USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 1802 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 HIS : no HE2:sc= 0.341 K(o=0.23,f=-2.8) USER MOD Set 1.2: B 43 ASN : amide:sc= -0.107 K(o=0.23,f=-0.61!) USER MOD Set 2.1: B 18 THR OG1 : rot 78:sc= 1.66 USER MOD Set 2.2: B 32 SER OG : rot 78:sc= 0.0758 USER MOD Set 2.3: B 37 SER OG : rot 138:sc= 0.512 USER MOD Set 3.1: B 35 THR OG1 : rot 91:sc= 1.22 USER MOD Set 3.2: B 51 SER OG : rot 98:sc= -0.384 USER MOD Set 3.3: B 53 HIS : no HE2:sc= 1.02 K(o=1.9,f=-2.6) USER MOD Set 4.1: B 19 GLN : amide:sc= -0.0948 K(o=0.84,f=-10!) USER MOD Set 4.2: B 22 LYS NZ :NH3+ 164:sc= 0.931 (180deg=0) USER MOD Set 5.1: B 17 SER OG : rot 13:sc= -0.456 USER MOD Set 5.2: B 21 TYR OH : rot 125:sc= -0.32 USER MOD Set 5.3: B 113 HIS : no HD1:sc= -0.995 K(o=-1.8,f=-9.5!) USER MOD Set 6.1: A 81 THR OG1 : rot 84:sc= 1.69 USER MOD Set 6.2: B 1 MET CE :methyl 133:sc= -0.184 (180deg=-0.426) USER MOD Set 6.3: B 2 THR OG1 : rot -136:sc= 0.49 USER MOD Set 7.1: A 118 TYR OH : rot -26:sc= 0.809 USER MOD Set 7.2: B 46 LYS NZ :NH3+ -153:sc= 0.334 (180deg=0) USER MOD Set 8.1: A 46 LYS NZ :NH3+ -154:sc= 0.236 (180deg=0) USER MOD Set 8.2: B 118 TYR OH : rot -24:sc= 0.941 USER MOD Set 9.1: A 43 ASN : amide:sc= -0.38 K(o=-0.11,f=-0.88!) USER MOD Set 9.2: B 3 HIS : no HE2:sc= 0.265 K(o=-0.11,f=-2.4) USER MOD Set10.1: A 35 THR OG1 : rot 85:sc= 1.23 USER MOD Set10.2: A 53 HIS : no HE2:sc= 0.927 K(o=2.2,f=-3.8!) USER MOD Set11.1: A 19 GLN : amide:sc= 0.628 K(o=1.4,f=-5.6!) USER MOD Set11.2: A 22 LYS NZ :NH3+ 175:sc= 0.774 (180deg=0) USER MOD Set12.1: A 17 SER OG : rot 2:sc= -0.45 USER MOD Set12.2: A 21 TYR OH : rot -39:sc= -0.266 USER MOD Set12.3: A 113 HIS : no HD1:sc= -2.17! C(o=-2.9!,f=-8.1!) USER MOD Set13.1: A 18 THR OG1 : rot 83:sc= 1.56 USER MOD Set13.2: A 32 SER OG : rot 79:sc= 0.0756 USER MOD Set13.3: A 37 SER OG : rot 142:sc= 0.62 USER MOD Set14.1: A 7 THR OG1 : rot -150:sc= 0.0295 USER MOD Set14.2: B 7 THR OG1 : rot -169:sc= 0.0299 USER MOD Set15.1: A 1 MET CE :methyl 131:sc= -0.377 (180deg=-0.803) USER MOD Set15.2: A 2 THR OG1 : rot -140:sc= 0.502 USER MOD Set15.3: B 81 THR OG1 : rot 80:sc= 1.7 USER MOD Single : A 1 MET N :NH3+ -143:sc= 0.995 (180deg=0.303) USER MOD Single : A 10 TYR OH : rot -144:sc= -2.84! USER MOD Single : A 13 ASN : amide:sc= 0.352 X(o=0.35,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl 143:sc= -0.108 (180deg=-0.65) USER MOD Single : A 51 SER OG : rot 98:sc= -0.421 USER MOD Single : A 54 THR OG1 : rot -40:sc= 0.311 USER MOD Single : A 58 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00361) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.49 K(o=-1.5,f=-4.1!) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 84:sc= 0.527 USER MOD Single : A 92 MET CE :methyl -139:sc= -1.08 (180deg=-3.92!) USER MOD Single : A 94 GLN : amide:sc= -2.58! C(o=-2.6!,f=-5.1!) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0367) USER MOD Single : A 99 MET CE :methyl 155:sc= -0.324 (180deg=-2.22!) USER MOD Single : A 103 TYR OH : rot -83:sc= 0.894 USER MOD Single : A 104 THR OG1 : rot 32:sc= 0.66 USER MOD Single : A 106 THR OG1 : rot 155:sc= -0.481 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ -162:sc= 0.747 (180deg=-0.64!) USER MOD Single : B 10 TYR OH : rot 150:sc= 0 USER MOD Single : B 13 ASN : amide:sc= -1.34 K(o=-1.3,f=-4.7!) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 45 MET CE :methyl 148:sc= -0.109 (180deg=-0.756) USER MOD Single : B 54 THR OG1 : rot -42:sc= 0.298 USER MOD Single : B 58 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0137) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 ASN : amide:sc= -2.06! C(o=-2.1!,f=-3.9!) USER MOD Single : B 77 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 SER OG : rot 86:sc= 0.472 USER MOD Single : B 92 MET CE :methyl 138:sc= -4.11! (180deg=-4.76!) USER MOD Single : B 94 GLN : amide:sc= -2.64! C(o=-2.6!,f=-5.3!) USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 LYS NZ :NH3+ -165:sc= -0.0348 (180deg=-0.28) USER MOD Single : B 99 MET CE :methyl -125:sc= -0.303 (180deg=-3.73!) USER MOD Single : B 103 TYR OH : rot -77:sc= 0.905 USER MOD Single : B 104 THR OG1 : rot 26:sc= 0.47 USER MOD Single : B 106 THR OG1 : rot 153:sc= 0.708 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.521 17.454 -2.479 1.00 0.00 N ATOM 2 CA MET A 1 3.717 17.774 -3.915 1.00 0.00 C ATOM 3 C MET A 1 3.788 16.487 -4.754 1.00 0.00 C ATOM 4 O MET A 1 3.292 16.444 -5.886 1.00 0.00 O ATOM 5 CB MET A 1 4.988 18.648 -4.112 1.00 0.00 C ATOM 6 CG MET A 1 6.320 17.966 -3.755 1.00 0.00 C ATOM 7 SD MET A 1 6.385 17.410 -2.032 1.00 0.00 S ATOM 8 CE MET A 1 8.004 16.639 -1.958 1.00 0.00 C ATOM 0 H1 MET A 1 2.891 18.161 -2.049 1.00 0.00 H new ATOM 0 H2 MET A 1 3.095 16.510 -2.389 1.00 0.00 H new ATOM 0 H3 MET A 1 4.440 17.467 -1.992 1.00 0.00 H new ATOM 0 HA MET A 1 2.859 18.349 -4.262 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.031 18.968 -5.153 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.887 19.548 -3.506 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.473 17.111 -4.414 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.139 18.661 -3.939 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.544 17.010 -1.087 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.889 15.558 -1.880 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.564 16.880 -2.862 1.00 0.00 H new ATOM 18 N THR A 2 4.404 15.439 -4.185 1.00 0.00 N ATOM 19 CA THR A 2 4.596 14.159 -4.869 1.00 0.00 C ATOM 20 C THR A 2 3.349 13.269 -4.686 1.00 0.00 C ATOM 21 O THR A 2 2.694 13.322 -3.636 1.00 0.00 O ATOM 22 CB THR A 2 5.873 13.454 -4.322 1.00 0.00 C ATOM 23 OG1 THR A 2 6.923 14.425 -4.186 1.00 0.00 O ATOM 24 CG2 THR A 2 6.354 12.326 -5.247 1.00 0.00 C ATOM 0 H THR A 2 4.782 15.459 -3.238 1.00 0.00 H new ATOM 0 HA THR A 2 4.732 14.336 -5.936 1.00 0.00 H new ATOM 0 HB THR A 2 5.621 13.012 -3.358 1.00 0.00 H new ATOM 0 HG1 THR A 2 7.774 14.029 -4.468 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.246 11.864 -4.824 1.00 0.00 H new ATOM 0 HG22 THR A 2 5.569 11.576 -5.345 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.588 12.736 -6.229 1.00 0.00 H new ATOM 32 N HIS A 3 3.032 12.467 -5.721 1.00 0.00 N ATOM 33 CA HIS A 3 1.799 11.660 -5.783 1.00 0.00 C ATOM 34 C HIS A 3 2.093 10.177 -5.457 1.00 0.00 C ATOM 35 O HIS A 3 2.729 9.484 -6.264 1.00 0.00 O ATOM 36 CB HIS A 3 1.150 11.790 -7.190 1.00 0.00 C ATOM 37 CG HIS A 3 0.682 13.184 -7.532 1.00 0.00 C ATOM 38 ND1 HIS A 3 -0.644 13.554 -7.549 1.00 0.00 N ATOM 39 CD2 HIS A 3 1.376 14.293 -7.878 1.00 0.00 C ATOM 40 CE1 HIS A 3 -0.744 14.822 -7.892 1.00 0.00 C ATOM 41 NE2 HIS A 3 0.470 15.295 -8.098 1.00 0.00 N ATOM 0 H HIS A 3 3.628 12.361 -6.542 1.00 0.00 H new ATOM 0 HA HIS A 3 1.101 12.036 -5.035 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.871 11.467 -7.941 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.301 11.109 -7.250 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -1.429 12.940 -7.330 1.00 0.00 H new ATOM 0 HD2 HIS A 3 2.450 14.373 -7.965 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -1.664 15.380 -7.988 1.00 0.00 H new ATOM 50 N PRO A 4 1.670 9.676 -4.247 1.00 0.00 N ATOM 51 CA PRO A 4 1.759 8.250 -3.881 1.00 0.00 C ATOM 52 C PRO A 4 0.484 7.474 -4.279 1.00 0.00 C ATOM 53 O PRO A 4 -0.151 6.799 -3.457 1.00 0.00 O ATOM 54 CB PRO A 4 1.943 8.333 -2.357 1.00 0.00 C ATOM 55 CG PRO A 4 1.078 9.487 -1.946 1.00 0.00 C ATOM 56 CD PRO A 4 1.100 10.467 -3.115 1.00 