM 0 HB2 ASP A 95 7.249 17.980 4.480 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.106 16.936 5.881 1.00 0.00 H new ATOM 1455 N GLN A 96 4.607 16.610 2.194 1.00 0.00 N ATOM 1456 CA GLN A 96 4.209 17.163 0.903 1.00 0.00 C ATOM 1457 C GLN A 96 5.299 18.076 0.352 1.00 0.00 C ATOM 1458 O GLN A 96 5.029 18.982 -0.435 1.00 0.00 O ATOM 1459 CB GLN A 96 2.911 17.952 1.057 1.00 0.00 C ATOM 1460 CG GLN A 96 1.748 16.987 1.314 1.00 0.00 C ATOM 1461 CD GLN A 96 1.321 16.322 0.009 1.00 0.00 C ATOM 1462 OE1 GLN A 96 0.834 15.114 0.031 1.00 0.00 O flip ATOM 1463 NE2 GLN A 96 1.425 16.924 -1.057 1.00 0.00 N flip ATOM 0 H GLN A 96 4.447 15.608 2.298 1.00 0.00 H new ATOM 0 HA GLN A 96 4.056 16.340 0.206 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.999 18.659 1.882 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.720 18.536 0.157 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.048 16.228 2.037 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.907 17.527 1.749 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.806 17.870 -1.073 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.130 16.478 -1.926 1.00 0.00 H new ATOM 1472 N ASN A 97 6.536 17.835 0.781 1.00 0.00 N ATOM 1473 CA ASN A 97 7.661 18.647 0.331 1.00 0.00 C ATOM 1474 C ASN A 97 7.902 18.457 -1.161 1.00 0.00 C ATOM 1475 O ASN A 97 8.720 19.153 -1.760 1.00 0.00 O ATOM 1476 CB ASN A 97 8.924 18.270 1.105 1.00 0.00 C ATOM 1477 CG ASN A 97 9.336 16.844 0.767 1.00 0.00 C ATOM 1478 OD1 ASN A 97 8.569 16.109 0.146 1.00 0.00 O ATOM 1479 ND2 ASN A 97 10.510 16.405 1.134 1.00 0.00 N ATOM 0 H ASN A 97 6.782 17.091 1.434 1.00 0.00 H new ATOM 0 HA ASN A 97 7.421 19.694 0.517 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.731 18.959 0.857 1.00 0.00 H new ATOM 0 HB3 ASN A 97 8.745 18.361 2.176 1.00 0.00 H new ATOM 0 HD21 ASN A 97 10.792 15.452 0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.145 17.015 1.649 1.00 0.00 H new ATOM 1486 N GLY A 98 7.182 17.514 -1.756 1.00 0.00 N ATOM 1487 CA GLY A 98 7.323 17.239 -3.182 1.00 0.00 C ATOM 1488 C GLY A 98 8.419 16.208 -3.429 1.00 0.00 C ATOM 1489 O GLY A 98 8.681 15.850 -4.574 1.00 0.00 O ATOM 0 H GLY A 98 6.498 16.929 -1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.377 16.874 -3.582 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.559 18.161 -3.713 1.00 0.00 H new ATOM 1493 N TYR A 99 9.059 15.733 -2.354 1.00 0.00 N ATOM 1494 CA TYR A 99 10.124 14.743 -2.476 1.00 0.00 C ATOM 1495 C TYR A 99 9.956 13.676 -1.412 1.00 0.00 C ATOM 1496 O TYR A 99 9.587 13.976 -0.278 1.00 0.00 O ATOM 1497 CB TYR A 99 11.483 15.426 -2.321 1.00 0.00 C ATOM 1498 CG TYR A 99 11.461 16.755 -3.046 1.00 0.00 C ATOM 1499 CD1 TYR A 99 11.344 16.790 -4.441 1.00 0.00 C ATOM 1500 CD2 TYR A 99 11.566 17.951 -2.326 1.00 0.00 C ATOM 1501 CE1 TYR A 99 11.331 18.017 -5.115 1.00 0.00 C ATOM 1502 CE2 TYR A 99 11.552 19.176 -2.999 1.00 0.00 C ATOM 1503 CZ TYR A 99 11.435 19.210 -4.393 1.00 0.00 C ATOM 1504 OH TYR A 99 11.423 20.420 -5.054 1.00 0.00 O ATOM 0 H TYR A 99 8.856 16.019 -1.396 1.00 0.00 H new ATOM 0 HA TYR A 99 10.071 14.276 -3.459 1.00 0.00 H new ATOM 0 HB2 TYR A 99 11.708 15.578 -1.265 1.00 0.00 H new ATOM 0 HB3 TYR A 99 12.270 14.791 -2.726 1.00 0.00 H new ATOM 0 HD1 TYR A 99 11.264 15.868 -4.998 1.00 0.00 H new ATOM 0 HD2 TYR A 99 11.658 17.927 -1.250 1.00 0.00 H new ATOM 0 HE1 TYR A 99 11.241 18.042 -6.191 1.00 0.00 H new ATOM 0 HE2 TYR A 99 11.632 20.098 -2.442 1.00 0.00 H new ATOM 0 HH TYR A 99 11.503 21.149 -4.404 1.00 0.00 H new ATOM 1514 N ILE A 100 10.216 12.432 -1.781 1.00 0.00 N ATOM 1515 CA ILE A 100 10.077 11.324 -0.847 1.00 0.00 C ATOM 1516 C ILE A 100 11.424 10.999 -0.218 1.00 0.00 C ATOM 1517 O ILE A 100 12.372 10.619 -0.906 1.00 0.00 O ATOM 1518 CB ILE A 100 9.550 10.078 -1.575 1.00 0.00 C ATOM 1519 CG1 ILE A 100 8.408 10.476 -2.527 1.00 0.00 C ATOM 1520 CG2 ILE A 100 9.031 9.067 -0.545 1.00 0.00 C ATOM 1521 CD1 ILE A 100 7.962 9.268 -3.358 1.00 0.00 C ATOM 0 H ILE A 100 10.523 12.164 -2.716 1.00 0.00 H new ATOM 0 HA ILE A 100 9.371 11.616 -0.070 1.00 0.00 H new ATOM 0 HB ILE A 100 10.358 9.628 -2.152 1.00 0.00 H new ATOM 0 HG12 ILE A 100 7.565 10.862 -1.953 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.739 11.278 -3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.657 8.182 -1.060 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.842 8.781 0.125 1.00 0.00 H new ATOM 0 HG23 ILE A 100 8.225 9.518 0.033 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.154 9.565 -4.027 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.803 8.900 -3.946 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.612 8.478 -2.693 1.00 0.00 H new ATOM 1533 N SER A 101 11.491 11.153 1.101 1.00 0.00 N ATOM 1534 CA SER A 101 12.721 10.864 1.842 1.00 0.00 C ATOM 1535 C SER A 101 12.771 9.394 2.257 1.00 0.00 C ATOM 1536 O SER A 101 11.741 8.785 2.544 1.00 0.00 O ATOM 1537 CB SER A 101 12.810 11.749 3.082 1.00 0.00 C ATOM 1538 OG SER A 101 13.770 11.207 3.981 1.00 0.00 O ATOM 0 H SER A 101 10.714 11.474 1.679 1.00 0.00 H new ATOM 0 HA SER A 101 13.568 11.073 1.188 1.00 0.00 H new ATOM 0 HB2 SER A 101 13.092 12.763 2.799 1.00 0.00 H new ATOM 0 HB3 SER A 101 11.836 11.813 3.567 1.00 0.00 H new ATOM 0 HG SER A 101 13.830 11.775 4.777 1.00 0.00 H new ATOM 1544 N ALA A 102 13.975 8.829 2.278 1.00 0.00 N ATOM 1545 CA ALA A 102 14.140 7.428 2.652 1.00 0.00 C ATOM 1546 C ALA A 102 13.390 7.136 3.954 1.00 0.00 C ATOM 1547 O ALA A 102 12.678 6.136 4.059 1.00 0.00 O ATOM 1548 CB ALA A 102 15.649 7.101 2.818 1.00 0.00 C ATOM 0 H ALA A 102 14.842 9.313 2.043 1.00 0.00 H new ATOM 0 HA ALA A 102 13.725 6.800 1.864 1.00 0.00 H new ATOM 0 HB1 ALA A 102 15.766 6.054 3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 102 16.167 7.286 1.877 1.00 0.00 H new ATOM 0 HB3 ALA A 102 16.075 7.734 3.597 1.00 0.00 H new ATOM 1554 N SER A 103 13.551 8.014 4.938 1.00 0.00 N ATOM 1555 CA SER A 103 12.891 7.831 6.223 1.00 0.00 C ATOM 1556 C SER A 103 11.376 7.795 6.042 1.00 0.00 C ATOM 1557 O SER A 103 10.689 6.961 6.628 1.00 0.00 O ATOM 1558 CB SER A 103 13.272 8.966 7.170 1.00 0.00 C ATOM 1559 OG SER A 103 12.646 8.756 8.430 1.00 0.00 O ATOM 0 H SER A 103 14.128 8.852 4.871 1.00 0.00 H new ATOM 0 HA SER A 103 13.216 6.882 6.650 1.00 0.00 H new ATOM 0 HB2 SER A 103 14.355 9.006 7.291 1.00 0.00 H new ATOM 0 HB3 SER A 103 12.962 9.924 6.752 1.00 0.00 H new ATOM 0 HG SER A 103 12.890 9.482 9.041 1.00 0.00 H new ATOM 1565 N GLU A 104 10.868 8.701 5.214 1.00 0.00 N ATOM 1566 CA GLU A 104 9.430 8.758 4.956 1.00 0.00 C ATOM 1567 C GLU A 104 8.968 7.478 4.275 1.00 0.00 C ATOM 1568 O GLU A 104 8.022 6.821 4.721 1.00 0.00 O ATOM 1569 CB GLU A 104 9.101 9.970 4.078 1.00 0.00 C ATOM 1570 CG GLU A 104 9.239 11.249 4.907 1.00 0.00 C ATOM 1571 CD GLU A 104 8.805 12.449 4.079 1.00 0.00 C ATOM 1572 OE1 GLU A 104 7.647 12.485 3.700 1.00 0.00 O ATOM 1573 OE2 GLU A 104 9.632 13.310 3.832 1.00 0.00 O ATOM 0 H GLU A 104 11.420 9.398 4.715 1.00 0.00 H new ATOM 0 HA GLU A 104 8.906 8.858 5.907 1.00 0.00 H new ATOM 0 HB2 GLU A 104 9.773 10.005 3.220 1.00 0.00 H new ATOM 0 HB3 GLU A 104 8.088 9.885 3.686 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.629 11.177 5.808 1.00 0.00 H new ATOM 0 HG3 GLU A 104 10.272 11.374 5.231 1.00 0.00 H new ATOM 1580 N LEU A 105 9.655 7.111 3.209 1.00 0.00 N ATOM 1581 CA LEU A 105 9.311 5.902 2.487 1.00 0.00 C ATOM 1582 C LEU A 105 9.559 4.681 3.370 1.00 0.00 C ATOM 1583 O LEU A 105 8.932 3.638 3.201 1.00 0.00 O ATOM 1584 CB LEU A 105 10.166 5.809 1.186 1.00 0.00 C ATOM 1585 CG LEU A 105 10.461 4.334 0.807 1.00 0.00 C ATOM 1586 CD1 LEU A 105 9.159 3.632 0.381 1.00 0.00 C ATOM 1587 CD2 LEU A 105 11.482 4.271 -0.319 1.00 0.00 C ATOM 0 H LEU A 105 10.447 7.628 2.827 1.00 0.00 H new ATOM 0 HA LEU A 105 8.255 5.930 2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.639 6.298 0.367 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.105 6.345 1.327 1.00 0.00 H new ATOM 0 HG LEU A 105 10.872 3.823 1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.374 2.597 0.116 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.446 3.655 1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.734 4.146 -0.481 1.00 0.00 H new ATOM 0 HD21 LEU A 105 11.679 3.230 -0.574 1.00 0.00 H new ATOM 0 HD22 LEU A 105 11.092 4.791 -1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.408 4.747 0.003 1.00 0.00 H new ATOM 1599 N ARG A 106 10.485 4.820 4.302 1.00 0.00 N ATOM 1600 CA ARG A 106 10.831 3.717 5.193 1.00 0.00 C ATOM 1601 C ARG A 106 9.802 3.561 6.292 1.00 0.00 C ATOM 1602 O ARG A 106 9.380 2.443 6.608 1.00 0.00 O ATOM 1603 CB ARG A 106 12.220 3.943 5.799 1.00 0.00 C ATOM 1604 CG ARG A 106 12.599 2.757 6.689 1.00 0.00 C ATOM 1605 CD ARG A 106 14.005 2.971 7.251 1.00 0.00 C ATOM 1606 NE ARG A 106 14.999 2.833 6.197 1.00 0.00 N ATOM 1607 CZ ARG A 106 16.236 3.291 6.353 1.00 0.00 C ATOM 1608 NH1 ARG A 106 16.576 3.879 7.467 1.00 0.00 N ATOM 1609 NH2 ARG A 106 17.111 3.151 5.393 1.00 0.00 N ATOM 0 H ARG A 106 11.011 5.679 4.464 1.00 0.00 H new ATOM 0 HA ARG A 106 10.843 2.798 4.606 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.957 4.064 5.005 1.00 0.00 H new ATOM 0 HB3 ARG A 106 12.226 4.864 6.383 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.882 2.656 7.503 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.562 1.831 6.115 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.077 3.962 7.700 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.201 2.247 8.042 1.00 