0.00 C ATOM 0 HA PRO A 4 2.558 7.709 -4.388 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.634 7.409 -1.867 1.00 0.00 H new ATOM 0 HB3 PRO A 4 2.986 8.502 -2.090 1.00 0.00 H new ATOM 0 HG2 PRO A 4 0.061 9.156 -1.733 1.00 0.00 H new ATOM 0 HG3 PRO A 4 1.457 9.955 -1.038 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.099 10.831 -3.348 1.00 0.00 H new ATOM 0 HD3 PRO A 4 1.713 11.340 -2.891 1.00 0.00 H new ATOM 64 N ASP A 5 0.151 7.541 -5.575 1.00 0.00 N ATOM 65 CA ASP A 5 -1.017 6.841 -6.160 1.00 0.00 C ATOM 66 C ASP A 5 -0.732 5.339 -6.392 1.00 0.00 C ATOM 67 O ASP A 5 -1.581 4.600 -6.918 1.00 0.00 O ATOM 68 CB ASP A 5 -1.407 7.522 -7.484 1.00 0.00 C ATOM 69 CG ASP A 5 -0.310 7.426 -8.557 1.00 0.00 C ATOM 70 OD1 ASP A 5 0.667 8.209 -8.506 1.00 0.00 O ATOM 71 OD2 ASP A 5 -0.416 6.571 -9.448 1.00 0.00 O ATOM 0 H ASP A 5 0.682 8.083 -6.256 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.844 6.906 -5.452 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.321 7.066 -7.865 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -1.630 8.572 -7.294 1.00 0.00 H new ATOM 76 N PHE A 6 0.451 4.908 -5.962 1.00 0.00 N ATOM 77 CA PHE A 6 0.962 3.561 -6.134 1.00 0.00 C ATOM 78 C PHE A 6 1.309 3.038 -4.729 1.00 0.00 C ATOM 79 O PHE A 6 2.031 3.689 -3.978 1.00 0.00 O ATOM 80 CB PHE A 6 2.206 3.619 -7.079 1.00 0.00 C ATOM 81 CG PHE A 6 2.905 2.297 -7.446 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.404 1.051 -7.088 1.00 0.00 C ATOM 83 CD2 PHE A 6 4.099 2.324 -8.165 1.00 0.00 C ATOM 84 CE1 PHE A 6 3.069 -0.100 -7.433 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.760 1.166 -8.510 1.00 0.00 C ATOM 86 CZ PHE A 6 4.247 -0.044 -8.140 1.00 0.00 C ATOM 0 H PHE A 6 1.102 5.516 -5.465 1.00 0.00 H new ATOM 0 HA PHE A 6 0.240 2.886 -6.595 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.897 4.101 -8.007 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.947 4.269 -6.614 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.480 0.987 -6.532 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.516 3.276 -8.459 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.663 -1.059 -7.146 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.681 1.215 -9.071 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.765 -0.955 -8.402 1.00 0.00 H new ATOM 96 N THR A 7 0.741 1.884 -4.372 1.00 0.00 N ATOM 97 CA THR A 7 1.044 1.186 -3.114 1.00 0.00 C ATOM 98 C THR A 7 1.599 -0.202 -3.448 1.00 0.00 C ATOM 99 O THR A 7 1.112 -0.866 -4.358 1.00 0.00 O ATOM 100 CB THR A 7 -0.216 1.074 -2.187 1.00 0.00 C ATOM 101 OG1 THR A 7 0.130 0.411 -0.954 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.393 0.331 -2.856 1.00 0.00 C ATOM 0 H THR A 7 0.053 1.402 -4.950 1.00 0.00 H new ATOM 0 HA THR A 7 1.786 1.762 -2.561 1.00 0.00 H new ATOM 0 HB THR A 7 -0.546 2.094 -1.988 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.651 -0.071 -0.612 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.235 0.286 -2.165 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.693 0.863 -3.759 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.083 -0.681 -3.117 1.00 0.00 H new ATOM 110 N ILE A 8 2.652 -0.614 -2.736 1.00 0.00 N ATOM 111 CA ILE A 8 3.325 -1.899 -2.960 1.00 0.00 C ATOM 112 C ILE A 8 3.168 -2.781 -1.711 1.00 0.00 C ATOM 113 O ILE A 8 3.354 -2.311 -0.581 1.00 0.00 O ATOM 114 CB ILE A 8 4.856 -1.698 -3.276 1.00 0.00 C ATOM 115 CG1 ILE A 8 5.076 -0.699 -4.457 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.544 -3.052 -3.569 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.539 -0.431 -4.806 1.00 0.00 C ATOM 0 H ILE A 8 3.065 -0.063 -1.983 1.00 0.00 H new ATOM 0 HA ILE A 8 2.863 -2.382 -3.821 1.00 0.00 H new ATOM 0 HB ILE A 8 5.316 -1.265 -2.388 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.571 -1.088 -5.342 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.597 0.248 -4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.599 -2.885 -3.784 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.449 -3.704 -2.700 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.069 -3.523 -4.429 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.592 0.273 -5.636 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.048 -0.009 -3.940 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.022 -1.365 -5.092 1.00 0.00 H new ATOM 129 N LEU A 9 2.833 -4.060 -1.924 1.00 0.00 N ATOM 130 CA LEU A 9 2.745 -5.059 -0.849 1.00 0.00 C ATOM 131 C LEU A 9 4.116 -5.728 -0.700 1.00 0.00 C ATOM 132 O LEU A 9 4.918 -5.808 -1.638 1.00 0.00 O ATOM 133 CB LEU A 9 1.608 -6.095 -1.151 1.00 0.00 C ATOM 134 CG LEU A 9 0.420 -6.127 -0.134 1.00 0.00 C ATOM 135 CD1 LEU A 9 0.876 -6.597 1.266 1.00 0.00 C ATOM 136 CD2 LEU A 9 -0.288 -4.757 -0.070 1.00 0.00 C ATOM 0 H LEU A 9 2.615 -4.433 -2.848 1.00 0.00 H new ATOM 0 HA LEU A 9 2.483 -4.582 0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.206 -5.884 -2.142 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.052 -7.090 -1.192 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.302 -6.859 -0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.022 -6.605 1.943 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.292 -7.602 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.636 -5.916 1.649 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.110 -4.805 0.644 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.423 -3.994 0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.678 -4.503 -1.056 1.00 0.00 H new ATOM 148 N TYR A 10 4.314 -6.257 0.511 1.00 0.00 N ATOM 149 CA TYR A 10 5.564 -6.840 0.972 1.00 0.00 C ATOM 150 C TYR A 10 5.359 -8.354 1.093 1.00 0.00 C ATOM 151 O TYR A 10 4.588 -8.806 1.950 1.00 0.00 O ATOM 152 CB TYR A 10 5.913 -6.195 2.340 1.00 0.00 C ATOM 153 CG TYR A 10 7.395 -6.086 2.637 1.00 0.00 C ATOM 154 CD1 TYR A 10 8.198 -5.194 1.928 1.00 0.00 C ATOM 155 CD2 TYR A 10 7.981 -6.835 3.641 1.00 0.00 C ATOM 156 CE1 TYR A 10 9.534 -5.065 2.218 1.00 0.00 C ATOM 157 CE2 TYR A 10 9.307 -6.703 3.939 1.00 0.00 C ATOM 158 CZ TYR A 10 10.078 -5.821 3.233 1.00 0.00 C ATOM 159 OH TYR A 10 11.396 -5.705 3.543 1.00 0.00 O ATOM 0 H TYR A 10 3.579 -6.289 1.217 1.00 0.00 H new ATOM 0 HA TYR A 10 6.388 -6.656 0.282 1.00 0.00 H new ATOM 0 HB2 TYR A 10 5.476 -5.197 2.376 1.00 0.00 H new ATOM 0 HB3 TYR A 10 5.441 -6.778 3.131 1.00 0.00 H new ATOM 0 HD1 TYR A 10 7.764 -4.596 1.140 1.00 0.00 H new ATOM 0 HD2 TYR A 10 7.379 -7.537 4.199 1.00 0.00 H new ATOM 0 HE1 TYR A 10 10.151 -4.379 1.657 1.00 0.00 H new ATOM 0 HE2 TYR A 10 9.746 -7.293 4.730 1.00 0.00 H new ATOM 0 HH TYR A 10 11.749 -6.581 3.804 1.00 0.00 H new ATOM 169 N VAL A 11 5.970 -9.127 0.180 1.00 0.00 N ATOM 170 CA VAL A 11 5.771 -10.590 0.111 1.00 0.00 C ATOM 171 C VAL A 11 7.111 -11.329 0.179 1.00 0.00 C ATOM 172 O VAL A 11 8.176 -10.749 -0.045 1.00 0.00 O ATOM 173 CB VAL A 11 4.981 -11.002 -1.198 1.00 0.00 C ATOM 174 CG1 VAL A 11 3.688 -10.169 -1.332 1.00 0.00 C ATOM 175 CG2 VAL A 11 5.838 -10.914 -2.488 1.00 0.00 C ATOM 0 H VAL A 11 6.610 -8.763 -0.526 1.00 0.00 H new ATOM 0 HA VAL A 11 5.172 -10.880 0.974 1.00 0.00 H new ATOM 0 HB VAL A 11 4.718 -12.054 -1.085 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.157 -10.465 -2.237 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.052 -10.343 -0.464 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.941 -9.110 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.235 -11.210 -3.346 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.186 -9.890 -2.625 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.696 -11.580 -2.401 1.00 0.00 H new ATOM 185 N ASP A 12 7.032 -12.613 0.544 1.00 0.00 N ATOM 186 CA ASP A 12 8.180 -13.513 0.654 1.00 0.00 C ATOM 187 C ASP A 12 8.301 -14.345 -0.627 1.00 0.00 C ATOM 188 O ASP A 12 9.289 -14.223 -1.351 1.00 0.00 O ATOM 189 CB ASP A 12 8.017 -14.430 1.895 1.00 0.00 C ATOM 190 CG ASP A 12 9.142 -15.474 2.049 1.00 0.00 C ATOM 191 OD1 ASP A 12 10.292 -15.083 2.337 1.00 0.00 O ATOM 192 OD2 ASP A 12 8.891 -16.684 1.873 1.00 0.00 O ATOM 0 H ASP A 12 6.147 -13.064 0.776 1.00 0.00 H new ATOM 0 HA ASP A 12 9.092 -12.929 0.779 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.984 -13.810 2.791 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.060 -14.948 1.830 1.00 0.00 H new ATOM 197 N ASN A 13 7.275 -15.171 -0.913 1.00 0.00 N ATOM 198 CA ASN A 13 7.288 -16.114 -2.053 1.00 0.00 C ATOM 199 C ASN A 13 6.727 -15.431 -3.316 1.00 0.00 C ATOM 200 O ASN A 13 5.511 -15.220 -3.386 1.00 0.00 O ATOM 201 CB ASN A 13 6.449 -17.382 -1.719 1.00 0.00 C ATOM 202 CG ASN A 13 7.038 -18.222 -0.591 1.00 0.00 C ATOM 203 OD1 ASN A 13 7.856 -19.112 -0.830 1.00 0.00 O ATOM 204 ND2 ASN A 13 6.617 -17.964 0.639 1.00 0.00 N ATOM 0 H ASN A 13 6.416 -15.205 -0.364 1.00 0.00 H new ATOM 0 HA ASN A 13 8.319 -16.415 -2.240 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.439 -17.078 -1.445 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.365 -17.998 -2.614 1.00 0.00 H new ATOM 0 HD21 ASN A 13 6.971 -18.510 1.424 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.939 -17.219 0.800 1.00 0.00 H new ATOM 211 N PRO A 14 7.591 -15.066 -4.328 1.00 0.00 N ATOM 212 CA PRO A 14 7.134 -14.382 -5.561 1.00 0.00 C ATOM 213 C PRO A 14 6.025 -15.163 -6.349 1.00 0.00 C ATOM 214 O PRO A 14 4.921 -14.624 -6.446 1.00 0.00 O ATOM 215 CB PRO A 14 8.437 -14.145 -6.379 1.00 0.00 C ATOM 216 CG PRO A 14 9.538 -14.244 -5.368 1.00 0.00 C ATOM 217 CD PRO A 14 9.073 -15.248 -4.341 1.00 0.00 C ATOM 0 HA PRO A 14 6.625 -13.445 -5.334 1.00 0.00 H new ATOM 0 HB2 PRO A 14 8.553 -14.890 -7.166 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.430 -13.169 -6.863 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.468 -14.567 -5.835 1.00 0.00 H new ATOM 0 HG3 PRO A 14 9.732 -13.276 -4.907 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.351 -16.265 -4.618 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.511 -15.054 -3.362 1.00 0.00 H new ATOM 225 N PRO A 15 6.232 -16.459 -6.854 1.00 0.00 N ATOM 226 CA PRO A 15 5.214 -17.147 -7.709 1.00 0.00 C ATOM 227 C PRO A 15 3.850 -17.256 -6.993 1.00 0.00 C ATOM 228 O PRO A 15 2.825 -16.815 -7.514 1.00 0.00 O ATOM 229 CB PRO A 15 5.834 -18.546 -7.990 1.00 0.00 C ATOM 230 CG PRO A 15 6.838 -18.746 -6.896 1.00 0.00 C ATOM 231 CD PRO A 15 7.389 -17.370 -6.604 1.00 0.00 C ATOM 0 HA PRO A 15 5.004 -16.599 -8.627 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.073 -19.326 -7.976 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.307 -18.579 -8.972 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.374 -19.180 -6.010 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.629 -19.428 -7.208 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.744 -17.292 -5.577 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.232 -17.132 -7.252 1.00 0.00 H new ATOM 239 N ALA A 16 3.894 -17.765 -5.752 1.00 0.00 N ATOM 240 CA ALA A 16 2.702 -18.150 -4.983 1.00 0.00 C ATOM 241 C ALA A 16 1.839 -16.928 -4.646 1.00 0.00 C ATOM 242 O ALA A 16 0.611 -16.952 -4.815 1.00 0.00 O ATOM 243 CB ALA A 16 3.116 -18.892 -3.703 1.00 0.00 C ATOM 0 H ALA A 16 4.768 -17.922 -5.250 1.00 0.00 H new ATOM 0 HA ALA A 16 2.101 -18.819 -5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.225 -19.173 -3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.676 -19.789 -3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.741 -18.241 -3.091 1.00 0.00 H new ATOM 249 N SER A 17 2.502 -15.837 -4.235 1.00 0.00 N ATOM 250 CA SER A 17 1.821 -14.607 -3.818 1.00 0.00 C ATOM 251 C SER A 17 1.362 -13.798 -5.040 1.00 0.00 C ATOM 252 O SER A 17 0.428 -12.995 -4.930 1.00 0.00 O ATOM 253 CB SER A 17 2.747 -13.747 -2.936 1.00 0.00 C ATOM 254 OG SER A 17 2.086 -12.577 -2.495 1.00 0.00 O ATOM 0 H SER A 17 3.519 -15.784 -4.183 1.00 0.00 H new ATOM 0 HA SER A 17 0.943 -14.889 -3.236 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.078 -14.328 -2.075 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.640 -13.474 -3.498 1.00 0.00 H new ATOM 0 HG SER A 17 1.163 -12.580 -2.823 1.00 0.00 H new ATOM 260 N THR A 18 1.970 -14.039 -6.219 1.00 0.00 N ATOM 261 CA THR A 18 1.635 -13.296 -7.440 1.00 0.00 C ATOM 262 C THR A 18 0.310 -13.773 -8.048 1.00 0.00 C ATOM 263 O THR A 18 -0.587 -12.978 -8.345 1.00 0.00 O ATOM 264 CB THR A 18 2.792 -13.376 -8.502 1.00 0.00 C ATOM 265 OG1 THR A 18 3.922 -12.608 -8.043 1.00 0.00 O ATOM 266 CG2 THR A 18 2.382 -12.881 -9.907 1.00 0.00 C ATOM 0 H THR A 18 2.696 -14.744 -6.346 1.00 0.00 H new ATOM 0 HA THR A 18 1.515 -12.252 -7.151 1.00 0.00 H new ATOM 0 HB THR A 18 3.045 -14.432 -8.601 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.456 -13.149 -7.425 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.231 -12.966 -10.585 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.557 -13.488 -10.280 1.00 0.00 H new ATOM 0 HG23 THR A 18 2.068 -11.839 -9.848 1.00 0.00 H new ATOM 274 N GLN A 19 0.188 -15.121 -8.108 1.00 0.00 N ATOM 275 CA GLN A 19 -1.026 -15.821 -8.580 1.00 0.00 C ATOM 276 C GLN A 19 -2.166 -15.609 -7.566 1.00 0.00 C ATOM 277 O GLN A 19 -3.346 -15.592 -7.942 1.00 0.00 O ATOM 278 CB GLN A 19 -0.755 -17.342 -8.766 1.00 0.00 C ATOM 279 CG GLN A 19 0.556 -17.695 -9.497 1.00 0.00 C ATOM 280 CD GLN A 19 0.690 -17.146 -10.912 1.00 0.00 C ATOM 281 OE1 GLN A 19 -0.288 -17.030 -11.645 1.00 0.00 O ATOM 282 NE2 GLN A 19 1.912 -16.787 -11.294 1.00 0.00 N ATOM 0 H GLN A 19 0.936 -15.755 -7.828 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.313 -15.408 -9.547 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -0.742 -17.814 -7.784 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -1.588 -17.777 -9.318 1.00 0.00 H new ATOM 0 HG2 GLN A 19 1.392 -17.327 -8.903 1.00 0.00 H new ATOM 0 HG3 GLN A 19 0.647 -18.780 -9.538 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.699 -16.899 -10.655 1.00 0.00 H new ATOM 0 HE22 GLN A 19 2.062 -16.399 -12.226 1.00 0.00 H new ATOM 291 N PHE A 20 -1.778 -15.454 -6.282 1.00 0.00 N ATOM 292 CA PHE A 20 -2.716 -15.203 -5.178 1.00 0.00 C ATOM 293 C PHE A 20 -3.487 -13.889 -5.402 1.00 0.00 C ATOM 294 O PHE A 20 -4.716 -13.908 -5.387 1.00 0.00 O ATOM 295 CB PHE A 20 -1.957 -15.170 -3.815 1.00 0.00 C ATOM 296 CG PHE A 20 -2.770 -14.628 -2.625 1.00 0.00 C ATOM 297 CD1 PHE A 20 -3.899 -15.303 -2.157 1.00 0.00 C ATOM 298 CD2 PHE A 20 -2.410 -13.434 -1.990 1.00 0.00 C ATOM 299 CE1 PHE A 20 -4.637 -14.800 -1.102 1.00 0.00 C ATOM 300 CE2 PHE A 20 -3.150 -12.936 -0.934 1.00 0.00 C ATOM 301 CZ PHE A 20 -4.264 -13.618 -0.492 1.00 0.00 C ATOM 0 H PHE A 20 -0.803 -15.500 -5.986 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.439 -16.019 -5.151 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.625 -16.181 -3.578 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -1.061 -14.560 -3.931 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.199 -16.229 -2.625 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -1.540 -12.893 -2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -5.509 -15.333 -0.753 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -2.856 -12.014 -0.456 1.00 0.00 H new ATOM 0 HZ PHE A 20 -4.845 -13.228 0.331 1.00 0.00 H new ATOM 311 N TYR A 21 -2.778 -12.768 -5.680 1.00 0.00 N ATOM 312 CA TYR A 21 -3.444 -11.470 -5.967 1.00 0.00 C ATOM 313 C TYR A 21 -4.130 -11.501 -7.344 1.00 0.00 C ATOM 314 O TYR A 21 -5.094 -10.755 -7.547 1.00 0.00 O ATOM 315 CB TYR A 21 -2.464 -10.278 -5.844 1.00 0.00 C ATOM 316 CG TYR A 21 -2.123 -9.905 -4.394 1.00 0.00 C ATOM 317 CD1 TYR A 21 -1.067 -10.511 -3.731 1.00 0.00 C ATOM 318 CD2 TYR A 21 -2.876 -8.956 -3.685 1.00 0.00 C ATOM 319 CE1 TYR A 21 -0.765 -10.199 -2.426 1.00 0.00 C ATOM 320 CE2 TYR A 21 -2.571 -8.637 -2.376 1.00 0.00 C ATOM 321 CZ TYR A 21 -1.515 -9.266 -1.753 1.00 0.00 C ATOM 322 OH TYR A 21 -1.213 -8.969 -0.447 1.00 0.00 O ATOM 0 H TYR A 21 -1.759 -12.733 -5.712 1.00 0.00 H new ATOM 0 HA TYR A 21 -4.215 -11.321 -5.211 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.543 -10.521 -6.373 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.898 -9.410 -6.341 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.468 -11.244 -4.251 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.707 -8.467 -4.171 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.061 -10.687 -1.931 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -3.156 -7.900 -1.845 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.963 -9.790 0.026 1.00 0.00 H new ATOM 332 N LYS A 22 -3.626 -12.317 -8.294 1.00 0.00 N ATOM 333 CA LYS A 22 -4.235 -12.422 -9.640 1.00 0.00 C ATOM 334 C LYS A 22 -5.722 -12.810 -9.582 1.00 0.00 C ATOM 335 O LYS A 22 -6.570 -12.161 -10.183 1.00 0.00 O ATOM 336 CB LYS A 22 -3.454 -13.416 -10.537 1.00 0.00 C ATOM 337 CG LYS A 22 -2.135 -12.856 -11.101 1.00 0.00 C ATOM 338 CD LYS A 22 -1.301 -13.906 -11.866 1.00 0.00 C ATOM 339 CE LYS A 22 -2.050 -14.536 -13.056 1.00 0.00 C ATOM 340 NZ LYS A 22 -1.165 -15.400 -13.877 1.00 0.00 N ATOM 0 H LYS A 22 -2.806 -12.908 -8.157 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.172 -11.429 -10.084 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -3.237 -14.315 -9.960 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.092 -13.717 -11.368 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.358 -12.024 -11.768 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.538 -12.456 -10.281 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -0.386 -13.438 -12.229 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.003 -14.695 -11.176 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.889 -15.125 -12.685 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.467 -13.746 -13.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.727 -15.870 -14.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.427 -14.818 -14.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -0.721 -16.118 -13.270 1.00 0.00 H new ATOM 354 N ALA A 23 -6.001 -13.883 -8.832 1.00 0.00 N ATOM 355 CA ALA A 23 -7.374 -14.391 -8.629 1.00 0.00 C ATOM 356 C ALA A 23 -8.146 -13.519 -7.610 1.00 0.00 C ATOM 357 O ALA A 23 -9.351 -13.297 -7.758 1.00 0.00 O ATOM 358 CB ALA A 23 -7.318 -15.856 -8.167 1.00 0.00 C ATOM 0 H ALA A 23 -5.287 -14.426 -8.347 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.912 -14.338 -9.576 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.331 -16.229 -8.018 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.818 -16.458 -8.926 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.766 -15.921 -7.230 1.00 0.00 H new ATOM 364 N LEU A 24 -7.416 -13.024 -6.595 1.00 0.00 N ATOM 365 CA LEU A 24 -7.977 -12.248 -5.456 1.00 0.00 C ATOM 366 C LEU A 24 -8.664 -10.946 -5.921 1.00 0.00 C ATOM 367 O LEU A 24 -9.763 -10.594 -5.464 1.00 0.00 O ATOM 368 CB LEU A 24 -6.816 -11.863 -4.489 1.00 0.00 C ATOM 369 CG LEU A 24 -7.204 -11.382 -3.057 1.00 0.00 C ATOM 370 CD1 LEU A 24 -7.555 -12.586 -2.169 1.00 0.00 C ATOM 371 CD2 LEU A 24 -6.088 -10.516 -2.419 1.00 0.00 C ATOM 0 H LEU A 24 -6.405 -13.149 -6.535 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.722 -12.874 -4.965 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.161 -12.728 -4.388 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.231 -11.074 -4.962 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.086 -10.747 -3.142 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.824 -12.237 -1.172 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.396 -13.126 -2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.694 -13.251 -2.100 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -6.397 -10.201 -1.422 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.171 -11.100 -2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.910 -9.637 -3.039 1.00 0.00 H new ATOM 383 N LEU A 25 -7.988 -10.253 -6.848 1.00 0.00 N ATOM 384 CA LEU A 25 -8.457 -8.985 -7.432 1.00 0.00 C ATOM 385 C LEU A 25 -9.190 -9.283 -8.752 1.00 0.00 C ATOM 386 O LEU A 25 -10.181 -8.614 -9.071 1.00 0.00 O ATOM 387 CB LEU A 25 -7.247 -8.031 -7.636 1.00 0.00 C ATOM 388 CG LEU A 25 -6.263 -7.915 -6.417 1.00 0.00 C ATOM 389 CD1 LEU A 25 -5.129 -6.908 -6.688 1.00 0.00 C ATOM 390 CD2 LEU A 25 -7.010 -7.579 -5.118 1.00 0.00 C ATOM 0 H LEU A 25 -7.089 -10.560 -7.219 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.158 -8.487 -6.763 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.683 -8.369 -8.505 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.626 -7.036 -7.870 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.801 -8.894 -6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.471 -6.858 -5.820 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.557 -7.230 -7.558 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.555 -5.923 -6.877 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.297 -7.507 -4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.529 -6.628 -5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.735 -8.364 -4.902 1.00 0.00 H new ATOM 402 N GLY A 26 -8.713 -10.296 -9.498 1.00 0.00 N ATOM 403 CA GLY A 26 -9.243 -10.610 -10.835 1.00 0.00 C ATOM 404 C GLY A 26 -8.466 -9.884 -11.928 1.00 0.00 C ATOM 405 O GLY A 26 -9.038 -9.438 -12.930 1.00 0.00 O ATOM 0 H GLY A 26 -7.959 -10.912 -9.195 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.193 -11.686 -11.004 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.295 -10.328 -10.886 1.00 0.00 H new ATOM 409 N VAL A 27 -7.139 -9.776 -11.714 1.00 0.00 N ATOM 410 CA VAL A 27 -6.208 -9.031 -12.588 1.00 0.00 C ATOM 411 C VAL A 27 -4.982 -9.902 -12.938 1.00 0.00 C ATOM 412 O VAL A 27 -4.917 -11.071 -12.553 1.00 0.00 O ATOM 413 CB VAL A 27 -5.741 -7.687 -11.906 1.00 0.00 C ATOM 414 CG1 VAL A 27 -6.949 -6.754 -11.622 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.911 -7.953 -10.619 1.00 0.00 C ATOM 0 H VAL A 27 -6.676 -10.211 -10.916 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.739 -8.782 -13.507 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.085 -7.174 -12.609 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.597 -5.836 -11.152 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.451 -6.513 -12.559 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.649 -7.258 -10.955 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.608 -7.003 -10.179 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.517 -8.508 -9.903 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.025 -8.535 -10.871 1.00 0.00 H new ATOM 425 N ASP A 28 -4.029 -9.328 -13.691 1.00 0.00 N ATOM 426 CA ASP A 28 -2.737 -9.972 -14.017 1.00 0.00 C ATOM 427 C ASP A 28 -1.611 -8.915 -13.968 1.00 0.00 C ATOM 428 O ASP A 28 -1.872 -7.733 -14.229 