0.00 H new ATOM 0 HE ARG A 106 14.741 2.376 5.322 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.892 3.986 8.216 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.525 4.231 7.589 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.844 2.690 4.523 1.00 0.00 H new ATOM 0 HH22 ARG A 106 18.061 3.503 5.513 1.00 0.00 H new ATOM 1623 N HIS A 107 9.400 4.694 6.868 1.00 0.00 N ATOM 1624 CA HIS A 107 8.423 4.686 7.936 1.00 0.00 C ATOM 1625 C HIS A 107 7.166 3.982 7.469 1.00 0.00 C ATOM 1626 O HIS A 107 6.666 3.100 8.156 1.00 0.00 O ATOM 1627 CB HIS A 107 8.079 6.116 8.352 1.00 0.00 C ATOM 1628 CG HIS A 107 7.084 6.090 9.481 1.00 0.00 C ATOM 1629 ND1 HIS A 107 7.451 5.784 10.783 1.00 0.00 N ATOM 1630 CD2 HIS A 107 5.734 6.332 9.521 1.00 0.00 C ATOM 1631 CE1 HIS A 107 6.344 5.847 11.544 1.00 0.00 C ATOM 1632 NE2 HIS A 107 5.268 6.177 10.825 1.00 0.00 N ATOM 0 H HIS A 107 9.739 5.620 6.609 1.00 0.00 H new ATOM 0 HA HIS A 107 8.844 4.159 8.792 1.00 0.00 H new ATOM 0 HB2 HIS A 107 8.982 6.642 8.662 1.00 0.00 H new ATOM 0 HB3 HIS A 107 7.667 6.663 7.504 1.00 0.00 H new ATOM 0 HD2 HIS A 107 5.125 6.602 8.671 1.00 0.00 H new ATOM 0 HE1 HIS A 107 6.327 5.654 12.607 1.00 0.00 H new ATOM 0 HE2 HIS A 107 4.311 6.291 11.159 1.00 0.00 H new ATOM 1641 N VAL A 108 6.654 4.365 6.300 1.00 0.00 N ATOM 1642 CA VAL A 108 5.449 3.730 5.780 1.00 0.00 C ATOM 1643 C VAL A 108 5.710 2.256 5.525 1.00 0.00 C ATOM 1644 O VAL A 108 5.064 1.408 6.122 1.00 0.00 O ATOM 1645 CB VAL A 108 5.038 4.401 4.474 1.00 0.00 C ATOM 1646 CG1 VAL A 108 3.747 3.778 3.944 1.00 0.00 C ATOM 1647 CG2 VAL A 108 4.832 5.891 4.720 1.00 0.00 C ATOM 0 H VAL A 108 7.046 5.097 5.707 1.00 0.00 H new ATOM 0 HA VAL A 108 4.649 3.834 6.513 1.00 0.00 H new ATOM 0 HB VAL A 108 5.823 4.257 3.732 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.464 4.266 3.011 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.903 2.714 3.765 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.952 3.909 4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.538 6.376 3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.050 6.032 5.466 1.00 0.00 H new ATOM 0 HG23 VAL A 108 5.761 6.332 5.081 1.00 0.00 H new ATOM 1657 N MET A 109 6.640 1.958 4.615 1.00 0.00 N ATOM 1658 CA MET A 109 6.949 0.561 4.278 1.00 0.00 C ATOM 1659 C MET A 109 6.753 -0.351 5.490 1.00 0.00 C ATOM 1660 O MET A 109 5.822 -1.154 5.530 1.00 0.00 O ATOM 1661 CB MET A 109 8.417 0.460 3.798 1.00 0.00 C ATOM 1662 CG MET A 109 8.488 -0.136 2.399 1.00 0.00 C ATOM 1663 SD MET A 109 7.806 -1.814 2.444 1.00 0.00 S ATOM 1664 CE MET A 109 7.641 -2.057 0.660 1.00 0.00 C ATOM 0 H MET A 109 7.186 2.651 4.104 1.00 0.00 H new ATOM 0 HA MET A 109 6.271 0.240 3.487 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.874 1.450 3.800 1.00 0.00 H new ATOM 0 HB3 MET A 109 8.989 -0.157 4.491 1.00 0.00 H new ATOM 0 HG2 MET A 109 7.927 0.481 1.697 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.520 -0.157 2.050 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.585 -2.099 0.395 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.114 -1.228 0.135 1.00 0.00 H new ATOM 0 HE3 MET A 109 8.125 -2.991 0.374 1.00 0.00 H new ATOM 1674 N ILE A 110 7.639 -0.236 6.461 1.00 0.00 N ATOM 1675 CA ILE A 110 7.536 -1.079 7.648 1.00 0.00 C ATOM 1676 C ILE A 110 6.143 -0.971 8.262 1.00 0.00 C ATOM 1677 O ILE A 110 5.545 -1.980 8.641 1.00 0.00 O ATOM 1678 CB ILE A 110 8.577 -0.642 8.676 1.00 0.00 C ATOM 1679 CG1 ILE A 110 8.487 -1.539 9.909 1.00 0.00 C ATOM 1680 CG2 ILE A 110 8.309 0.808 9.082 1.00 0.00 C ATOM 1681 CD1 ILE A 110 9.737 -1.344 10.766 1.00 0.00 C ATOM 0 H ILE A 110 8.423 0.416 6.459 1.00 0.00 H new ATOM 0 HA ILE A 110 7.714 -2.114 7.357 1.00 0.00 H new ATOM 0 HB ILE A 110 9.573 -0.723 8.241 1.00 0.00 H new ATOM 0 HG12 ILE A 110 7.595 -1.296 10.486 1.00 0.00 H new ATOM 0 HG13 ILE A 110 8.397 -2.583 9.608 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.051 1.123 9.816 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.373 1.450 8.203 1.00 0.00 H new ATOM 0 HG23 ILE A 110 7.312 0.886 9.517 1.00 0.00 H new ATOM 0 HD11 ILE A 110 9.677 -1.982 11.647 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.621 -1.609 10.186 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.806 -0.302 11.077 1.00 0.00 H new ATOM 1693 N ASN A 111 5.629 0.253 8.363 1.00 0.00 N ATOM 1694 CA ASN A 111 4.304 0.470 8.944 1.00 0.00 C ATOM 1695 C ASN A 111 3.287 -0.491 8.337 1.00 0.00 C ATOM 1696 O ASN A 111 2.169 -0.616 8.834 1.00 0.00 O ATOM 1697 CB ASN A 111 3.848 1.913 8.710 1.00 0.00 C ATOM 1698 CG ASN A 111 2.614 2.217 9.534 1.00 0.00 C ATOM 1699 OD1 ASN A 111 2.563 1.889 10.717 1.00 0.00 O ATOM 1700 ND2 ASN A 111 1.616 2.840 8.974 1.00 0.00 N ATOM 0 H ASN A 111 6.103 1.102 8.054 1.00 0.00 H new ATOM 0 HA ASN A 111 4.371 0.285 10.016 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.650 2.602 8.976 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.634 2.066 7.652 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.782 3.060 9.518 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.669 3.108 7.991 1.00 0.00 H new ATOM 1707 N LEU A 112 3.682 -1.165 7.261 1.00 0.00 N ATOM 1708 CA LEU A 112 2.797 -2.115 6.589 1.00 0.00 C ATOM 1709 C LEU A 112 2.914 -3.491 7.234 1.00 0.00 C ATOM 1710 O LEU A 112 2.446 -4.483 6.683 1.00 0.00 O ATOM 1711 CB LEU A 112 3.158 -2.214 5.109 1.00 0.00 C ATOM 1712 CG LEU A 112 3.089 -0.819 4.474 1.00 0.00 C ATOM 1713 CD1 LEU A 112 3.556 -0.895 3.017 1.00 0.00 C ATOM 1714 CD2 LEU A 112 1.646 -0.281 4.536 1.00 0.00 C ATOM 0 H LEU A 112 4.605 -1.073 6.836 1.00 0.00 H new ATOM 0 HA LEU A 112 1.771 -1.760 6.686 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.159 -2.629 4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.472 -2.892 4.600 1.00 0.00 H new ATOM 0 HG LEU A 112 3.740 -0.142 5.026 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.507 0.096 2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.583 -1.258 2.983 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.911 -1.577 2.463 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.607 0.710 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.983 -0.955 3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.326 -0.217 5.576 1.00 0.00 H new ATOM 1726 N GLY A 113 3.545 -3.542 8.401 1.00 0.00 N ATOM 1727 CA GLY A 113 3.713 -4.805 9.109 1.00 0.00 C ATOM 1728 C GLY A 113 4.789 -5.659 8.450 1.00 0.00 C ATOM 1729 O GLY A 113 5.007 -6.804 8.839 1.00 0.00 O ATOM 0 H GLY A 113 3.945 -2.732 8.874 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.982 -4.611 10.147 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.768 -5.348 9.121 1.00 0.00 H new ATOM 1733 N GLU A 114 5.457 -5.092 7.448 1.00 0.00 N ATOM 1734 CA GLU A 114 6.510 -5.811 6.734 1.00 0.00 C ATOM 1735 C GLU A 114 7.869 -5.511 7.349 1.00 0.00 C ATOM 1736 O GLU A 114 8.161 -4.372 7.705 1.00 0.00 O ATOM 1737 CB GLU A 114 6.514 -5.396 5.264 1.00 0.00 C ATOM 1738 CG GLU A 114 5.179 -5.778 4.619 1.00 0.00 C ATOM 1739 CD GLU A 114 5.032 -7.295 4.578 1.00 0.00 C ATOM 1740 OE1 GLU A 114 6.041 -7.971 4.693 1.00 0.00 O ATOM 1741 OE2 GLU A 114 3.914 -7.758 4.433 1.00 0.00 O ATOM 0 H GLU A 114 5.290 -4.143 7.114 1.00 0.00 H new ATOM 0 HA GLU A 114 6.315 -6.881 6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.676 -4.321 5.179 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.336 -5.884 4.740 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.355 -5.340 5.183 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.125 -5.372 3.609 1.00 0.00 H new ATOM 1748 N LYS A 115 8.695 -6.541 7.482 1.00 0.00 N ATOM 1749 CA LYS A 115 10.021 -6.370 8.069 1.00 0.00 C ATOM 1750 C LYS A 115 11.014 -5.913 7.012 1.00 0.00 C ATOM 1751 O LYS A 115 11.613 -6.728 6.315 1.00 0.00 O ATOM 1752 CB LYS A 115 10.498 -7.694 8.676 1.00 0.00 C ATOM 1753 CG LYS A 115 9.851 -7.912 10.048 1.00 0.00 C ATOM 1754 CD LYS A 115 8.343 -8.111 9.878 1.00 0.00 C ATOM 1755 CE LYS A 115 7.751 -8.638 11.180 1.00 0.00 C ATOM 1756 NZ LYS A 115 6.274 -8.774 11.030 1.00 0.00 N ATOM 0 H LYS A 115 8.475 -7.495 7.195 1.00 0.00 H new ATOM 0 HA LYS A 115 9.958 -5.612 8.850 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.244 -8.519 8.011 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.583 -7.687 8.775 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.290 -8.783 10.534 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.045 -7.055 10.693 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.869 -7.168 9.606 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.147 -8.812 9.067 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.193 -9.603 11.430 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.984 -7.959 12.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 5.810 -8.530 11.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 5.940 -8.132 10.