1.00 0.00 O ATOM 429 CB ASP A 28 -2.794 -10.654 -15.414 1.00 0.00 C ATOM 430 CG ASP A 28 -3.037 -9.670 -16.575 1.00 0.00 C ATOM 431 OD1 ASP A 28 -4.182 -9.203 -16.738 1.00 0.00 O ATOM 432 OD2 ASP A 28 -2.094 -9.368 -17.340 1.00 0.00 O ATOM 0 H ASP A 28 -4.130 -8.397 -14.096 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.531 -10.748 -13.280 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.857 -11.183 -15.588 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -3.587 -11.402 -15.411 1.00 0.00 H new ATOM 437 N PRO A 29 -0.341 -9.311 -13.614 1.00 0.00 N ATOM 438 CA PRO A 29 0.805 -8.382 -13.577 1.00 0.00 C ATOM 439 C PRO A 29 1.212 -7.919 -14.996 1.00 0.00 C ATOM 440 O PRO A 29 1.735 -8.712 -15.791 1.00 0.00 O ATOM 441 CB PRO A 29 1.942 -9.200 -12.890 1.00 0.00 C ATOM 442 CG PRO A 29 1.254 -10.398 -12.309 1.00 0.00 C ATOM 443 CD PRO A 29 0.085 -10.671 -13.222 1.00 0.00 C ATOM 0 HA PRO A 29 0.574 -7.464 -13.038 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.708 -9.493 -13.608 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.438 -8.615 -12.116 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.927 -11.255 -12.265 1.00 0.00 H new ATOM 0 HG3 PRO A 29 0.919 -10.203 -11.290 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.376 -11.269 -14.085 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.710 -11.214 -12.711 1.00 0.00 H new ATOM 451 N VAL A 30 0.934 -6.634 -15.303 1.00 0.00 N ATOM 452 CA VAL A 30 1.321 -5.996 -16.579 1.00 0.00 C ATOM 453 C VAL A 30 2.863 -5.894 -16.691 1.00 0.00 C ATOM 454 O VAL A 30 3.427 -5.973 -17.792 1.00 0.00 O ATOM 455 CB VAL A 30 0.634 -4.584 -16.742 1.00 0.00 C ATOM 456 CG1 VAL A 30 1.045 -3.594 -15.620 1.00 0.00 C ATOM 457 CG2 VAL A 30 0.889 -3.989 -18.153 1.00 0.00 C ATOM 0 H VAL A 30 0.434 -6.009 -14.671 1.00 0.00 H new ATOM 0 HA VAL A 30 0.967 -6.624 -17.396 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.440 -4.742 -16.639 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.546 -2.638 -15.778 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.753 -4.000 -14.651 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.125 -3.447 -15.642 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.402 -3.017 -18.231 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.961 -3.872 -18.310 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.483 -4.660 -18.910 1.00 0.00 H new ATOM 467 N GLU A 31 3.531 -5.738 -15.535 1.00 0.00 N ATOM 468 CA GLU A 31 4.994 -5.884 -15.393 1.00 0.00 C ATOM 469 C GLU A 31 5.269 -7.021 -14.394 1.00 0.00 C ATOM 470 O GLU A 31 4.522 -7.171 -13.426 1.00 0.00 O ATOM 471 CB GLU A 31 5.651 -4.565 -14.896 1.00 0.00 C ATOM 472 CG GLU A 31 5.533 -3.368 -15.861 1.00 0.00 C ATOM 473 CD GLU A 31 6.200 -2.078 -15.328 1.00 0.00 C ATOM 474 OE1 GLU A 31 7.448 -2.042 -15.213 1.00 0.00 O ATOM 475 OE2 GLU A 31 5.486 -1.098 -15.019 1.00 0.00 O ATOM 0 H GLU A 31 3.065 -5.503 -14.659 1.00 0.00 H new ATOM 0 HA GLU A 31 5.428 -6.116 -16.366 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.199 -4.289 -13.943 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.707 -4.754 -14.704 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.987 -3.635 -16.815 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.479 -3.169 -16.054 1.00 0.00 H new ATOM 482 N SER A 32 6.322 -7.821 -14.631 1.00 0.00 N ATOM 483 CA SER A 32 6.687 -8.931 -13.733 1.00 0.00 C ATOM 484 C SER A 32 8.157 -9.349 -13.929 1.00 0.00 C ATOM 485 O SER A 32 8.755 -9.153 -14.996 1.00 0.00 O ATOM 486 CB SER A 32 5.738 -10.145 -13.920 1.00 0.00 C ATOM 487 OG SER A 32 5.950 -11.135 -12.917 1.00 0.00 O ATOM 0 H SER A 32 6.937 -7.720 -15.438 1.00 0.00 H new ATOM 0 HA SER A 32 6.574 -8.573 -12.710 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.702 -9.807 -13.885 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.897 -10.584 -14.905 1.00 0.00 H new ATOM 0 HG SER A 32 5.504 -10.862 -12.088 1.00 0.00 H new ATOM 493 N SER A 33 8.712 -9.909 -12.854 1.00 0.00 N ATOM 494 CA SER A 33 10.091 -10.406 -12.752 1.00 0.00 C ATOM 495 C SER A 33 10.065 -11.676 -11.850 1.00 0.00 C ATOM 496 O SER A 33 9.065 -11.897 -11.157 1.00 0.00 O ATOM 497 CB SER A 33 10.990 -9.293 -12.142 1.00 0.00 C ATOM 498 OG SER A 33 10.939 -8.093 -12.908 1.00 0.00 O ATOM 0 H SER A 33 8.190 -10.036 -11.987 1.00 0.00 H new ATOM 0 HA SER A 33 10.500 -10.665 -13.729 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.670 -9.086 -11.121 1.00 0.00 H new ATOM 0 HB3 SER A 33 12.020 -9.646 -12.088 1.00 0.00 H new ATOM 0 HG SER A 33 11.514 -7.416 -12.494 1.00 0.00 H new ATOM 504 N PRO A 34 11.133 -12.547 -11.828 1.00 0.00 N ATOM 505 CA PRO A 34 11.185 -13.726 -10.909 1.00 0.00 C ATOM 506 C PRO A 34 11.107 -13.343 -9.406 1.00 0.00 C ATOM 507 O PRO A 34 10.844 -14.203 -8.563 1.00 0.00 O ATOM 508 CB PRO A 34 12.536 -14.419 -11.264 1.00 0.00 C ATOM 509 CG PRO A 34 13.328 -13.379 -11.996 1.00 0.00 C ATOM 510 CD PRO A 34 12.314 -12.523 -12.724 1.00 0.00 C ATOM 0 HA PRO A 34 10.322 -14.378 -11.048 1.00 0.00 H new ATOM 0 HB2 PRO A 34 13.057 -14.751 -10.366 1.00 0.00 H new ATOM 0 HB3 PRO A 34 12.376 -15.301 -11.884 1.00 0.00 H new ATOM 0 HG2 PRO A 34 13.920 -12.780 -11.304 1.00 0.00 H new ATOM 0 HG3 PRO A 34 14.025 -13.840 -12.696 1.00 0.00 H new ATOM 0 HD2 PRO A 34 12.681 -11.508 -12.877 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.079 -12.928 -13.708 1.00 0.00 H new ATOM 518 N THR A 35 11.340 -12.051 -9.080 1.00 0.00 N ATOM 519 CA THR A 35 11.303 -11.556 -7.690 1.00 0.00 C ATOM 520 C THR A 35 10.379 -10.314 -7.515 1.00 0.00 C ATOM 521 O THR A 35 10.402 -9.652 -6.461 1.00 0.00 O ATOM 522 CB THR A 35 12.765 -11.252 -7.206 1.00 0.00 C ATOM 523 OG1 THR A 35 12.787 -11.015 -5.795 1.00 0.00 O ATOM 524 CG2 THR A 35 13.399 -10.053 -7.938 1.00 0.00 C ATOM 0 H THR A 35 11.557 -11.330 -9.768 1.00 0.00 H new ATOM 0 HA THR A 35 10.869 -12.339 -7.068 1.00 0.00 H new ATOM 0 HB THR A 35 13.359 -12.134 -7.445 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.845 -11.870 -5.320 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.409 -9.890 -7.562 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.439 -10.259 -9.008 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.798 -9.161 -7.763 1.00 0.00 H new ATOM 532 N PHE A 36 9.540 -10.013 -8.530 1.00 0.00 N ATOM 533 CA PHE A 36 8.665 -8.813 -8.508 1.00 0.00 C ATOM 534 C PHE A 36 7.420 -9.027 -9.396 1.00 0.00 C ATOM 535 O PHE A 36 7.411 -9.892 -10.262 1.00 0.00 O ATOM 536 CB PHE A 36 9.481 -7.562 -8.978 1.00 0.00 C ATOM 537 CG PHE A 36 8.752 -6.217 -8.829 1.00 0.00 C ATOM 538 CD1 PHE A 36 8.700 -5.569 -7.594 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.120 -5.604 -9.915 1.00 0.00 C ATOM 540 CE1 PHE A 36 8.041 -4.362 -7.447 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.462 -4.396 -9.762 1.00 0.00 C ATOM 542 CZ PHE A 36 7.421 -3.776 -8.530 1.00 0.00 C ATOM 0 H PHE A 36 9.448 -10.580 -9.373 1.00 0.00 H new ATOM 0 HA PHE A 36 8.317 -8.644 -7.489 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.410 -7.519 -8.410 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.753 -7.697 -10.025 1.00 0.00 H new ATOM 0 HD1 PHE A 36 9.183 -6.018 -6.738 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.146 -6.079 -10.885 1.00 0.00 H new ATOM 0 HE1 PHE A 36 8.012 -3.878 -6.482 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.978 -3.936 -10.611 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.905 -2.834 -8.414 1.00 0.00 H new ATOM 552 N SER A 37 6.373 -8.226 -9.146 1.00 0.00 N ATOM 553 CA SER A 37 5.168 -8.138 -9.992 1.00 0.00 C ATOM 554 C SER A 37 4.528 -6.748 -9.830 1.00 0.00 C ATOM 555 O SER A 37 4.699 -6.094 -8.802 1.00 0.00 O ATOM 556 CB SER A 37 4.154 -9.256 -9.650 1.00 0.00 C ATOM 557 OG SER A 37 4.650 -10.529 -10.035 1.00 0.00 O ATOM 0 H SER A 37 6.337 -7.608 -8.335 1.00 0.00 H new ATOM 0 HA SER A 37 5.462 -8.278 -11.032 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.949 -9.250 -8.580 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.209 -9.062 -10.157 1.00 0.00 H new ATOM 0 HG SER A 37 4.398 -11.195 -9.362 1.00 0.00 H new ATOM 563 N LEU A 38 3.802 -6.311 -10.862 1.00 0.00 N ATOM 564 CA LEU A 38 3.135 -5.006 -10.907 1.00 0.00 C ATOM 565 C LEU A 38 1.839 -5.177 -11.703 1.00 0.00 C ATOM 566 O LEU A 38 1.879 -5.563 -12.866 1.00 0.00 O ATOM 567 CB LEU A 38 4.103 -3.949 -11.517 1.00 0.00 C ATOM 568 CG LEU A 38 3.601 -2.468 -11.662 1.00 0.00 C ATOM 569 CD1 LEU A 38 2.920 -2.203 -13.015 1.00 0.00 C ATOM 570 CD2 LEU A 38 2.672 -2.067 -10.502 1.00 0.00 C ATOM 0 H LEU A 38 3.658 -6.865 -11.706 1.00 0.00 H new ATOM 0 HA LEU A 38 2.876 -4.641 -9.913 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.006 -3.935 -10.906 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.394 -4.299 -12.507 1.00 0.00 H new ATOM 0 HG LEU A 38 4.492 -1.842 -11.620 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.593 -1.164 -13.060 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.627 -2.397 -13.822 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.057 -2.860 -13.123 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.345 -1.036 -10.637 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.803 -2.724 -10.488 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.209 -2.156 -9.558 1.00 0.00 H new ATOM 582 N PHE A 39 0.710 -4.819 -11.082 1.00 0.00 N ATOM 583 CA PHE A 39 -0.623 -4.783 -11.719 1.00 0.00 C ATOM 584 C PHE A 39 -1.275 -3.423 -11.401 1.00 0.00 C ATOM 585 O PHE A 39 -1.195 -2.929 -10.277 1.00 0.00 O ATOM 586 CB PHE A 39 -1.495 -5.992 -11.243 1.00 0.00 C ATOM 587 CG PHE A 39 -1.241 -6.428 -9.785 1.00 0.00 C ATOM 588 CD1 PHE A 39 -1.956 -5.876 -8.720 1.00 0.00 C ATOM 589 CD2 PHE A 39 -0.254 -7.380 -9.486 1.00 0.00 C ATOM 590 CE1 PHE A 39 -1.694 -6.259 -7.415 1.00 0.00 C ATOM 591 CE2 PHE A 39 0.000 -7.760 -8.181 1.00 0.00 C ATOM 592 CZ PHE A 39 -0.718 -7.199 -7.146 1.00 0.00 C ATOM 0 H PHE A 39 0.691 -4.539 -10.101 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.533 -4.881 -12.801 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.547 -5.730 -11.353 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.307 -6.841 -11.901 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.723 -5.141 -8.916 1.00 0.00 H new ATOM 0 HD2 PHE A 39 0.317 -7.823 -10.289 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.256 -5.820 -6.603 1.00 0.00 H new ATOM 0 HE2 PHE A 39 0.761 -8.497 -7.972 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.518 -7.494 -6.127 1.00 0.00 H new ATOM 602 N VAL A 40 -1.910 -2.817 -12.414 1.00 0.00 N ATOM 603 CA VAL A 40 -2.508 -1.472 -12.311 1.00 0.00 C ATOM 604 C VAL A 40 -4.035 -1.598 -12.395 1.00 0.00 C ATOM 605 O VAL A 40 -4.556 -2.130 -13.382 1.00 0.00 O ATOM 606 CB VAL A 40 -1.989 -0.519 -13.459 1.00 0.00 C ATOM 607 CG1 VAL A 40 -2.459 0.943 -13.242 1.00 0.00 C ATOM 608 CG2 VAL A 40 -0.451 -0.600 -13.600 1.00 0.00 C ATOM 0 H VAL A 40 -2.025 -3.245 -13.333 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.215 -1.034 -11.357 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.427 -0.865 -14.395 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.083 1.570 -14.051 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.548 0.977 -13.232 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.076 1.311 -12.290 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.123 0.067 -14.398 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.017 -0.301 -12.662 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.161 -1.623 -13.840 1.00 0.00 H new ATOM 618 N LEU A 41 -4.741 -1.099 -11.371 1.00 0.00 N ATOM 619 CA LEU A 41 -6.179 -1.362 -11.185 1.00 0.00 C ATOM 620 C LEU A 41 -7.013 -0.297 -11.919 1.00 0.00 C ATOM 621 O LEU A 41 -6.606 0.869 -12.011 1.00 0.00 O ATOM 622 CB LEU A 41 -6.538 -1.396 -9.670 1.00 0.00 C ATOM 623 CG LEU A 41 -5.806 -2.480 -8.801 1.00 0.00 C ATOM 624 CD1 LEU A 41 -6.301 -2.458 -7.341 1.00 0.00 C ATOM 625 CD2 LEU A 41 -5.949 -3.892 -9.407 1.00 0.00 C ATOM 0 H LEU A 41 -4.335 -0.503 -10.649 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.413 -2.338 -11.610 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.321 -0.416 -9.246 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.613 -1.553 -9.577 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.746 -2.226 -8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.774 -3.220 -6.767 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.107 -1.478 -6.906 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.372 -2.661 -7.317 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.429 -4.613 -8.776 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.005 -4.157 -9.467 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.515 -3.905 -10.407 1.00 0.00 H new ATOM 637 N ALA A 42 -8.207 -0.707 -12.398 1.00 0.00 N ATOM 638 CA ALA A 42 -9.100 0.128 -13.240 1.00 0.00 C ATOM 639 C ALA A 42 -9.692 1.347 -12.492 1.00 0.00 C ATOM 640 O ALA A 42 -10.346 2.201 -13.103 1.00 0.00 O ATOM 641 CB ALA A 42 -10.227 -0.751 -13.801 1.00 0.00 C ATOM 0 H ALA A 42 -8.585 -1.636 -12.211 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.493 0.538 -14.047 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.887 -0.144 -14.421 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.798 -1.552 -14.403 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -10.797 -1.182 -12.978 1.00 0.00 H new ATOM 647 N ASN A 43 -9.454 1.418 -11.172 1.00 0.00 N ATOM 648 CA ASN A 43 -9.948 2.510 -10.308 1.00 0.00 C ATOM 649 C ASN A 43 -9.037 3.760 -10.384 1.00 0.00 C ATOM 650 O ASN A 43 -9.262 4.736 -9.658 1.00 0.00 O ATOM 651 CB ASN A 43 -10.067 2.024 -8.834 1.00 0.00 C ATOM 652 CG ASN A 43 -10.940 0.773 -8.644 1.00 0.00 C ATOM 653 OD1 ASN A 43 -10.937 -0.150 -9.461 1.00 0.00 O ATOM 654 ND2 ASN A 43 -11.693 0.732 -7.555 1.00 0.00 N ATOM 0 H ASN A 43 -8.911 0.717 -10.669 1.00 0.00 H new ATOM 0 HA ASN A 43 -10.935 2.795 -10.673 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.068 1.816 -8.452 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.477 2.833 -8.230 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.289 -0.077 -7.377 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.677 1.509 -6.894 1.00 0.00 H new ATOM 661 N GLY A 44 -8.013 3.724 -11.261 1.00 0.00 N ATOM 662 CA GLY A 44 -7.089 4.850 -11.447 1.00 0.00 C ATOM 663 C GLY A 44 -5.899 4.794 -10.499 1.00 0.00 C ATOM 664 O GLY A 44 -5.136 5.757 -10.392 1.00 0.00 O ATOM 0 H GLY A 44 -7.808 2.919 -11.853 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.729 4.854 -12.476 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.627 5.786 -11.294 1.00 0.00 H new ATOM 668 N MET A 45 -5.720 3.641 -9.834 1.00 0.00 N ATOM 669 CA MET A 45 -4.647 3.426 -8.848 1.00 0.00 C ATOM 670 C MET A 45 -3.713 2.307 -9.332 1.00 0.00 C ATOM 671 O MET A 45 -4.013 1.612 -10.314 1.00 0.00 O ATOM 672 CB MET A 45 -5.276 3.104 -7.462 1.00 0.00 C ATOM 673 CG MET A 45 -5.938 1.717 -7.339 1.00 0.00 C ATOM 674 SD MET A 45 -4.742 0.398 -7.017 1.00 0.00 S ATOM 675 CE MET A 45 -4.163 0.804 -5.368 1.00 0.00 C ATOM 0 H MET A 45 -6.319 2.826 -9.966 