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 6.040 -9.755 10.774 1.00 0.00 H new ATOM 1770 N LEU A 116 11.188 -4.604 6.907 1.00 0.00 N ATOM 1771 CA LEU A 116 12.119 -4.031 5.933 1.00 0.00 C ATOM 1772 C LEU A 116 13.446 -3.712 6.593 1.00 0.00 C ATOM 1773 O LEU A 116 13.494 -3.057 7.633 1.00 0.00 O ATOM 1774 CB LEU A 116 11.516 -2.752 5.329 1.00 0.00 C ATOM 1775 CG LEU A 116 10.561 -3.119 4.183 1.00 0.00 C ATOM 1776 CD1 LEU A 116 11.349 -3.707 2.980 1.00 0.00 C ATOM 1777 CD2 LEU A 116 9.529 -4.142 4.687 1.00 0.00 C ATOM 0 H LEU A 116 10.700 -3.916 7.481 1.00 0.00 H new ATOM 0 HA LEU A 116 12.290 -4.760 5.141 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.980 -2.194 6.097 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.310 -2.104 4.959 1.00 0.00 H new ATOM 0 HG LEU A 116 10.048 -2.218 3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 116 10.654 -3.960 2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.066 -2.969 2.619 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.880 -4.604 3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 116 8.850 -4.404 3.875 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.044 -5.038 5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 116 8.960 -3.710 5.510 1.00 0.00 H new ATOM 1789 N THR A 117 14.525 -4.172 5.967 1.00 0.00 N ATOM 1790 CA THR A 117 15.861 -3.927 6.488 1.00 0.00 C ATOM 1791 C THR A 117 16.428 -2.641 5.901 1.00 0.00 C ATOM 1792 O THR A 117 15.951 -2.145 4.882 1.00 0.00 O ATOM 1793 CB THR A 117 16.782 -5.101 6.141 1.00 0.00 C ATOM 1794 OG1 THR A 117 17.195 -4.994 4.786 1.00 0.00 O ATOM 1795 CG2 THR A 117 16.034 -6.419 6.346 1.00 0.00 C ATOM 0 H THR A 117 14.499 -4.713 5.103 1.00 0.00 H new ATOM 0 HA THR A 117 15.799 -3.826 7.572 1.00 0.00 H new ATOM 0 HB THR A 117 17.657 -5.079 6.790 1.00 0.00 H new ATOM 0 HG1 THR A 117 17.786 -5.744 4.564 1.00 0.00 H new ATOM 0 HG21 THR A 117 16.691 -7.253 6.099 1.00 0.00 H new ATOM 0 HG22 THR A 117 15.720 -6.501 7.387 1.00 0.00 H new ATOM 0 HG23 THR A 117 15.157 -6.444 5.699 1.00 0.00 H new ATOM 1803 N ASP A 118 17.456 -2.110 6.549 1.00 0.00 N ATOM 1804 CA ASP A 118 18.092 -0.882 6.085 1.00 0.00 C ATOM 1805 C ASP A 118 18.747 -1.105 4.727 1.00 0.00 C ATOM 1806 O ASP A 118 18.782 -0.205 3.890 1.00 0.00 O ATOM 1807 CB ASP A 118 19.146 -0.422 7.096 1.00 0.00 C ATOM 1808 CG ASP A 118 18.467 0.126 8.347 1.00 0.00 C ATOM 1809 OD1 ASP A 118 17.278 0.397 8.283 1.00 0.00 O ATOM 1810 OD2 ASP A 118 19.145 0.266 9.352 1.00 0.00 O ATOM 0 H ASP A 118 17.867 -2.507 7.394 1.00 0.00 H new ATOM 0 HA ASP A 118 17.328 -0.111 5.987 1.00 0.00 H new ATOM 0 HB2 ASP A 118 19.796 -1.256 7.361 1.00 0.00 H new ATOM 0 HB3 ASP A 118 19.779 0.346 6.650 1.00 0.00 H new ATOM 1815 N GLU A 119 19.263 -2.310 4.514 1.00 0.00 N ATOM 1816 CA GLU A 119 19.911 -2.635 3.250 1.00 0.00 C ATOM 1817 C GLU A 119 18.897 -2.626 2.108 1.00 0.00 C ATOM 1818 O GLU A 119 19.138 -2.035 1.058 1.00 0.00 O ATOM 1819 CB GLU A 119 20.564 -4.015 3.338 1.00 0.00 C ATOM 1820 CG GLU A 119 21.735 -3.965 4.322 1.00 0.00 C ATOM 1821 CD GLU A 119 22.356 -5.350 4.466 1.00 0.00 C ATOM 1822 OE1 GLU A 119 21.893 -6.258 3.795 1.00 0.00 O ATOM 1823 OE2 GLU A 119 23.286 -5.482 5.243 1.00 0.00 O ATOM 0 H GLU A 119 19.246 -3.071 5.193 1.00 0.00 H new ATOM 0 HA GLU A 119 20.673 -1.882 3.052 1.00 0.00 H new ATOM 0 HB2 GLU A 119 19.833 -4.755 3.664 1.00 0.00 H new ATOM 0 HB3 GLU A 119 20.915 -4.326 2.354 1.00 0.00 H new ATOM 0 HG2 GLU A 119 22.485 -3.256 3.971 1.00 0.00 H new ATOM 0 HG3 GLU A 119 21.390 -3.610 5.293 1.00 0.00 H new ATOM 1830 N GLU A 120 17.761 -3.279 2.321 1.00 0.00 N ATOM 1831 CA GLU A 120 16.723 -3.339 1.296 1.00 0.00 C ATOM 1832 C GLU A 120 16.241 -1.936 0.938 1.00 0.00 C ATOM 1833 O GLU A 120 16.065 -1.611 -0.236 1.00 0.00 O ATOM 1834 CB GLU A 120 15.545 -4.173 1.799 1.00 0.00 C ATOM 1835 CG GLU A 120 15.971 -5.637 1.924 1.00 0.00 C ATOM 1836 CD GLU A 120 14.840 -6.457 2.536 1.00 0.00 C ATOM 1837 OE1 GLU A 120 13.812 -5.877 2.841 1.00 0.00 O ATOM 1838 OE2 GLU A 120 15.020 -7.654 2.689 1.00 0.00 O ATOM 0 H GLU A 120 17.535 -3.771 3.186 1.00 0.00 H new ATOM 0 HA GLU A 120 17.144 -3.803 0.404 1.00 0.00 H new ATOM 0 HB2 GLU A 120 15.207 -3.798 2.765 1.00 0.00 H new ATOM 0 HB3 GLU A 120 14.704 -4.086 1.111 1.00 0.00 H new ATOM 0 HG2 GLU A 120 16.230 -6.034 0.943 1.00 0.00 H new ATOM 0 HG3 GLU A 120 16.864 -5.713 2.544 1.00 0.00 H new ATOM 1845 N VAL A 121 16.033 -1.114 1.957 1.00 0.00 N ATOM 1846 CA VAL A 121 15.575 0.256 1.735 1.00 0.00 C ATOM 1847 C VAL A 121 16.608 1.044 0.928 1.00 0.00 C ATOM 1848 O VAL A 121 16.264 1.785 0.004 1.00 0.00 O ATOM 1849 CB VAL A 121 15.331 0.950 3.077 1.00 0.00 C ATOM 1850 CG1 VAL A 121 14.964 2.420 2.833 1.00 0.00 C ATOM 1851 CG2 VAL A 121 14.188 0.246 3.815 1.00 0.00 C ATOM 0 H VAL A 121 16.171 -1.365 2.936 1.00 0.00 H new ATOM 0 HA VAL A 121 14.643 0.221 1.172 1.00 0.00 H new ATOM 0 HB VAL A 121 16.235 0.901 3.684 1.00 0.00 H new ATOM 0 HG11 VAL A 121 14.790 2.915 3.788 1.00 0.00 H new ATOM 0 HG12 VAL A 121 15.781 2.917 2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 121 14.060 2.473 2.227 1.00 0.00 H new ATOM 0 HG21 VAL A 121 14.014 0.740 4.771 1.00 0.00 H new ATOM 0 HG22 VAL A 121 13.282 0.293 3.211 1.00 0.00 H new ATOM 0 HG23 VAL A 121 14.454 -0.797 3.988 1.00 0.00 H new ATOM 1861 N GLU A 122 17.875 0.887 1.289 1.00 0.00 N ATOM 1862 CA GLU A 122 18.949 1.585 0.592 1.00 0.00 C ATOM 1863 C GLU A 122 19.086 1.067 -0.834 1.00 0.00 C ATOM 1864 O GLU A 122 19.588 1.765 -1.720 1.00 0.00 O ATOM 1865 CB GLU A 122 20.266 1.400 1.341 1.00 0.00 C ATOM 1866 CG GLU A 122 20.227 2.197 2.641 1.00 0.00 C ATOM 1867 CD GLU A 122 20.266 3.694 2.349 1.00 0.00 C ATOM 1868 OE1 GLU A 122 21.179 4.118 1.660 1.00 0.00 O ATOM 1869 OE2 GLU A 122 19.385 4.394 2.821 1.00 0.00 O ATOM 0 H GLU A 122 18.183 0.287 2.054 1.00 0.00 H new ATOM 0 HA GLU A 122 18.705 2.647 0.555 1.00 0.00 H new ATOM 0 HB2 GLU A 122 20.430 0.344 1.554 1.00 0.00 H new ATOM 0 HB3 GLU A 122 21.099 1.734 0.722 1.00 0.00 H new ATOM 0 HG2 GLU A 122 19.323 1.952 3.198 1.00 0.00 H new ATOM 0 HG3 GLU A 122 21.073 1.921 3.270 1.00 0.00 H new ATOM 1876 N GLN A 123 18.645 -0.160 -1.055 1.00 0.00 N ATOM 1877 CA GLN A 123 18.738 -0.758 -2.382 1.00 0.00 C ATOM 1878 C GLN A 123 17.679 -0.208 -3.334 1.00 0.00 C ATOM 1879 O GLN A 123 18.000 0.334 -4.396 1.00 0.00 O ATOM 1880 CB GLN A 123 18.589 -2.279 -2.277 1.00 0.00 C ATOM 1881 CG GLN A 123 19.903 -2.906 -1.808 1.00 0.00 C ATOM 1882 CD GLN A 123 19.698 -4.386 -1.516 1.00 0.00 C ATOM 1883 OE1 GLN A 123 18.596 -4.910 -1.685 1.00 0.00 O ATOM 1884 NE2 GLN A 123 20.703 -5.098 -1.086 1.00 0.00 N ATOM 0 H GLN A 123 18.223 -0.758 -0.344 1.00 0.00 H new ATOM 0 HA GLN A 123 19.717 -0.503 -2.788 1.00 0.00 H new ATOM 0 HB2 GLN A 123 17.790 -2.526 -1.578 1.00 0.00 H new ATOM 0 HB3 GLN A 123 18.305 -2.692 -3.245 1.00 0.00 H new ATOM 0 HG2 GLN A 123 20.669 -2.780 -2.573 1.00 0.00 H new ATOM 0 HG3 GLN A 123 20.260 -2.396 -0.913 1.00 0.00 H new ATOM 0 HE21 GLN A 123 21.614 -4.662 -0.947 1.00 0.00 H new ATOM 0 HE22 GLN A 123 20.577 -6.091 -0.889 1.00 0.00 H new ATOM 1893 N MET A 124 16.417 -0.378 -2.967 1.00 0.00 N ATOM 1894 CA MET A 124 15.324 0.080 -3.809 1.00 0.00 C ATOM 1895 C MET A 124 15.426 1.577 -4.073 1.00 0.00 C ATOM 1896 O MET A 124 15.226 2.033 -5.202 1.00 0.00 O ATOM 1897 CB MET A 124 13.986 -0.232 -3.125 1.00 0.00 C ATOM 1898 CG MET A 124 13.791 0.671 -1.902 1.00 0.00 C ATOM 1899 SD MET A 124 13.077 2.244 -2.432 1.00 0.00 S ATOM 1900 CE MET A 124 11.346 1.726 -2.368 1.00 0.00 C ATOM 0 H MET A 124 16.127 -0.826 -2.098 1.00 0.00 H new ATOM 0 HA MET A 124 15.383 -0.441 -4.765 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.167 -0.085 -3.829 1.00 0.00 H new ATOM 0 HB3 MET A 124 13.960 -1.278 -2.821 1.00 0.00 H new ATOM 0 HG2 MET A 124 13.136 0.186 -1.178 1.00 0.00 H new ATOM 0 HG3 MET A 124 14.746 0.841 -1.404 1.00 0.00 H new ATOM 0 HE1 MET A 124 10.702 2.605 -2.399 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.126 1.085 -3.222 1.00 0.00 H new ATOM 0 HE3 MET A 124 11.165 1.176 -1.445 1.00 0.00 H new ATOM 1910 N ILE A 125 15.733 2.348 -3.030 1.00 0.00 N ATOM 1911 CA ILE A 125 15.836 3.786 -3.180 1.00 0.00 C ATOM 1912 C ILE A 125 16.961 4.134 -4.145 1.00 0.00 C ATOM 1913 O ILE A 125 16.854 5.075 -4.935 1.00 0.00 O ATOM 1914 CB ILE A 125 16.090 4.434 -1.809 1.00 0.00 C ATOM 1915 CG1 ILE A 125 15.837 5.951 -1.891 1.00 0.00 C ATOM 1916 CG2 ILE A 125 17.529 4.170 -1.374 1.00 0.00 C ATOM 1917 CD1 ILE A 125 14.353 6.252 -1.655 1.00 0.00 C ATOM 0 H ILE A 125 15.911 2.001 -2.088 1.00 0.00 H new ATOM 0 HA ILE A 125 14.900 4.170 -3.586 1.00 0.00 H new ATOM 0 HB ILE A 125 15.409 4.000 -1.076 1.00 0.00 H new ATOM 0 HG12 ILE A 125 16.444 6.469 -1.148 1.00 0.00 H new ATOM 0 HG13 ILE A 125 16.141 6.326 -2.868 1.00 0.00 H new ATOM 0 HG21 ILE A 125 17.706 4.631 -0.402 1.00 0.00 H new ATOM 0 HG22 ILE A 125 17.696 3.095 -1.302 1.00 0.00 H new ATOM 0 HG23 ILE A 125 18.215 4.595 -2.107 1.00 0.00 H new ATOM 0 HD11 ILE A 125 14.186 7.327 -1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 125 13.754 5.749 -2.414 1.00 0.00 H new ATOM 0 HD13 ILE A 125 14.062 5.894 -0.667 1.00 0.00 H new ATOM 1929 N LYS A 126 18.040 3.358 -4.078 1.00 0.00 N ATOM 1930 CA LYS A 126 19.173 3.594 -4.961 1.00 0.00 C ATOM 1931 C LYS A 126 18.762 3.379 -6.417 1.00 0.00 C ATOM 1932 O LYS A 126 19.181 4.125 -7.303 1.00 0.00 O ATOM 1933 CB LYS A 126 20.323 2.656 -4.604 1.00 0.00 C ATOM 1934 CG LYS A 126 21.556 3.015 -5.428 1.00 0.00 C ATOM 1935 CD LYS A 126 22.726 2.124 -5.002 1.00 0.00 C ATOM 1936 CE LYS A 126 23.967 2.487 -5.817 1.00 0.00 C ATOM 1937 NZ LYS A 126 24.400 3.872 -5.477 1.00 0.00 N ATOM 0 H LYS A 126 18.151 2.575 -3.434 1.00 0.00 H new ATOM 0 HA LYS A 126 19.503 4.625 -4.835 1.00 0.00 H new ATOM 0 HB2 LYS A 126 20.550 2.732 -3.541 1.00 0.00 H new ATOM 0 HB3 LYS A 126 20.034 1.622 -4.795 1.00 0.00 H new ATOM 0 HG2 LYS A 126 21.350 2.881 -6.490 1.00 0.00 H new ATOM 0 HG3 LYS A 126 21.812 4.065 -5.283 1.00 0.00 H new ATOM 0 HD2 LYS A 126 22.926 2.253 -3.938 1.00 0.00 H new ATOM 0 HD3 LYS A 126 22.472 1.075 -5.154 1.00 0.00 H new ATOM 0 HE2 LYS A 126 24.771 1.782 -5.607 1.00 0.00 H new ATOM 0 HE3 LYS A 126 23.749 2.414 -6.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 25.395 4.001 -5.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 23.808 4.556 -5.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 24.299 4.026 -4.453 1.00 0.00 H new ATOM 1951 N GLU A 127 17.943 2.355 -6.653 1.00 0.00 N ATOM 1952 CA GLU A 127 17.484 2.053 -8.000 1.00 0.00 C ATOM 1953 C GLU A 127 16.410 3.048 -8.442 1.00 0.00 C ATOM 1954 O GLU A 127 16.456 3.573 -9.556 1.00 0.00 O ATOM 1955 CB GLU A 127 16.916 0.633 -8.049 1.00 0.00 C ATOM 1956 CG GLU A 127 16.667 0.232 -9.502 1.00 0.00 C ATOM 1957 CD GLU A 127 17.997 0.039 -10.224 1.00 0.00 C ATOM 1958 OE1 GLU A 127 19.019 0.051 -9.557 1.00 0.00 O ATOM 1959 OE2 GLU A 127 17.975 -0.122 -11.434 1.00 0.00 O ATOM 0 H GLU A 127 17.588 1.727 -5.932 1.00 0.00 H new ATOM 0 HA GLU A 127 18.334 2.131 -8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 127 17.612 -0.064 -7.583 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.986 0.582 -7.482 1.00 0.00 H new ATOM 0 HG2 GLU A 127 16.086 -0.690 -9.539 1.00 0.00 H new ATOM 0 HG3 GLU A 127 16.079 1.000 -10.004 1.00 0.00 H new ATOM 1966 N ALA A 128 15.441 3.299 -7.563 1.00 0.00 N ATOM 1967 CA ALA A 128 14.357 4.227 -7.877 1.00 0.00 C ATOM 1968 C ALA A 128 14.914 5.623 -8.133 1.00 0.00 C ATOM 1969 O ALA A 128 14.470 6.328 -9.039 1.00 0.00 O ATOM 1970 CB ALA A 128 13.356 4.273 -6.717 1.00 0.00 C ATOM 0 H ALA A 128 15.384 2.877 -6.636 1.00 0.00 H new ATOM 0 HA ALA A 128 13.849 3.880 -8.776 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.551 4.967 -6.958 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.941 3.278 -6.555 1.00 0.00 H new ATOM 0 HB3 ALA A 128 13.863 4.607 -5.812 1.00 0.00 H new ATOM 1976 N ASP A 129 15.900 6.015 -7.334 1.00 0.00 N ATOM 1977 CA ASP A 129 16.515 7.328 -7.489 1.00 0.00 C ATOM 1978 C ASP A 129 17.512 7.306 -8.642 1.00 0.00 C ATOM 1979 O ASP A 129 18.604 6.749 -8.519 1.00 0.00 O ATOM 1980 CB ASP A 129 17.233 7.721 -6.199 1.00 0.00 C ATOM 1981 CG ASP A 129 17.658 9.183 -6.265 1.00 0.00 C ATOM 1982 OD1 ASP A 129 17.327 9.832 -7.241 1.00 0.00 O ATOM 1983 OD2 ASP A 129 18.310 9.633 -5.334 1.00 0.00 O ATOM 0 H ASP A 129 16.288 5.449 -6.579 1.00 0.00 H new ATOM 0 HA ASP A 129 15.735 8.058 -7.705 1.00 0.00 H new ATOM 0 HB2 ASP A 129 16.575 7.563 -5.344 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.106 7.086 -6.051 1.00 0.00 H new ATOM 1988 N LEU A 130 17.132 7.915 -9.760 1.00 0.00 N ATOM 1989 CA LEU A 130 17.996 7.956 -10.934 1.00 0.00 C ATOM 1990 C LEU A 130 19.248 8.773 -10.666 1.00 0.00 C ATOM 1991 O LEU A 130 20.347 8.383 -11.054 1.00 0.00 O ATOM 1992 CB LEU A 130 17.236 8.563 -12.112 1.00 0.00 C ATOM 1993 CG LEU A 130 16.076 7.638 -12.514 1.00 0.00 C ATOM 1994 CD1 LEU A 130 15.194 8.348 -13.547 1.00 0.00 C ATOM 1995 CD2 LEU A 130 16.613 6.316 -13.104 1.00 0.00 C ATOM 0 H LEU A 130 16.235 8.385 -9.878 1.00 0.00 H new ATOM 0 HA LEU A 130 18.295 6.935 -11.171 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.852 9.547 -11.841 1.00 0.00 H new ATOM 0 HB3 LEU A 130 17.910 8.705 -12.957 1.00 0.00 H new ATOM 0 HG LEU A 130 15.488 7.405 -11.627 1.00 0.00 H new ATOM 0 HD11 LEU A 130 14.371 7.694 -13.834 1.00 0.00 H new ATOM 0 HD12 LEU A 130 14.795 9.266 -13.115 1.00 0.00 H new ATOM 0 HD13 LEU A 130 15.788 8.590 -14.428 1.00 0.00 H new ATOM 0 HD21 LEU A 130 15.776 5.675 -13.382 1.00 0.00 H new ATOM 0 HD22 LEU A 130 17.216 6.530 -13.987 1.00 0.00 H new ATOM 0 HD23 LEU A 130 17.227 5.808 -12.360 1.00 0.00 H new ATOM 2007 N ASP A 131 19.073 9.917 -10.013 1.00 0.00 N ATOM 2008 CA ASP A 131 20.198 10.797 -9.708 1.00 0.00 C ATOM 2009 C ASP A 131 20.819 10.429 -8.367 1.00 0.00 C ATOM 2010 O ASP A 131 21.765 11.072 -7.913 1.00 0.00 O ATOM 2011 CB ASP A 131 19.723 12.249 -9.677 1.00 0.00 C ATOM 2012 CG ASP A 131 18.544 12.398 -8.724 1.00 0.00 C ATOM 2013 OD1 ASP A 131 18.575 11.781 -7.672 1.00 0.00 O ATOM 2014 OD2 ASP A 131 17.630 13.133 -9.054 1.00 0.00 O ATOM 0 H ASP A 131 18.168 10.256 -9.686 1.00 0.00 H new ATOM 0 HA ASP A 131 20.954 10.678 -10.485 1.00 0.00 H new ATOM 0 HB2 ASP A 131 20.539 12.899 -9.362 1.00 0.00 H new ATOM 0 HB3 ASP A 131 19.432 12.565 -10.679 1.00 0.00 H new ATOM 2019 N GLY A 132 20.288 9.386 -7.737 1.00 0.00 N ATOM 2020 CA GLY A 132 20.811 8.941 -6.451 1.00 0.00 C ATOM 2021 C GLY A 132 21.039 10.124 -5.520 1.00 0.00 C ATOM 2022 O GLY A 132 21.967 10.119 -4.712 1.00 0.00 O ATOM 0 H GLY A 132 19.504 8.838 -8.092 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.113 8.241 -5.992 1.00 0.00 H new ATOM 0 HA3 GLY A 132 21.748 8.405 -6.601 1.00 0.00 H new ATOM 2026 N ASP A 133 20.187 11.139 -5.639 1.00 0.00 N ATOM 2027 CA ASP A 133 20.311 12.325 -4.802 1.00 0.00 C ATOM 2028 C ASP A 133 19.918 12.010 -3.363 1.00 0.00 C ATOM 2029 O ASP A 133 20.144 12.814 -2.462 1.00 0.00 O ATOM 2030 CB ASP A 133 19.421 13.445 -5.347 1.00 0.00 C ATOM 2031 CG ASP A 133 17.960 13.012 -5.319 1.00 0.00 C ATOM 2032 OD1 ASP A 133 17.709 11.872 -4.972 1.00 0.00 O ATOM 2033 OD2 ASP A 133 17.112 13.823 -5.651 1.00 0.00 O ATOM 0 H ASP A 133 19.411 11.163 -6.301 1.00 0.00 H new ATOM 0 HA ASP A 133 21.351 12.650 -4.817 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.553 14.348 -4.750 1.00 0.00 H new ATOM 0 HB3 ASP A 133 19.716 13.691 -6.367 1.00 0.00 H new ATOM 2038 N GLY A 134 19.326 10.836 -3.158 1.00 0.00 N ATOM 2039 CA GLY A 134 18.899 10.420 -1.820 1.00 0.00 C ATOM 2040 C GLY A 134 17.420 10.706 -1.603 1.00 0.00 C ATOM 2041 O GLY A 134 16.900 10.528 -0.503 1.00 0.00 O ATOM 0 H GLY A 134 19.131 10.158 -3.895 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.090 9.355 -1.689 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.488 10.944 -1.068 1.00 0.00 H new ATOM 2045 N GLN A 135 16.740 11.146 -2.660 1.00 0.00 N ATOM 2046 CA GLN A 135 15.312 11.452 -2.578 1.00 0.00 C ATOM 2047 C GLN A 135 14.635 11.182 -3.915 1.00 0.00 C ATOM 2048 O GLN A 135 15.291 11.129 -4.955 1.00 0.00 O ATOM 2049 CB GLN A 135 15.121 12.937 -2.182 1.00 0.00 C ATOM 2050 CG GLN A 135 14.866 13.053 -0.681 1.00 0.00 C ATOM 2051 CD GLN A 135 14.972 14.505 -0.242 1.00 0.00 C ATOM 2052 OE1 GLN A 135 15.800 15.254 -0.758 1.00 0.00 O ATOM 2053 NE2 GLN A 135 14.170 14.949 0.684 1.00 0.00 N ATOM 0 H GLN A 135 17.152 11.298 -3.580 1.00 0.00 H new ATOM 0 HA GLN A 135 14.856 10.813 -1.821 1.00 0.00 H new ATOM 0 HB2 GLN A 135 16.007 13.510 -2.453 1.00 0.00 H new ATOM 0 HB3 GLN A 135 14.284 13.364 -2.735 1.00 0.00 H new ATOM 0 HG2 GLN A 135 13.876 12.664 -0.442 1.00 0.00 H new ATOM 0 HG3 GLN A 135 15.588 12.446 -0.134 1.00 0.00 H new ATOM 0 HE21 GLN A 135 13.485 14.323 1.108 1.00 0.00 H new ATOM 0 HE22 GLN A 135 14.227 15.922 0.984 1.00 0.00 H new ATOM 2062 N VAL A 136 13.311 11.026 -3.873 1.00 0.00 N ATOM 2063 CA VAL A 136 12.532 10.778 -5.080 1.00 0.00 C ATOM 2064 C VAL A 136 11.452 11.841 -5.242 1.00 0.00 C ATOM 2065 O VAL A 136 10.638 12.067 -4.347 1.00 0.00 O ATOM 2066 CB VAL A 136 11.889 9.388 -5.001 1.00 0.00 C ATOM 2067 CG1 VAL A 136 10.759 9.272 -6.019 1.00 0.00 C ATOM 2068 CG2 VAL A 136 12.943 8.332 -5.296 1.00 0.00 C ATOM 0 H VAL A 136 12.759 11.067 -3.016 1.00 0.00 H new ATOM 0 HA VAL A 136 13.195 10.821 -5.944 1.00 0.00 H new ATOM 0 HB VAL A 136 11.482 9.239 -4.001 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.310 8.281 -5.953 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.002 10.028 -5.810 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.156 9.425 -7.023 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.491 7.342 -5.241 1.00 0.00 H new ATOM 0 HG22 VAL A 136 13.348 8.491 -6.295 1.00 0.00 H new ATOM 0 HG23 VAL A 136 13.747 8.405 -4.563 1.00 0.00 H new ATOM 2078 N ASN A 137 11.453 12.484 -6.401 1.00 0.00 N ATOM 2079 CA ASN A 137 10.465 13.520 -6.695 1.00 0.00 C ATOM 2080 C ASN A 137 9.246 12.910 -7.384 1.00 0.00 C ATOM 2081 O ASN A 137 9.241 11.729 -7.735 1.00 0.00 O ATOM 2082 CB ASN A 137 11.076 14.593 -7.598 1.00 0.00 C ATOM 2083 CG ASN A 137 12.480 14.940 -7.116 1.00 0.00 C ATOM 2084 OD1 ASN A 137 12.911 14.450 -5.986 1.00 0.00 O flip ATOM 2085 ND2 ASN A 137 13.205 15.670 -7.790 1.00 0.00 N flip ATOM 0 H ASN A 137 12.122 12.310 -7.151 1.00 0.00 H new ATOM 0 HA ASN A 137 10.155 13.975 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 137 11.113 14.236 -8.627 1.00 0.00 H new ATOM 0 HB3 ASN A 137 10.450 15.485 -7.593 1.00 0.00 H new ATOM 0 HD21 ASN A 137 12.865 16.051 -8.673 1.00 0.00 H new ATOM 0 HD22 ASN A 137 14.146 15.894 -7.466 1.00 0.00 H new ATOM 2092 N TYR A 138 8.212 13.725 -7.573 1.00 0.00 N ATOM 2093 CA TYR A 138 6.993 13.261 -8.222 1.00 0.00 C ATOM 2094 C TYR A 138 7.298 12.757 -9.630 1.00 0.00 C ATOM 2095 O TYR A 138 6.744 11.751 -10.069 1.00 0.00 O ATOM 2096 CB TYR A 138 5.968 14.399 -8.290 1.00 0.00 C ATOM 2097 CG TYR A 138 4.747 13.934 -9.049 1.00 0.00 C ATOM 2098 CD1 TYR A 138 3.712 13.259 -8.381 1.00 0.00 C ATOM 2099 CD2 TYR A 138 4.649 14.178 -10.424 1.00 0.00 C ATOM 2100 CE1 TYR A 138 2.585 12.831 -9.091 1.00 0.00 C ATOM 2101 CE2 TYR A 138 3.520 13.748 -11.132 1.00 0.00 C ATOM 2102 CZ TYR A 138 2.490 13.075 -10.466 1.00 0.00 C ATOM 2103 OH TYR A 138 1.378 12.652 -11.164 1.00 0.00 O ATOM 0 H TYR A 138 8.195 14.704 -7.287 1.00 0.00 H new ATOM 0 HA TYR A 138 6.580 12.440 -7.636 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.687 14.710 -7.284 1.00 0.00 H new ATOM 0 HB3 TYR A 138 6.406 15.268 -8.782 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.786 13.071 -7.320 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.444 14.698 -10.938 1.00 0.00 H new ATOM 0 HE1 TYR A 138 1.788 12.312 -8.578 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.444 13.936 -12.193 1.00 0.00 H new ATOM 0 HH TYR A 138 1.470 12.901 -12.107 1.00 0.00 H new ATOM 2113 N GLU A 139 8.173 13.467 -10.334 1.00 0.00 N ATOM 2114 CA GLU A 139 8.531 13.080 -11.694 1.00 0.00 C ATOM 2115 C GLU A 139 9.148 11.683 -11.713 1.00 0.00 C ATOM 2116 O GLU A 139 8.680 10.789 -12.427 1.00 0.00 O ATOM 2117 CB GLU A 139 9.526 14.091 -12.268 1.00 0.00 C ATOM 2118 CG GLU A 139 9.793 13.761 -13.737 1.00 0.00 C ATOM 2119 CD GLU A 139 10.692 14.830 -14.355 1.00 0.00 C ATOM 2120 OE1 GLU A 139 11.244 15.619 -13.606 1.00 0.00 O ATOM 2121 OE2 GLU A 139 10.815 14.841 -15.570 1.00 0.00 O ATOM 0 H GLU A 139 8.643 14.305 -9.991 1.00 0.00 H new ATOM 0 HA GLU A 139 7.627 13.067 -12.303 1.00 0.00 H new ATOM 0 HB2 GLU A 139 9.128 15.102 -12.177 1.00 0.00 H new ATOM 0 HB3 GLU A 139 10.457 14.063 -11.702 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.267 12.783 -13.819 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.851 13.705 -14.283 1.00 0.00 H new ATOM 2128 N GLU A 140 10.190 11.493 -10.911 1.00 0.00 N ATOM 2129 CA GLU A 140 10.855 10.197 -10.836 1.00 0.00 C ATOM 2130 C GLU A 140 9.876 9.128 -10.367 1.00 0.00 C ATOM 2131 O GLU A 140 9.944 7.978 -10.803 1.00 0.00 O ATOM 2132 CB GLU A 140 12.043 10.273 -9.872 1.00 0.00 C ATOM 2133 CG GLU A 140 13.146 11.141 -10.478 1.00 0.00 C ATOM 2134 CD GLU A 140 14.295 11.296 -9.484 1.00 0.00 C ATOM 2135 OE1 GLU A 140 14.291 10.592 -8.490 1.00 0.00 O ATOM 2136 OE2 GLU A 140 15.158 12.126 -9.727 1.00 0.00 O ATOM 0 H GLU A 140 10.590 12.213 -10.309 1.00 0.00 H new ATOM 0 HA GLU A 140 11.217 9.932 -11.829 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.722 10.690 -8.917 1.00 0.00 H new ATOM 0 HB3 GLU A 140 12.424 9.272 -9.671 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.511 10.688 -11.400 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.746 12.121 -10.740 1.00 0.00 H new ATOM 2143 N PHE A 141 8.965 9.515 -9.483 1.00 0.00 N ATOM 2144 CA PHE A 141 7.972 8.578 -8.969 1.00 0.00 C ATOM 2145 C PHE A 141 7.096 8.046 -10.102 1.00 0.00 C ATOM 2146 O PHE A 141 6.848 6.842 -10.198 1.00 0.00 O ATOM 2147 CB PHE A 141 7.095 9.273 -7.925 1.00 0.00 C ATOM 2148 CG PHE A 141 6.098 8.284 -7.371 1.00 0.00 C ATOM 2149 CD1 PHE A 141 6.542 7.216 -6.582 1.00 0.00 C ATOM 2150 CD2 PHE A 141 4.730 8.433 -7.640 1.00 0.00 C ATOM 2151 CE1 PHE A 141 5.621 6.304 -6.062 1.00 0.00 C ATOM 2152 CE2 PHE A 141 3.813 7.517 -7.120 1.00 0.00 C ATOM 2153 CZ PHE A 141 4.261 6.456 -6.330 1.00 0.00 C ATOM 0 H PHE A 141 8.892 10.461 -9.110 1.00 0.00 H new ATOM 0 HA PHE A 141 8.494 7.740 -8.508 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.714 9.672 -7.121 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.574 10.118 -8.375 1.00 0.00 H new ATOM 0 HD1 PHE A 141 7.595 7.098 -6.376 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.386 9.256 -8.249 1.00 0.00 H new ATOM 0 HE1 PHE A 141 5.962 5.481 -5.452 1.00 0.00 H new ATOM 0 HE2 PHE A 141 2.759 7.629 -7.328 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.551 5.750 -5.925 1.00 0.00 H new ATOM 2163 N VAL A 142 6.627 8.952 -10.954 1.00 0.00 N ATOM 2164 CA VAL A 142 5.772 8.564 -12.069 1.00 0.00 C ATOM 2165 C VAL A 142 6.502 7.584 -12.977 1.00 0.00 C ATOM 2166 O VAL A 142 5.941 6.566 -13.383 1.00 0.00 O ATOM 2167 CB VAL A 142 5.366 9.807 -12.872 1.00 0.00 C ATOM 2168 CG1 VAL A 142 4.633 9.378 -14.152 1.00 0.00 C ATOM 2169 CG2 VAL A 142 4.439 10.686 -12.024 1.00 0.00 C ATOM 0 H VAL A 142 6.823 9.951 -10.895 1.00 0.00 H new ATOM 0 HA VAL A 142 4.878 8.082 -11.673 1.00 0.00 H new ATOM 0 HB VAL A 142 6.260 10.371 -13.138 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.346 10.262 -14.721 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.292 8.756 -14.757 1.00 0.00 H new ATOM 0 HG13 VAL A 142 3.740 8.811 -13.887 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.151 11.569 -12.595 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.547 10.121 -11.756 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.959 10.995 -11.117 1.00 0.00 H new ATOM 2179 N LYS A 143 7.754 7.892 -13.292 1.00 0.00 N ATOM 2180 CA LYS A 143 8.538 7.023 -14.161 1.00 0.00 C ATOM 2181 C LYS A 143 8.675 5.631 -13.554 1.00 0.00 C ATOM 2182 O LYS A 143 8.636 4.628 -14.265 1.00 0.00 O ATOM 2183 CB LYS A 143 9.923 7.623 -14.386 1.00 0.00 C ATOM 2184 CG LYS A 143 9.805 8.891 -15.242 1.00 0.00 C ATOM 2185 CD LYS A 143 11.194 9.331 -15.721 1.00 0.00 C ATOM 2186 CE LYS A 143 11.999 9.896 -14.549 1.00 0.00 C ATOM 2187 NZ LYS A 143 13.241 10.530 -15.065 1.00 0.00 N ATOM 0 H LYS A 143 8.243 8.725 -12.964 1.00 0.00 H new ATOM 0 HA LYS A 143 8.020 6.937 -15.116 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.387 7.861 -13.429 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.568 6.897 -14.881 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.158 8.702 -16.099 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.341 9.689 -14.662 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.721 8.484 -16.160 1.00 0.00 H new ATOM 0 HD3 LYS A 143 11.096 10.085 -16.502 1.00 0.00 H new ATOM 0 HE2 LYS A 143 11.403 10.628 -14.003 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.248 9.100 -13.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 13.790 10.915 -14.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 13.811 9.820 -15.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 12.992 11.300 -15.719 1.00 0.00 H new ATOM 2201 N MET A 144 8.833 5.578 -12.241 1.00 0.00 N ATOM 2202 CA MET A 144 8.965 4.301 -11.542 1.00 0.00 C ATOM 2203 C MET A 144 7.650 3.524 -11.600 1.00 0.00 C ATOM 2204 O MET A 144 7.637 2.294 -11.596 1.00 0.00 O ATOM 2205 CB MET A 144 9.380 4.549 -10.085 1.00 0.00 C ATOM 2206 CG MET A 144 10.876 4.850 -10.028 1.00 0.00 C ATOM 2207 SD MET A 144 11.792 3.324 -10.363 1.00 0.00 S ATOM 2208 CE MET A 144 11.346 2.433 -8.845 1.00 0.00 C ATOM 0 H MET A 144 8.873 6.398 -11.636 1.00 0.00 H new ATOM 0 HA MET A 144 9.735 3.705 -12.032 1.00 0.00 H new ATOM 0 HB2 MET A 144 8.814 5.383 -9.671 1.00 0.00 H new ATOM 0 HB3 MET A 144 9.150 3.675 -9.476 1.00 0.00 H new ATOM 0 HG2 MET A 144 11.135 5.614 -10.761 1.00 0.00 H new ATOM 0 HG3 MET A 144 11.145 5.244 -9.048 1.00 0.00 H new ATOM 0 HE1 MET A 144 12.241 1.992 -8.406 1.00 0.00 H new ATOM 0 HE2 MET A 144 10.898 3.127 -8.134 1.00 0.00 H new ATOM 0 HE3 MET A 144 10.632 1.645 -9.082 1.00 0.00 H new ATOM 2218 N MET A 145 6.546 4.258 -11.648 1.00 0.00 N ATOM 2219 CA MET A 145 5.222 3.641 -11.716 1.00 0.00 C ATOM 2220 C MET A 145 4.953 3.065 -13.101 1.00 0.00 C ATOM 2221 O MET A 145 4.207 2.094 -13.243 1.00 0.00 O ATOM 2222 CB MET A 145 4.131 4.661 -11.337 1.00 0.00 C ATOM 2223 CG MET A 145 3.913 4.659 -9.823 1.00 0.00 C ATOM 2224 SD MET A 145 3.036 3.143 -9.368 1.00 0.00 S ATOM 2225 CE MET A 145 3.179 3.325 -7.578 1.00 0.00 C ATOM 0 H MET A 145 6.538 5.278 -11.641 1.00 0.00 H new ATOM 0 HA MET A 145 5.198 2.820 -10.999 1.00 0.00 H new ATOM 0 HB2 MET A 145 4.423 5.657 -11.669 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.199 4.415 -11.847 1.00 0.00 H new ATOM 0 HG2 MET A 145 4.869 4.713 -9.303 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.337 5.534 -9.523 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.759 2.447 -7.088 1.00 0.00 H new ATOM 0 HE2 MET A 145 4.230 3.425 -7.305 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.635 4.214 -7.258 1.00 0.00 H new ATOM 2235 N MET A 146 5.554 3.667 -14.112 1.00 0.00 N ATOM 2236 CA MET A 146 5.362 3.205 -15.478 1.00 0.00 C ATOM 2237 C MET A 146 5.748 1.738 -15.612 1.00 0.00 C ATOM 2238 O MET A 146 6.348 1.157 -14.710 1.00 0.00 O ATOM 2239 CB MET A 146 6.211 4.046 -16.431 1.00 0.00 C ATOM 2240 CG MET A 146 5.636 5.462 -16.530 1.00 0.00 C ATOM 2241 SD MET A 146 4.032 5.413 -17.368 1.00 0.00 S ATOM 2242 CE MET A 146 4.636 5.015 -19.027 1.00 0.00 C ATOM 0 H MET A 146 6.175 4.471 -14.016 1.00 0.00 H new ATOM 0 HA MET A 146 4.308 3.312 -15.733 1.00 0.00 H new ATOM 0 HB2 MET A 146 7.241 4.086 -16.075 1.00 0.00 H new ATOM 0 HB3 MET A 146 6.232 3.583 -17.418 1.00 0.00 H new ATOM 0 HG2 MET A 146 5.524 5.890 -15.534 1.00 0.00 H new ATOM 0 HG3 MET A 146 6.324 6.106 -17.078 1.00 0.00 H new ATOM 0 HE1 MET A 146 3.952 5.423 -19.771 1.00 0.00 H new ATOM 0 HE2 MET A 146 5.626 5.449 -19.168 1.00 0.00 H new ATOM 0 HE3 MET A 146 4.694 3.933 -19.143 1.00 0.00 H new ATOM 2252 N THR A 147 5.377 1.138 -16.738 1.00 0.00 N ATOM 2253 CA THR A 147 5.678 -0.268 -16.971 1.00 0.00 C ATOM 2254 C THR A 147 7.122 -0.562 -16.626 1.00 0.00 C ATOM 2255 O THR A 147 7.392 -1.494 -15.876 1.00 0.00 O ATOM 2256 CB THR A 147 5.404 -0.622 -18.454 1.00 0.00 C ATOM 2257 OG1 THR A 147 5.281 0.578 -19.201 1.00 0.00 O ATOM 2258 CG2 THR A 147 4.118 -1.434 -18.575 1.00 0.00 C ATOM 0 H THR A 147 4.873 1.598 -17.496 1.00 0.00 H new ATOM 0 HA THR A 147 5.038 -0.877 -16.332 1.00 0.00 H new ATOM 0 HB THR A 147 6.231 -1.218 -18.840 1.00 0.00 H new ATOM 0 HG1 THR A 147 5.109 0.362 -20.141 1.00 0.00 H new ATOM 0 HG21 THR A 147 3.938 -1.676 -19.622 1.00 0.00 H new ATOM 0 HG22 THR A 147 4.214 -2.356 -18.001 1.00 0.00 H new ATOM 0 HG23 THR A 147 3.282 -0.851 -18.188 1.00 0.00 H new ATOM 2266 N VAL A 148 8.033 0.233 -17.176 1.00 0.00 N ATOM 2267 CA VAL A 148 9.456 0.051 -16.921 1.00 0.00 C ATOM 2268 C VAL A 148 9.933 -1.306 -17.400 1.00 0.00 C ATOM 2269 O VAL A 148 10.706 -1.392 -18.354 1.00 0.00 O ATOM 2270 CB VAL A 148 9.753 0.213 -15.430 1.00 0.00 C ATOM 2271 CG1 VAL A 148 11.247 0.006 -15.182 1.00 0.00 C ATOM 2272 CG2 VAL A 148 9.335 1.620 -14.973 1.00 0.00 C ATOM 0 H VAL A 148 7.811 1.009 -17.800 1.00 0.00 H new ATOM 0 HA VAL A 148 9.995 0.817 -17.479 1.00 0.00 H new ATOM 0 HB VAL A 148 9.190 -0.528 -14.863 1.00 0.00 H new ATOM 0 HG11 VAL A 148 11.459 0.122 -14.119 1.00 0.00 H new ATOM 0 HG12 VAL A 148 11.534 -0.996 -15.502 1.00 0.00 H new ATOM 0 HG13 VAL A 148 11.815 0.744 -15.748 1.00 0.00 H new ATOM 0 HG21 VAL A 148 9.547 1.735 -13.910 1.00 0.00 H new ATOM 0 HG22 VAL A 148 9.894 2.367 -15.537 1.00 0.00 H new ATOM 0 HG23 VAL A 148 8.268 1.757 -15.147 1.00 0.00 H new ATOM 2282 N ARG A 149 9.450 -2.350 -16.745 1.00 0.00 N ATOM 2283 CA ARG A 149 9.805 -3.723 -17.098 1.00 0.00 C ATOM 2284 C ARG A 149 11.250 -3.798 -17.589 1.00 0.00 C ATOM 2285 O ARG A 149 12.070 -3.071 -17.056 1.00 0.00 O ATOM 2286 CB ARG A 149 8.863 -4.261 -18.189 1.00 0.00 C ATOM 2287 CG ARG A 149 8.933 -3.367 -19.432 1.00 0.00 C ATOM 2288 CD ARG A 149 8.153 -4.011 -20.568 1.00 0.00 C ATOM 2289 NE ARG A 149 8.241 -3.176 -21.763 1.00 0.00 N ATOM 2290 CZ ARG A 149 7.370 -2.198 -21.991 1.00 0.00 C ATOM 2291 NH1 ARG A 149 6.411 -1.966 -21.140 1.00 0.00 N ATOM 2292 NH2 ARG A 149 7.477 -1.468 -23.069 1.00 0.00 N ATOM 2293 OXT ARG A 149 11.512 -4.578 -18.491 1.00 0.00 O ATOM 0 H ARG A 149 8.805 -2.275 -15.958 1.00 0.00 H new ATOM 0 HA ARG A 149 9.702 -4.336 -16.203 1.00 0.00 H new ATOM 0 HB2 ARG A 149 9.141 -5.282 -18.450 1.00 0.00 H new ATOM 0 HB3 ARG A 149 7.840 -4.295 -17.813 1.00 0.00 H new ATOM 0 HG2 ARG A 149 8.522 -2.382 -19.208 1.00 0.00 H new ATOM 0 HG3 ARG A 149 9.972 -3.219 -19.728 1.00 0.00 H new ATOM 0 HD2 ARG A 149 8.550 -5.004 -20.777 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.110 -4.139 -20.279 1.00 0.00 H new ATOM 0 HE ARG A 149 8.987 -3.347 -22.437 1.00 0.00 H new ATOM 0 HH11 ARG A 149 6.328 -2.535 -20.298 1.00 0.00 H new ATOM 0 HH12 ARG A 149 5.743 -1.215 -21.316 1.00 0.00 H new ATOM 0 HH21 ARG A 149 8.228 -1.649 -23.735 1.00 0.00 H new ATOM 0 HH22 ARG A 149 6.809 -0.717 -23.245 1.00 0.00 H new TER 2307 ARG A 149 ATOM 2308 N ALA B 19 13.310 -3.899 -7.760 1.00 0.00 N ATOM 2309 CA ALA B 19 13.052 -2.708 -6.900 1.00 0.00 C ATOM 2310 C ALA B 19 11.690 -2.116 -7.246 1.00 0.00 C ATOM 2311 O ALA B 19 10.988 -1.592 -6.381 1.00 0.00 O ATOM 2312 CB ALA B 19 14.148 -1.669 -7.134 1.00 0.00 C ATOM 0 HA ALA B 19 13.055 -3.004 -5.851 1.00 0.00 H new ATOM 0 HB1 ALA B 19 13.963 -0.797 -6.507 1.00 0.00 H new ATOM 0 HB2 ALA B 19 15.117 -2.099 -6.880 1.00 0.00 H new ATOM 0 HB3 ALA B 19 14.147 -1.369 -8.182 1.00 0.00 H new ATOM 2320 N ARG B 20 11.319 -2.209 -8.519 1.00 0.00 N ATOM 2321 CA ARG B 20 10.036 -1.683 -8.972 1.00 0.00 C ATOM 2322 C ARG B 20 8.893 -2.373 -8.239 1.00 0.00 C ATOM 2323 O ARG B 20 7.884 -1.747 -7.915 1.00 0.00 O ATOM 2324 CB ARG B 20 9.890 -1.890 -10.482 1.00 0.00 C ATOM 2325 CG ARG B 20 10.215 -3.341 -10.834 1.00 0.00 C ATOM 2326 CD ARG B 20 10.118 -3.536 -12.345 1.00 0.00 C ATOM 2327 NE ARG B 20 8.732 -3.407 -12.783 1.00 0.00 N ATOM 2328 CZ ARG B 20 7.900 -4.445 -12.758 1.00 0.00 C ATOM 2329 NH1 ARG B 20 8.319 -5.607 -12.337 1.00 0.00 N ATOM 2330 NH2 ARG B 20 6.664 -4.303 -13.153 1.00 0.00 N ATOM 0 H ARG B 20 11.884 -2.640 -9.251 1.00 0.00 H new ATOM 0 HA ARG B 20 9.998 -0.616 -8.753 1.00 0.00 H new ATOM 0 HB2 ARG B 20 8.875 -1.648 -10.796 1.00 0.00 H new ATOM 0 HB3 ARG B 20 10.559 -1.217 -11.018 1.00 0.00 H new ATOM 0 HG2 ARG B 20 11.217 -3.594 -10.488 1.00 0.00 H new ATOM 0 HG3 ARG B 20 9.523 -4.013 -10.325 1.00 0.00 H new ATOM 0 HD2 ARG B 20 10.738 -2.798 -12.855 1.00 0.00 H new ATOM 0 HD3 ARG B 20 10.503 -4.519 -12.617 1.00 0.00 H new ATOM 0 HE ARG B 20 8.394 -2.503 -13.115 1.00 0.00 H new ATOM 0 HH11 ARG B 20 9.284 -5.719 -12.027 1.00 0.00 H new ATOM 0 HH12 ARG B 20 7.681 -6.403 -12.318 1.00 0.00 H new ATOM 0 HH21 ARG B 20 6.335 -3.395 -13.482 1.00 0.00 H new ATOM 0 HH22 ARG B 20 6.028 -5.100 -13.133 1.00 0.00 H new ATOM 2344 N GLN B 21 9.057 -3.663 -7.974 1.00 0.00 N ATOM 2345 CA GLN B 21 8.032 -4.419 -7.271 1.00 0.00 C ATOM 2346 C GLN B 21 7.863 -3.898 -5.854 1.00 0.00 C ATOM 2347 O GLN B 21 6.742 -3.762 -5.365 1.00 0.00 O ATOM 2348 CB GLN B 21 8.409 -5.907 -7.234 1.00 0.00 C ATOM 2349 CG GLN B 21 8.227 -6.529 -8.622 1.00 0.00 C ATOM 2350 CD GLN B 21 6.745 -6.574 -8.981 1.00 0.00 C ATOM 2351 OE1 GLN B 21 6.348 -6.122 -10.138 1.00 0.00 O flip ATOM 2352 NE2 GLN B 21 5.927 -7.029 -8.181 1.00 0.00 N flip ATOM 0 H GLN B 21 9.883 -4.203 -8.233 1.00 0.00 H new ATOM 0 HA GLN B 21 7.089 -4.299 -7.804 1.00 0.00 H new ATOM 0 HB2 GLN B 21 9.443 -6.020 -6.908 1.00 0.00 H new ATOM 0 HB3 GLN B 21 7.787 -6.430 -6.508 1.00 0.00 H new ATOM 0 HG2 GLN B 21 8.773 -5.947 -9.365 1.00 0.00 H new ATOM 0 HG3 GLN B 21 8.644 -7.536 -8.636 1.00 0.00 H new ATOM 0 HE21 GLN B 21 6.240 -7.382 -7.277 1.00 0.00 H new ATOM 0 HE22 GLN B 21 4.936 -7.053 -8.423 1.00 0.00 H new ATOM 2361 N ARG B 22 8.974 -3.597 -5.197 1.00 0.00 N ATOM 2362 CA ARG B 22 8.926 -3.087 -3.835 1.00 0.00 C ATOM 2363 C ARG B 22 8.191 -1.759 -3.802 1.00 0.00 C ATOM 2364 O ARG B 22 7.431 -1.485 -2.874 1.00 0.00 O ATOM 2365 CB ARG B 22 10.354 -2.916 -3.304 1.00 0.00 C ATOM 2366 CG ARG B 22 10.992 -4.299 -3.062 1.00 0.00 C ATOM 2367 CD ARG B 22 10.650 -4.801 -1.655 1.00 0.00 C ATOM 2368 NE ARG B 22 11.108 -6.173 -1.485 1.00 0.00 N ATOM 2369 CZ ARG B 22 12.369 -6.446 -1.177 1.00 0.00 C ATOM 2370 NH1 ARG B 22 13.227 -5.474 -1.026 1.00 0.00 N ATOM 2371 NH2 ARG B 22 12.748 -7.682 -1.027 1.00 0.00 N ATOM 0 H ARG B 22 9.913 -3.696 -5.582 1.00 0.00 H new ATOM 0 HA ARG B 22 8.391 -3.795 -3.202 1.00 0.00 H new ATOM 0 HB2 ARG B 22 10.952 -2.350 -4.018 1.00 0.00 H new ATOM 0 HB3 ARG B 22 10.340 -2.344 -2.376 1.00 0.00 H new ATOM 0 HG2 ARG B 22 10.632 -5.009 -3.807 1.00 0.00 H new ATOM 0 HG3 ARG B 22 12.074 -4.234 -3.180 1.00 0.00 H new ATOM 0 HD2 ARG B 22 11.117 -4.159 -0.908 1.00 0.00 H new ATOM 0 HD3 ARG B 22 9.573 -4.747 -1.493 1.00 0.00 H new ATOM 0 HE ARG B 22 10.446 -6.939 -1.605 1.00 0.00 H new ATOM 0 HH11 ARG B 22 12.927 -4.506 -1.145 1.00 0.00 H new ATOM 0 HH12 ARG B 22 14.197 -5.682 -0.789 1.00 0.00 H new ATOM 0 HH21 ARG B 22 12.076 -8.440 -1.146 1.00 0.00 H new ATOM 0 HH22 ARG B 22 13.717 -7.893 -0.790 1.00 0.00 H new ATOM 2385 N TRP B 23 8.416 -0.940 -4.818 1.00 0.00 N ATOM 2386 CA TRP B 23 7.754 0.356 -4.883 1.00 0.00 C ATOM 2387 C TRP B 23 6.248 0.169 -5.071 1.00 0.00 C ATOM 2388 O TRP B 23 5.432 0.734 -4.326 1.00 0.00 O ATOM 2389 CB TRP B 23 8.354 1.184 -6.052 1.00 0.00 C ATOM 2390 CG TRP B 23 9.213 2.284 -5.515 1.00 0.00 C ATOM 2391 CD1 TRP B 23 10.548 2.388 -5.698 1.00 0.00 C ATOM 2392 CD2 TRP B 23 8.821 3.426 -4.710 1.00 0.00 C ATOM 2393 NE1 TRP B 23 10.996 3.533 -5.065 1.00 0.00 N ATOM 2394 CE2 TRP B 23 9.968 4.204 -4.438 1.00 0.00 C ATOM 2395 CE3 TRP B 23 7.588 3.857 -4.196 1.00 0.00 C ATOM 2396 CZ2 TRP B 23 9.888 5.371 -3.681 1.00 0.00 C ATOM 2397 CZ3 TRP B 23 7.510 5.026 -3.432 1.00 0.00 C ATOM 2398 CH2 TRP B 23 8.658 5.776 -3.180 1.00 0.00 C ATOM 0 H TRP B 23 9.041 -1.144 -5.598 1.00 0.00 H new ATOM 0 HA TRP B 23 7.916 0.894 -3.949 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.943 0.537 -6.702 1.00 0.00 H new ATOM 0 HB3 TRP B 23 7.552 1.602 -6.661 1.00 0.00 H new ATOM 0 HD1 TRP B 23 11.164 1.692 -6.248 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.968 3.843 -5.062 1.00 0.00 H new ATOM 0 HE3 TRP B 23 6.694 3.283 -4.392 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 10.775 5.955 -3.486 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 6.558 5.348 -3.036 1.00 0.00 H new ATOM 0 HH2 TRP B 23 8.590 6.679 -2.591 1.00 0.00 H new ATOM 2409 N ARG B 24 5.889 -0.635 -6.063 1.00 0.00 N ATOM 2410 CA ARG B 24 4.490 -0.894 -6.338 1.00 0.00 C ATOM 2411 C ARG B 24 3.863 -1.651 -5.185 1.00 0.00 C ATOM 2412 O ARG B 24 2.708 -1.420 -4.839 1.00 0.00 O ATOM 2413 CB ARG B 24 4.345 -1.691 -7.636 1.00 0.00 C ATOM 2414 CG ARG B 24 4.682 -0.800 -8.833 1.00 0.00 C ATOM 2415 CD ARG B 24 4.671 -1.638 -10.111 1.00 0.00 C ATOM 2416 NE ARG B 24 3.337 -2.179 -10.352 1.00 0.00 N ATOM 2417 CZ ARG B 24 3.115 -3.049 -11.332 1.00 0.00 C ATOM 2418 NH1 ARG B 24 4.099 -3.435 -12.100 1.00 0.00 N ATOM 2419 NH2 ARG B 24 1.914 -3.521 -11.528 1.00 0.00 N ATOM 0 H ARG B 24 6.543 -1.113 -6.683 1.00 0.00 H new ATOM 0 HA ARG B 24 3.973 0.059 -6.454 1.00 0.00 H new ATOM 0 HB2 ARG B 24 5.007 -2.557 -7.618 1.00 0.00 H new ATOM 0 HB3 ARG B 24 3.327 -2.070 -7.729 1.00 0.00 H new ATOM 0 HG2 ARG B 24 3.958 0.011 -8.911 1.00 0.00 H new ATOM 0 HG3 ARG B 24 5.661 -0.342 -8.694 1.00 0.00 H new ATOM 0 HD2 ARG B 24 4.981 -1.026 -10.958 1.00 0.00 H new ATOM 0 HD3 ARG B 24 5.391 -2.452 -10.026 1.00 0.00 H new ATOM 0 HE ARG B 24 2.562 -1.884 -9.758 1.00 0.00 H new ATOM 0 HH11 ARG B 24 5.039 -3.069 -11.948 1.00 0.00 H new ATOM 0 HH12 ARG B 24 3.927 -4.103 -12.852 1.00 0.00 H new ATOM 0 HH21 ARG B 24 1.145 -3.222 -10.929 1.00 0.00 H new ATOM 0 HH22 ARG B 24 1.745 -4.189 -12.280 1.00 0.00 H new ATOM 2433 N SER B 25 4.636 -2.555 -4.593 1.00 0.00 N ATOM 2434 CA SER B 25 4.142 -3.336 -3.473 1.00 0.00 C ATOM 2435 C SER B 25 3.751 -2.417 -2.327 1.00 0.00 C ATOM 2436 O SER B 25 2.698 -2.586 -1.722 1.00 0.00 O ATOM 2437 CB SER B 25 5.216 -4.315 -2.999 1.00 0.00 C ATOM 2438 OG SER B 25 5.496 -5.251 -4.033 1.00 0.00 O ATOM 0 H SER B 25 5.596 -2.761 -4.868 1.00 0.00 H new ATOM 0 HA SER B 25 3.266 -3.896 -3.799 1.00 0.00 H new ATOM 0 HB2 SER B 25 6.123 -3.774 -2.729 1.00 0.00 H new ATOM 0 HB3 SER B 25 4.878 -4.837 -2.104 1.00 0.00 H new ATOM 0 HG SER B 25 5.905 -4.786 -4.793 1.00 0.00 H new ATOM 2444 N SER B 26 4.592 -1.438 -2.034 1.00 0.00 N ATOM 2445 CA SER B 26 4.290 -0.512 -0.949 1.00 0.00 C ATOM 2446 C SER B 26 2.984 0.221 -1.230 1.00 0.00 C ATOM 2447 O SER B 26 2.138 0.368 -0.342 1.00 0.00 O ATOM 2448 CB SER B 26 5.426 0.494 -0.801 1.00 0.00 C ATOM 2449 OG SER B 26 5.322 1.151 0.452 1.00 0.00 O ATOM 0 H SER B 26 5.472 -1.264 -2.519 1.00 0.00 H new ATOM 0 HA SER B 26 4.184 -1.076 -0.022 1.00 0.00 H new ATOM 0 HB2 SER B 26 6.387 -0.014 -0.877 1.00 0.00 H new ATOM 0 HB3 SER B 26 5.386 1.224 -1.610 1.00 0.00 H new ATOM 0 HG SER B 26 6.054 1.796 0.545 1.00 0.00 H new ATOM 2455 N VAL B 27 2.825 0.676 -2.466 1.00 0.00 N ATOM 2456 CA VAL B 27 1.608 1.384 -2.851 1.00 0.00 C ATOM 2457 C VAL B 27 0.421 0.418 -2.911 1.00 0.00 C ATOM 2458 O VAL B 27 -0.694 0.746 -2.511 1.00 0.00 O ATOM 2459 CB VAL B 27 1.801 2.060 -4.205 1.00 0.00 C ATOM 2460 CG1 VAL B 27 0.492 2.717 -4.648 1.00 0.00 C ATOM 2461 CG2 VAL B 27 2.897 3.121 -4.090 1.00 0.00 C ATOM 0 H VAL B 27 3.513 0.570 -3.212 1.00 0.00 H new ATOM 0 HA VAL B 27 1.398 2.146 -2.100 1.00 0.00 H new ATOM 0 HB VAL B 27 2.092 1.314 -4.944 1.00 0.00 H new ATOM 0 HG11 VAL B 27 0.636 3.198 -5.615 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.286 1.958 -4.732 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.192 3.463 -3.912 1.00 0.00 H new ATOM 0 HG21 VAL B 27 3.037 3.606 -5.056 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.606 3.866 -3.349 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.830 2.649 -3.783 1.00 0.00 H new ATOM 2471 N SER B 28 0.657 -0.766 -3.444 1.00 0.00 N ATOM 2472 CA SER B 28 -0.409 -1.749 -3.562 1.00 0.00 C ATOM 2473 C SER B 28 -0.790 -2.309 -2.200 1.00 0.00 C ATOM 2474 O SER B 28 -1.964 -2.572 -1.936 1.00 0.00 O ATOM 2475 CB SER B 28 0.039 -2.887 -4.479 1.00 0.00 C ATOM 2476 OG SER B 28 0.936 -3.726 -3.766 1.00 0.00 O ATOM 0 H SER B 28 1.564 -1.070 -3.798 1.00 0.00 H new ATOM 0 HA SER B 28 -1.284 -1.256 -3.987 1.00 0.00 H new ATOM 0 HB2 SER B 28 -0.824 -3.460 -4.818 1.00 0.00 H new ATOM 0 HB3 SER B 28 0.525 -2.486 -5.368 1.00 0.00 H new ATOM 0 HG SER B 28 1.228 -4.460 -4.346 1.00 0.00 H new ATOM 2482 N ILE B 29 0.201 -2.483 -1.340 1.00 0.00 N ATOM 2483 CA ILE B 29 -0.048 -3.005 -0.007 1.00 0.00 C ATOM 2484 C ILE B 29 -0.868 -2.021 0.806 1.00 0.00 C ATOM 2485 O ILE B 29 -1.802 -2.406 1.510 1.00 0.00 O ATOM 2486 CB ILE B 29 1.283 -3.304 0.692 1.00 0.00 C ATOM 2487 CG1 ILE B 29 1.932 -4.552 0.072 1.00 0.00 C ATOM 2488 CG2 ILE B 29 1.051 -3.544 2.190 1.00 0.00 C ATOM 2489 CD1 ILE B 29 3.419 -4.591 0.438 1.00 0.00 C ATOM 0 H ILE B 29 1.179 -2.272 -1.540 1.00 0.00 H new ATOM 0 HA ILE B 29 -0.617 -3.931 -0.092 1.00 0.00 H new ATOM 0 HB ILE B 29 1.945 -2.448 0.563 1.00 0.00 H new ATOM 0 HG12 ILE B 29 1.434 -5.452 0.434 1.00 0.00 H new ATOM 0 HG13 ILE B 29 1.814 -4.536 -1.011 1.00 0.00 H new ATOM 0 HG21 ILE B 29 2.003 -3.755 2.676 1.00 0.00 H new ATOM 0 HG22 ILE B 29 0.605 -2.655 2.636 1.00 0.00 H new ATOM 0 HG23 ILE B 29 0.380 -4.392 2.323 1.00 0.00 H new ATOM 0 HD11 ILE B 29 3.879 -5.476 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE B 29 3.912 -3.698 0.054 1.00 0.00 H new ATOM 0 HD13 ILE B 29 3.526 -4.627 1.522 1.00 0.00 H new ATOM 2501 N VAL B 30 -0.509 -0.748 0.727 1.00 0.00 N ATOM 2502 CA VAL B 30 -1.214 0.259 1.480 1.00 0.00 C ATOM 2503 C VAL B 30 -2.660 0.338 1.012 1.00 0.00 C ATOM 2504 O VAL B 30 -3.575 0.559 1.818 1.00 0.00 O ATOM 2505 CB VAL B 30 -0.504 1.635 1.311 1.00 0.00 C ATOM 2506 CG1 VAL B 30 -1.114 2.445 0.154 1.00 0.00 C ATOM 2507 CG2 VAL B 30 -0.632 2.451 2.592 1.00 0.00 C ATOM 0 H VAL B 30 0.259 -0.398 0.154 1.00 0.00 H new ATOM 0 HA VAL B 30 -1.208 -0.008 2.537 1.00 0.00 H new ATOM 0 HB VAL B 30 0.545 1.435 1.091 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -0.595 3.399 0.064 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -1.009 1.886 -0.776 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -2.171 2.624 0.353 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -0.132 3.411 2.463 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -1.686 2.617 2.814 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -0.169 1.909 3.417 1.00 0.00 H new ATOM 2517 N LYS B 31 -2.865 0.165 -0.293 1.00 0.00 N ATOM 2518 CA LYS B 31 -4.204 0.231 -0.839 1.00 0.00 C ATOM 2519 C LYS B 31 -5.020 -0.969 -0.400 1.00 0.00 C ATOM 2520 O LYS B 31 -6.160 -0.826 0.048 1.00 0.00 O ATOM 2521 CB LYS B 31 -4.121 0.295 -2.372 1.00 0.00 C ATOM 2522 CG LYS B 31 -3.749 1.717 -2.838 1.00 0.00 C ATOM 2523 CD LYS B 31 -5.022 2.560 -2.981 1.00 0.00 C ATOM 2524 CE LYS B 31 -4.655 3.966 -3.433 1.00 0.00 C ATOM 2525 NZ LYS B 31 -5.894 4.779 -3.572 1.00 0.00 N ATOM 0 H LYS B 31 -2.130 -0.019 -0.976 1.00 0.00 H new ATOM 0 HA LYS B 31 -4.700 1.127 -0.466 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -3.378 -0.417 -2.731 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -5.078 0.003 -2.806 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -3.072 2.181 -2.120 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -3.221 1.672 -3.791 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -5.696 2.099 -3.703 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -5.553 2.600 -2.030 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -3.982 4.428 -2.710 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -4.124 3.927 -4.384 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -5.706 5.754 -3.262 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -6.196 4.784 -4.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -6.647 4.368 -2.984 1.00 0.00 H new ATOM 2539 N ASN B 32 -4.423 -2.136 -0.528 1.00 0.00 N ATOM 2540 CA ASN B 32 -5.083 -3.365 -0.138 1.00 0.00 C ATOM 2541 C ASN B 32 -5.221 -3.425 1.376 1.00 0.00 C ATOM 2542 O ASN B 32 -6.197 -3.970 1.897 1.00 0.00 O ATOM 2543 CB ASN B 32 -4.295 -4.577 -0.637 1.00 0.00 C ATOM 2544 CG ASN B 32 -4.476 -4.732 -2.143 1.00 0.00 C ATOM 2545 OD1 ASN B 32 -5.654 -4.537 -2.673 1.00 0.00 O flip ATOM 2546 ND2 ASN B 32 -3.521 -5.042 -2.855 1.00 0.00 N flip ATOM 0 H ASN B 32 -3.481 -2.259 -0.899 1.00 0.00 H new ATOM 0 HA ASN B 32 -6.075 -3.384 -0.588 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -3.238 -4.457 -0.400 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -4.636 -5.478 -0.127 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -2.602 -5.194 -2.438 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -3.648 -5.147 -3.862 1.00 0.00 H new ATOM 2553 N ARG B 33 -4.225 -2.884 2.080 1.00 0.00 N ATOM 2554 CA ARG B 33 -4.246 -2.904 3.529 1.00 0.00 C ATOM 2555 C ARG B 33 -5.445 -2.161 4.067 1.00 0.00 C ATOM 2556 O ARG B 33 -6.181 -2.719 4.881 1.00 0.00 O ATOM 2557 CB ARG B 33 -2.965 -2.273 4.083 1.00 0.00 C ATOM 2558 CG ARG B 33 -3.040 -2.187 5.613 1.00 0.00 C ATOM 2559 CD ARG B 33 -1.679 -1.776 6.167 1.00 0.00 C ATOM 2560 NE ARG B 33 -0.702 -2.831 5.927 1.00 0.00 N ATOM 2561 CZ ARG B 33 -0.768 -3.987 6.582 1.00 0.00 C ATOM 2562 NH1 ARG B 33 -1.717 -4.192 7.456 1.00 0.00 N ATOM 2563 NH2 ARG B 33 0.115 -4.918 6.352 1.00 0.00 N ATOM 0 H ARG B 33 -3.407 -2.434 1.669 1.00 0.00 H new ATOM 0 HA ARG B 33 -4.310 -3.944 3.848 1.00 0.00 H new ATOM 0 HB2 ARG B 33 -2.100 -2.866 3.786 1.00 0.00 H new ATOM 0 HB3 ARG B 33 -2.829 -1.277 3.661 1.00 0.00 H new ATOM 0 HG2 ARG B 33 -3.799 -1.464 5.910 1.00 0.00 H new ATOM 0 HG3 ARG B 33 -3.338 -3.150 6.028 1.00 0.00 H new ATOM 0 HD2 ARG B 33 -1.350 -0.850 5.695 1.00 0.00 H new ATOM 0 HD3 ARG B 33 -1.757 -1.578 7.236 1.00 0.00 H new ATOM 0 HE ARG B 33 0.043 -2.681 5.247 1.00 0.00 H new ATOM 0 HH11 ARG B 33 -2.409 -3.465 7.637 1.00 0.00 H new ATOM 0 HH12 ARG B 33 -1.766 -5.079 7.957 1.00 0.00 H new ATOM 0 HH21 ARG B 33 0.857 -4.760 5.670 1.00 0.00 H new ATOM 0 HH22 ARG B 33 0.064 -5.804 6.854 1.00 0.00 H new ATOM 2577 N ALA B 34 -5.635 -0.906 3.611 1.00 0.00 N ATOM 2578 CA ALA B 34 -6.753 -0.077 4.069 1.00 0.00 C ATOM 2579 C ALA B 34 -7.271 -0.547 5.431 1.00 0.00 C ATOM 2580 O ALA B 34 -8.476 -0.740 5.618 1.00 0.00 O ATOM 2581 CB ALA B 34 -7.884 -0.129 3.055 1.00 0.00 C ATOM 0 H ALA B 34 -5.028 -0.452 2.929 1.00 0.00 H new ATOM 0 HA ALA B 34 -6.392 0.947 4.171 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -8.712 0.489 3.402 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -7.529 0.245 2.095 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -8.223 -1.159 2.941 1.00 0.00 H new ATOM 2587 N ARG B 35 -6.351 -0.753 6.366 1.00 0.00 N ATOM 2588 CA ARG B 35 -6.718 -1.224 7.692 1.00 0.00 C ATOM 2589 C ARG B 35 -7.754 -0.297 8.309 1.00 0.00 C ATOM 2590 O ARG B 35 -8.318 -0.591 9.361 1.00 0.00 O ATOM 2591 CB ARG B 35 -5.478 -1.283 8.593 1.00 0.00 C ATOM 2592 CG ARG B 35 -5.785 -2.101 9.851 1.00 0.00 C ATOM 2593 CD ARG B 35 -4.529 -2.219 10.709 1.00 0.00 C ATOM 2594 NE ARG B 35 -4.816 -3.003 11.906 1.00 0.00 N ATOM 2595 CZ ARG B 35 -5.388 -2.448 12.970 1.00 0.00 C ATOM 2596 NH1 ARG B 35 -5.709 -1.183 12.951 1.00 0.00 N ATOM 2597 NH2 ARG B 35 -5.631 -3.167 14.032 1.00 0.00 N ATOM 0 H ARG B 35 -5.351 -0.602 6.230 1.00 0.00 H new ATOM 0 HA ARG B 35 -7.142 -2.224 7.601 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -4.645 -1.732 8.051 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.171 -0.275 8.870 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -6.582 -1.624 10.421 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -6.141 -3.093 9.573 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -3.731 -2.692 10.137 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -4.176 -1.227 10.990 1.00 0.00 H new ATOM 0 HE ARG B 35 -4.574 -3.994 11.927 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -5.521 -0.622 12.120 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -6.148 -0.756 13.767 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -5.382 -4.156 14.046 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -6.070 -2.740 14.848 1.00 0.00 H new ATOM 2611 N ARG B 36 -8.007 0.823 7.640 1.00 0.00 N ATOM 2612 CA ARG B 36 -8.982 1.799 8.129 1.00 0.00 C ATOM 2613 C ARG B 36 -10.206 1.839 7.227 1.00 0.00 C ATOM 2614 O ARG B 36 -11.070 2.693 7.378 1.00 0.00 O ATOM 2615 CB ARG B 36 -8.344 3.182 8.187 1.00 0.00 C ATOM 2616 CG ARG B 36 -7.754 3.537 6.823 1.00 0.00 C ATOM 2617 CD ARG B 36 -7.203 4.965 6.858 1.00 0.00 C ATOM 2618 NE ARG B 36 -6.108 5.060 7.820 1.00 0.00 N ATOM 2619 CZ ARG B 36 -4.865 4.730 7.485 1.00 0.00 C ATOM 2620 NH1 ARG B 36 -4.606 4.305 6.279 1.00 0.00 N ATOM 2621 NH2 ARG B 36 -3.905 4.828 8.364 1.00 0.00 N ATOM 0 H ARG B 36 -7.555 1.079 6.762 1.00 0.00 H new ATOM 0 HA ARG B 36 -9.297 1.499 9.129 1.00 0.00 H new ATOM 0 HB2 ARG B 36 -9.088 3.924 8.476 1.00 0.00 H new ATOM 0 HB3 ARG B 36 -7.563 3.201 8.947 1.00 0.00 H new ATOM 0 HG2 ARG B 36 -6.960 2.836 6.565 1.00 0.00 H new ATOM 0 HG3 ARG B 36 -8.519 3.450 6.051 1.00 0.00 H new ATOM 0 HD2 ARG B 36 -6.852 5.251 5.867 1.00 0.00 H new ATOM 0 HD3 ARG B 36 -7.996 5.662 7.129 1.00 0.00 H new ATOM 0 HE ARG B 36 -6.301 5.386 8.767 1.00 0.00 H new ATOM 0 HH11 ARG B 36 -5.357 4.226 5.594 1.00 0.00 H new ATOM 0 HH12 ARG B 36 -3.652 4.052 6.021 1.00 0.00 H new ATOM 0 HH21 ARG B 36 -4.109 5.158 9.307 1.00 0.00 H new ATOM 0 HH22 ARG B 36 -2.951 4.575 8.107 1.00 0.00 H new ATOM 2635 N PHE B 37 -10.271 0.909 6.296 1.00 0.00 N ATOM 2636 CA PHE B 37 -11.401 0.838 5.371 1.00 0.00 C ATOM 2637 C PHE B 37 -11.701 2.220 4.796 1.00 0.00 C ATOM 2638 O PHE B 37 -12.629 2.897 5.227 1.00 0.00 O ATOM 2639 CB PHE B 37 -12.634 0.294 6.101 1.00 0.00 C ATOM 2640 CG PHE B 37 -12.207 -0.771 7.076 1.00 0.00 C ATOM 2641 CD1 PHE B 37 -12.119 -2.106 6.669 1.00 0.00 C ATOM 2642 CD2 PHE B 37 -11.905 -0.422 8.396 1.00 0.00 C ATOM 2643 CE1 PHE B 37 -11.732 -3.090 7.584 1.00 0.00 C ATOM 2644 CE2 PHE B 37 -11.516 -1.406 9.311 1.00 0.00 C ATOM 2645 CZ PHE B 37 -11.430 -2.740 8.903 1.00 0.00 C ATOM 0 H PHE B 37 -9.561 0.191 6.154 1.00 0.00 H new ATOM 0 HA PHE B 37 -11.146 0.167 4.551 1.00 0.00 H new ATOM 0 HB2 PHE B 37 -13.145 1.101 6.627 1.00 0.00 H new ATOM 0 HB3 PHE B 37 -13.343 -0.118 5.383 1.00 0.00 H new ATOM 0 HD1 PHE B 37 -12.350 -2.377 5.649 1.00 0.00 H new ATOM 0 HD2 PHE B 37 -11.972 0.609 8.710 1.00 0.00 H new ATOM 0 HE1 PHE B 37 -11.666 -4.122 7.271 1.00 0.00 H new ATOM 0 HE2 PHE B 37 -11.283 -1.136 10.330 1.00 0.00 H new ATOM 0 HZ PHE B 37 -11.130 -3.501 9.608 1.00 0.00 H new ATOM 2655 N ARG B 38 -10.907 2.637 3.817 1.00 0.00 N ATOM 2656 CA ARG B 38 -11.101 3.939 3.198 1.00 0.00 C ATOM 2657 C ARG B 38 -12.485 4.028 2.573 1.00 0.00 C ATOM 2658 O ARG B 38 -13.097 5.096 2.550 1.00 0.00 O ATOM 2659 CB ARG B 38 -10.029 4.161 2.132 1.00 0.00 C ATOM 2660 CG ARG B 38 -10.146 3.080 1.046 1.00 0.00 C ATOM 2661 CD ARG B 38 -8.822 2.954 0.302 1.00 0.00 C ATOM 2662 NE ARG B 38 -8.426 4.249 -0.251 1.00 0.00 N ATOM 2663 CZ ARG B 38 -7.144 4.588 -0.376 1.00 0.00 C ATOM 2664 NH1 ARG B 38 -6.207 3.758 -0.008 1.00 0.00 N ATOM 2665 NH2 ARG B 38 -6.820 5.753 -0.872 1.00 0.00 N ATOM 0 H ARG B 38 -10.129 2.096 3.438 1.00 0.00 H new ATOM 0 HA ARG B 38 -11.017 4.712 3.962 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -10.143 5.150 1.688 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -9.039 4.128 2.586 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -10.413 2.125 1.498 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -10.943 3.336 0.348 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -8.050 2.588 0.979 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -8.916 2.222 -0.500 1.00 0.00 H new ATOM 0 HE ARG B 38 -9.147 4.907 -0.547 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -6.455 2.847 0.377 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -5.226 4.021 -0.105 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -7.549 6.404 -1.164 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -5.838 6.011 -0.967 1.00 0.00 H new ATOM 2679 N MET B 39 -12.979 2.900 2.076 1.00 0.00 N ATOM 2680 CA MET B 39 -14.298 2.877 1.464 1.00 0.00 C ATOM 2681 C MET B 39 -15.384 3.107 2.513 1.00 0.00 C ATOM 2682 O MET B 39 -16.151 4.069 2.439 1.00 0.00 O ATOM 2683 CB MET B 39 -14.535 1.537 0.761 1.00 0.00 C ATOM 2684 CG MET B 39 -16.020 1.364 0.406 1.00 0.00 C ATOM 2685 SD MET B 39 -16.642 2.892 -0.336 1.00 0.00 S ATOM 2686 CE MET B 39 -18.395 2.443 -0.348 1.00 0.00 C ATOM 0 H MET B 39 -12.493 2.003 2.085 1.00 0.00 H new ATOM 0 HA MET B 39 -14.345 3.680 0.729 1.00 0.00 H new ATOM 0 HB2 MET B 39 -13.931 1.484 -0.145 1.00 0.00 H new ATOM 0 HB3 MET B 39 -14.213 0.720 1.407 1.00 0.00 H new ATOM 0 HG2 MET B 39 -16.145 0.533 -0.288 1.00 0.00 H new ATOM 0 HG3 MET B 39 -16.593 1.121 1.301 1.00 0.00 H new ATOM 0 HE1 MET B 39 -18.898 2.962 -1.164 1.00 0.00 H new ATOM 0 HE2 MET B 39 -18.494 1.366 -0.487 1.00 0.00 H new ATOM 0 HE3 MET B 39 -18.851 2.730 0.600 1.00 0.00 H new ATOM 2696 N ILE B 40 -15.441 2.208 3.491 1.00 0.00 N ATOM 2697 CA ILE B 40 -16.430 2.308 4.553 1.00 0.00 C ATOM 2698 C ILE B 40 -16.209 3.578 5.365 1.00 0.00 C ATOM 2699 O ILE B 40 -17.159 4.277 5.716 1.00 0.00 O ATOM 2700 CB ILE B 40 -16.349 1.079 5.471 1.00 0.00 C ATOM 2701 CG1 ILE B 40 -16.816 -0.163 4.697 1.00 0.00 C ATOM 2702 CG2 ILE B 40 -17.260 1.288 6.691 1.00 0.00 C ATOM 2703 CD1 ILE B 40 -16.576 -1.420 5.540 1.00 0.00 C ATOM 0 H ILE B 40 -14.816 1.406 3.568 1.00 0.00 H new ATOM 0 HA ILE B 40 -17.421 2.348 4.101 1.00 0.00 H new ATOM 0 HB ILE B 40 -15.320 0.941 5.804 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -17.875 -0.074 4.453 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -16.277 -0.239 3.753 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -17.202 0.416 7.342 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -16.936 2.172 7.240 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -18.289 1.424 6.358 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -16.909 -2.298 4.987 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -15.513 -1.512 5.761 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -17.136 -1.345 6.472 1.00 0.00 H new ATOM 2715 N SER B 41 -14.948 3.867 5.661 1.00 0.00 N ATOM 2716 CA SER B 41 -14.609 5.052 6.437 1.00 0.00 C ATOM 2717 C SER B 41 -15.115 6.308 5.735 1.00 0.00 C ATOM 2718 O SER B 41 -15.675 7.200 6.371 1.00 0.00 O ATOM 2719 CB SER B 41 -13.095 5.150 6.604 1.00 0.00 C ATOM 2720 OG SER B 41 -12.779 6.306 7.370 1.00 0.00 O ATOM 0 H SER B 41 -14.148 3.301 5.377 1.00 0.00 H new ATOM 0 HA SER B 41 -15.082 4.970 7.415 1.00 0.00 H new ATOM 0 HB2 SER B 41 -12.714 4.257 7.099 1.00 0.00 H new ATOM 0 HB3 SER B 41 -12.613 5.204 5.628 1.00 0.00 H new ATOM 0 HG SER B 41 -11.807 6.370 7.480 1.00 0.00 H new ATOM 2726 N ASN B 42 -14.908 6.369 4.420 1.00 0.00 N ATOM 2727 CA ASN B 42 -15.342 7.520 3.636 1.00 0.00 C ATOM 2728 C ASN B 42 -16.746 7.329 3.117 1.00 0.00 C ATOM 2729 O ASN B 42 -17.296 8.263 2.546 1.00 0.00 O ATOM 2730 CB ASN B 42 -14.413 7.741 2.451 1.00 0.00 C ATOM 2731 CG ASN B 42 -14.869 8.962 1.654 1.00 0.00 C ATOM 2732 OD1 ASN B 42 -15.744 8.854 0.794 1.00 0.00 O ATOM 2733 ND2 ASN B 42 -14.320 10.122 1.888 1.00 0.00 N ATOM 0 H ASN B 42 -14.445 5.638 3.879 1.00 0.00 H new ATOM 0 HA ASN B 42 -15.317 8.388 4.295 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -13.391 7.885 2.801 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -14.409 6.859 1.811 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -14.615 10.942 1.358 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -13.596 10.209 2.601 1.00 0.00 H new ATOM 2740 N LEU B 43 -17.311 6.121 3.329 1.00 0.00 N ATOM 2741 CA LEU B 43 -18.682 5.788 2.894 1.00 0.00 C ATOM 2742 C LEU B 43 -19.265 6.887 1.989 1.00 0.00 C ATOM 2743 O LEU B 43 -18.713 7.090 0.918 1.00 0.00 O ATOM 2744 CB LEU B 43 -19.584 5.570 4.138 1.00 0.00 C ATOM 2745 CG LEU B 43 -19.145 6.501 5.284 1.00 0.00 C ATOM 2746 CD1 LEU B 43 -19.579 7.940 4.995 1.00 0.00 C ATOM 2747 CD2 LEU B 43 -19.779 6.028 6.585 1.00 0.00 C ATOM 2748 OXT LEU B 43 -20.245 7.506 2.377 1.00 0.00 O ATOM 0 H LEU B 43 -16.833 5.355 3.803 1.00 0.00 H new ATOM 0 HA LEU B 43 -18.646 4.868 2.310 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -20.625 5.765 3.880 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -19.525 4.531 4.461 1.00 0.00 H new ATOM 0 HG LEU B 43 -18.059 6.473 5.370 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -19.262 8.587 5.813 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -19.120 8.279 4.066 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -20.664 7.981 4.900 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -19.471 6.684 7.399 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -20.865 6.052 6.490 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -19.456 5.009 6.798 1.00 0.00 H new TER 2760 LEU B 43 HETATM 2761 CA CA A 179 -19.942 -10.177 13.938 1.00 0.00 CA HETATM 2762 CA CA A 192 -26.934 -8.625 3.089 1.00 0.00 CA HETATM 2763 CA CA A 221 8.187 14.231 1.877 1.00 0.00 CA HETATM 2764 CA CA A 234 16.025 12.083 -7.261 1.00 0.00 CA