1.00 0.00 H new ATOM 0 HA MET A 45 -4.047 4.329 -8.741 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.499 3.185 -6.702 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.023 3.865 -7.236 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.673 1.740 -6.534 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.479 1.494 -8.259 1.00 0.00 H new ATOM 0 HE1 MET A 45 -3.997 -0.114 -4.804 1.00 0.00 H new ATOM 0 HE2 MET A 45 -3.229 1.361 -5.437 1.00 0.00 H new ATOM 0 HE3 MET A 45 -4.911 1.412 -4.859 1.00 0.00 H new ATOM 685 N LYS A 46 -2.594 2.121 -8.624 1.00 0.00 N ATOM 686 CA LYS A 46 -1.532 1.190 -9.033 1.00 0.00 C ATOM 687 C LYS A 46 -1.075 0.373 -7.808 1.00 0.00 C ATOM 688 O LYS A 46 -0.960 0.925 -6.706 1.00 0.00 O ATOM 689 CB LYS A 46 -0.387 2.031 -9.663 1.00 0.00 C ATOM 690 CG LYS A 46 0.701 1.238 -10.406 1.00 0.00 C ATOM 691 CD LYS A 46 1.684 2.171 -11.157 1.00 0.00 C ATOM 692 CE LYS A 46 2.745 1.406 -11.954 1.00 0.00 C ATOM 693 NZ LYS A 46 3.651 2.320 -12.686 1.00 0.00 N ATOM 0 H LYS A 46 -2.397 2.611 -7.751 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.878 0.472 -9.776 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.828 2.745 -10.359 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.090 2.610 -8.872 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.254 0.625 -9.694 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.233 0.557 -11.116 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.121 2.813 -11.835 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.178 2.823 -10.437 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.328 0.782 -11.277 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.255 0.737 -12.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.041 1.830 -13.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.121 3.159 -12.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.428 2.613 -12.060 1.00 0.00 H new ATOM 707 N LEU A 47 -0.826 -0.940 -7.998 1.00 0.00 N ATOM 708 CA LEU A 47 -0.531 -1.870 -6.879 1.00 0.00 C ATOM 709 C LEU A 47 0.639 -2.818 -7.266 1.00 0.00 C ATOM 710 O LEU A 47 0.585 -3.517 -8.279 1.00 0.00 O ATOM 711 CB LEU A 47 -1.828 -2.654 -6.477 1.00 0.00 C ATOM 712 CG LEU A 47 -2.026 -2.985 -4.951 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.404 -3.634 -4.716 1.00 0.00 C ATOM 714 CD2 LEU A 47 -0.894 -3.873 -4.372 1.00 0.00 C ATOM 0 H LEU A 47 -0.823 -1.384 -8.916 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.211 -1.304 -6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.689 -2.076 -6.812 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.840 -3.593 -7.030 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.980 -2.037 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.525 -3.857 -3.656 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.189 -2.948 -5.035 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.474 -4.557 -5.291 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.087 -4.066 -3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -0.860 -4.818 -4.914 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.062 -3.359 -4.478 1.00 0.00 H new ATOM 726 N GLY A 48 1.693 -2.813 -6.429 1.00 0.00 N ATOM 727 CA GLY A 48 2.909 -3.608 -6.644 1.00 0.00 C ATOM 728 C GLY A 48 2.956 -4.858 -5.782 1.00 0.00 C ATOM 729 O GLY A 48 2.174 -5.017 -4.838 1.00 0.00 O ATOM 0 H GLY A 48 1.721 -2.251 -5.578 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.969 -3.894 -7.694 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.783 -2.992 -6.431 1.00 0.00 H new ATOM 733 N LEU A 49 3.935 -5.715 -6.094 1.00 0.00 N ATOM 734 CA LEU A 49 4.295 -6.885 -5.293 1.00 0.00 C ATOM 735 C LEU A 49 5.825 -6.966 -5.303 1.00 0.00 C ATOM 736 O LEU A 49 6.418 -7.344 -6.314 1.00 0.00 O ATOM 737 CB LEU A 49 3.654 -8.182 -5.882 1.00 0.00 C ATOM 738 CG LEU A 49 3.126 -9.184 -4.829 1.00 0.00 C ATOM 739 CD1 LEU A 49 1.929 -8.583 -4.062 1.00 0.00 C ATOM 740 CD2 LEU A 49 2.775 -10.534 -5.467 1.00 0.00 C ATOM 0 H LEU A 49 4.510 -5.610 -6.930 1.00 0.00 H new ATOM 0 HA LEU A 49 3.920 -6.794 -4.273 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.830 -7.898 -6.537 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.395 -8.686 -6.503 1.00 0.00 H new ATOM 0 HG LEU A 49 3.922 -9.373 -4.109 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.571 -9.302 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.243 -7.670 -3.555 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.127 -8.351 -4.763 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.407 -11.215 -4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.004 -10.389 -6.223 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.664 -10.959 -5.932 1.00 0.00 H new ATOM 752 N TRP A 50 6.454 -6.587 -4.187 1.00 0.00 N ATOM 753 CA TRP A 50 7.920 -6.561 -4.056 1.00 0.00 C ATOM 754 C TRP A 50 8.343 -7.599 -3.009 1.00 0.00 C ATOM 755 O TRP A 50 7.794 -7.631 -1.899 1.00 0.00 O ATOM 756 CB TRP A 50 8.367 -5.131 -3.657 1.00 0.00 C ATOM 757 CG TRP A 50 9.832 -4.782 -3.826 1.00 0.00 C ATOM 758 CD1 TRP A 50 10.888 -5.597 -4.141 1.00 0.00 C ATOM 759 CD2 TRP A 50 10.383 -3.469 -3.680 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.050 -4.867 -4.182 1.00 0.00 N ATOM 761 CE2 TRP A 50 11.759 -3.556 -3.911 1.00 0.00 C ATOM 762 CE3 TRP A 50 9.828 -2.227 -3.386 1.00 0.00 C ATOM 763 CZ2 TRP A 50 12.594 -2.446 -3.833 1.00 0.00 C ATOM 764 CZ3 TRP A 50 10.653 -1.126 -3.315 1.00 0.00 C ATOM 765 CH2 TRP A 50 12.027 -1.239 -3.535 1.00 0.00 C ATOM 0 H TRP A 50 5.963 -6.288 -3.345 1.00 0.00 H new ATOM 0 HA TRP A 50 8.400 -6.814 -5.001 1.00 0.00 H new ATOM 0 HB2 TRP A 50 7.783 -4.421 -4.242 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.103 -4.976 -2.611 1.00 0.00 H new ATOM 0 HD1 TRP A 50 10.816 -6.658 -4.329 1.00 0.00 H new ATOM 0 HE1 TRP A 50 12.978 -5.240 -4.382 1.00 0.00 H new ATOM 0 HE3 TRP A 50 8.766 -2.128 -3.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 13.657 -2.535 -4.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.230 -0.159 -3.085 1.00 0.00 H new ATOM 0 HH2 TRP A 50 12.651 -0.360 -3.469 1.00 0.00 H new ATOM 776 N SER A 51 9.300 -8.455 -3.385 1.00 0.00 N ATOM 777 CA SER A 51 9.836 -9.489 -2.500 1.00 0.00 C ATOM 778 C SER A 51 10.854 -8.895 -1.500 1.00 0.00 C ATOM 779 O SER A 51 11.731 -8.114 -1.885 1.00 0.00 O ATOM 780 CB SER A 51 10.456 -10.613 -3.344 1.00 0.00 C ATOM 781 OG SER A 51 9.493 -11.180 -4.217 1.00 0.00 O ATOM 0 H SER A 51 9.723 -8.448 -4.313 1.00 0.00 H new ATOM 0 HA SER A 51 9.023 -9.909 -1.907 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.291 -10.220 -3.924 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.858 -11.386 -2.689 1.00 0.00 H new ATOM 0 HG SER A 51 9.587 -10.784 -5.109 1.00 0.00 H new ATOM 787 N ARG A 52 10.735 -9.288 -0.224 1.00 0.00 N ATOM 788 CA ARG A 52 11.526 -8.718 0.889 1.00 0.00 C ATOM 789 C ARG A 52 13.030 -9.071 0.811 1.00 0.00 C ATOM 790 O ARG A 52 13.862 -8.392 1.422 1.00 0.00 O ATOM 791 CB ARG A 52 10.932 -9.191 2.237 1.00 0.00 C ATOM 792 CG ARG A 52 10.913 -10.719 2.439 1.00 0.00 C ATOM 793 CD ARG A 52 10.331 -11.128 3.796 1.00 0.00 C ATOM 794 NE ARG A 52 10.387 -12.589 3.983 1.00 0.00 N ATOM 795 CZ ARG A 52 10.327 -13.229 5.160 1.00 0.00 C ATOM 796 NH1 ARG A 52 10.176 -12.563 6.295 1.00 0.00 N ATOM 797 NH2 ARG A 52 10.414 -14.550 5.191 1.00 0.00 N ATOM 0 H ARG A 52 10.084 -10.015 0.073 1.00 0.00 H new ATOM 0 HA ARG A 52 11.463 -7.633 0.808 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.504 -8.739 3.048 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.912 -8.816 2.319 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.327 -11.179 1.643 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.928 -11.106 2.352 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.885 -10.635 4.595 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.298 -10.789 3.868 1.00 0.00 H new ATOM 0 HE ARG A 52 10.479 -13.163 3.145 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.103 -11.546 6.284 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.133 -13.067 7.180 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.526 -15.074 4.323 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.369 -15.043 6.083 1.00 0.00 H new ATOM 811 N HIS A 53 13.374 -10.132 0.054 1.00 0.00 N ATOM 812 CA HIS A 53 14.782 -10.559 -0.126 1.00 0.00 C ATOM 813 C HIS A 53 15.526 -9.681 -1.156 1.00 0.00 C ATOM 814 O HIS A 53 16.745 -9.803 -1.297 1.00 0.00 O ATOM 815 CB HIS A 53 14.886 -12.076 -0.490 1.00 0.00 C ATOM 816 CG HIS A 53 14.183 -12.546 -1.747 1.00 0.00 C ATOM 817 ND1 HIS A 53 13.874 -13.868 -1.964 1.00 0.00 N ATOM 818 CD2 HIS A 53 13.751 -11.892 -2.850 1.00 0.00 C ATOM 819 CE1 HIS A 53 13.292 -14.002 -3.137 1.00 0.00 C ATOM 820 NE2 HIS A 53 13.205 -12.822 -3.697 1.00 0.00 N ATOM 0 H HIS A 53 12.698 -10.711 -0.444 1.00 0.00 H new ATOM 0 HA HIS A 53 15.278 -10.419 0.835 1.00 0.00 H new ATOM 0 HB2 HIS A 53 15.943 -12.328 -0.582 1.00 0.00 H new ATOM 0 HB3 HIS A 53 14.493 -12.650 0.349 1.00 0.00 H new ATOM 0 HD1 HIS A 53 14.067 -14.630 -1.314 1.00 0.00 H new ATOM 0 HD2 HIS A 53 13.823 -10.830 -3.031 1.00 0.00 H new ATOM 0 HE1 HIS A 53 12.944 -14.930 -3.566 1.00 0.00 H new ATOM 829 N THR A 54 14.793 -8.796 -1.863 1.00 0.00 N ATOM 830 CA THR A 54 15.376 -7.920 -2.902 1.00 0.00 C ATOM 831 C THR A 54 14.966 -6.446 -2.689 1.00 0.00 C ATOM 832 O THR A 54 15.254 -5.586 -3.536 1.00 0.00 O ATOM 833 CB THR A 54 14.958 -8.417 -4.334 1.00 0.00 C ATOM 834 OG1 THR A 54 15.741 -7.764 -5.345 1.00 0.00 O ATOM 835 CG2 THR A 54 13.459 -8.186 -4.616 1.00 0.00 C ATOM 0 H THR A 54 13.790 -8.668 -1.732 1.00 0.00 H new ATOM 0 HA THR A 54 16.462 -7.974 -2.820 1.00 0.00 H new ATOM 0 HB THR A 54 15.145 -9.490 -4.362 1.00 0.00 H new ATOM 0 HG1 THR A 54 15.857 -6.820 -5.110 1.00 0.00 H new ATOM 0 HG21 THR A 54 13.217 -8.545 -5.616 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.863 -8.728 -3.882 1.00 0.00 H new ATOM 0 HG23 THR A 54 13.236 -7.121 -4.549 1.00 0.00 H new ATOM 843 N VAL A 55 14.305 -6.148 -1.549 1.00 0.00 N ATOM 844 CA VAL A 55 13.874 -4.773 -1.228 1.00 0.00 C ATOM 845 C VAL A 55 15.101 -3.893 -0.913 1.00 0.00 C ATOM 846 O VAL A 55 16.114 -4.392 -0.414 1.00 0.00 O ATOM 847 CB VAL A 55 12.835 -4.741 -0.043 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.483 -5.197 1.281 1.00 0.00 C ATOM 849 CG2 VAL A 55 12.157 -3.346 0.097 1.00 0.00 C ATOM 0 H VAL A 55 14.060 -6.839 -0.840 1.00 0.00 H new ATOM 0 HA VAL A 55 13.366 -4.369 -2.104 1.00 0.00 H new ATOM 0 HB VAL A 55 12.045 -5.453 -0.284 1.00 0.00 H new ATOM 0 HG11 VAL A 55 12.742 -5.164 2.079 1.00 0.00 H new ATOM 0 HG12 VAL A 55 13.854 -6.216 1.172 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.312 -4.533 1.528 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.448 -3.367 0.925 1.00 0.00 H new ATOM 0 HG22 VAL A 55 12.918 -2.589 0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.630 -3.104 -0.826 1.00 0.00 H new ATOM 859 N GLU A 56 15.021 -2.601 -1.253 1.00 0.00 N ATOM 860 CA GLU A 56 16.101 -1.631 -1.009 1.00 0.00 C ATOM 861 C GLU A 56 15.530 -0.396 -0.271 1.00 0.00 C ATOM 862 O GLU A 56 14.713 0.325 -0.848 1.00 0.00 O ATOM 863 CB GLU A 56 16.799 -1.239 -2.342 1.00 0.00 C ATOM 864 CG GLU A 56 17.787 -2.294 -2.882 1.00 0.00 C ATOM 865 CD GLU A 56 18.640 -1.783 -4.060 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.287 -0.719 -3.914 1.00 0.00 O ATOM 867 OE2 GLU A 56 18.699 -2.450 -5.117 1.00 0.00 O ATOM 0 H GLU A 56 14.203 -2.195 -1.707 1.00 0.00 H new ATOM 0 HA GLU A 56 16.861 -2.086 -0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 56 16.035 -1.055 -3.097 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.334 -0.301 -2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 56 18.447 -2.610 -2.075 1.00 0.00 H new ATOM 0 HG3 GLU A 56 17.229 -3.174 -3.201 1.00 0.00 H new ATOM 874 N PRO A 57 15.929 -0.127 1.031 1.00 0.00 N ATOM 875 CA PRO A 57 16.931 -0.917 1.795 1.00 0.00 C ATOM 876 C PRO A 57 16.381 -2.288 2.261 1.00 0.00 C ATOM 877 O PRO A 57 15.185 -2.418 2.576 1.00 0.00 O ATOM 878 CB PRO A 57 17.256 0.007 3.000 1.00 0.00 C ATOM 879 CG PRO A 57 15.973 0.739 3.242 1.00 0.00 C ATOM 880 CD PRO A 57 15.394 0.988 1.862 1.00 0.00 C ATOM 0 HA PRO A 57 17.804 -1.174 1.195 1.00 0.00 H new ATOM 0 HB2 PRO A 57 17.560 -0.568 3.875 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.071 0.693 2.770 1.00 0.00 H new ATOM 0 HG2 PRO A 57 15.292 0.149 3.855 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.147 1.676 3.771 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.304 0.982 1.881 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.701 1.958 1.471 1.00 0.00 H new ATOM 888 N LYS A 58 17.272 -3.302 2.232 1.00 0.00 N ATOM 889 CA LYS A 58 16.993 -4.671 2.697 1.00 0.00 C ATOM 890 C LYS A 58 16.373 -4.688 4.105 1.00 0.00 C ATOM 891 O LYS A 58 16.942 -4.134 5.049 1.00 0.00 O ATOM 892 CB LYS A 58 18.296 -5.525 2.665 1.00 0.00 C ATOM 893 CG LYS A 58 18.745 -5.979 1.258 1.00 0.00 C ATOM 894 CD LYS A 58 17.753 -6.969 0.610 1.00 0.00 C ATOM 895 CE LYS A 58 17.563 -8.251 1.436 1.00 0.00 C ATOM 896 NZ LYS A 58 18.812 -9.048 1.535 1.00 0.00 N ATOM 0 H LYS A 58 18.222 -3.186 1.878 1.00 0.00 H new ATOM 0 HA LYS A 58 16.261 -5.107 2.017 1.00 0.00 H new ATOM 0 HB2 LYS A 58 19.102 -4.948 3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.149 -6.409 3.286 1.00 0.00 H new ATOM 0 HG2 LYS A 58 18.853 -5.105 0.615 1.00 0.00 H new ATOM 0 HG3 LYS A 58 19.727 -6.447 1.327 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.788 -6.478 0.483 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.109 -7.234 -0.386 1.00 0.00 H new ATOM 0 HE2 LYS A 58 17.222 -7.988 2.437 1.00 0.00 H new ATOM 0 HE3 LYS A 58 16.781 -8.860 0.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 18.630 -9.911 2.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.134 -9.308 0.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 19.547 -8.484 2.007 1.00 0.00 H new ATOM 910 N ALA A 59 15.202 -5.324 4.210 1.00 0.00 N ATOM 911 CA ALA A 59 14.422 -5.415 5.449 1.00 0.00 C ATOM 912 C ALA A 59 13.734 -6.786 5.517 1.00 0.00 C ATOM 913 O ALA A 59 13.500 -7.432 4.482 1.00 0.00 O ATOM 914 CB ALA A 59 13.396 -4.264 5.526 1.00 0.00 C ATOM 0 H ALA A 59 14.761 -5.799 3.422 1.00 0.00 H new ATOM 0 HA ALA A 59 15.087 -5.317 6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 59 12.826 -4.346 6.451 1.00 0.00 H new ATOM 0 HB2 ALA A 59 13.919 -3.308 5.506 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.718 -4.324 4.675 1.00 0.00 H new ATOM 920 N SER A 60 13.420 -7.226 6.739 1.00 0.00 N ATOM 921 CA SER A 60 12.759 -8.510 6.999 1.00 0.00 C ATOM 922 C SER A 60 11.601 -8.275 7.985 1.00 0.00 C ATOM 923 O SER A 60 11.806 -8.225 9.207 1.00 0.00 O ATOM 924 CB SER A 60 13.767 -9.539 7.567 1.00 0.00 C ATOM 925 OG SER A 60 14.865 -9.739 6.690 1.00 0.00 O ATOM 0 H SER A 60 13.620 -6.695 7.586 1.00 0.00 H new ATOM 0 HA SER A 60 12.367 -8.918 6.067 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.132 -9.194 8.534 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.260 -10.489 7.738 1.00 0.00 H new ATOM 0 HG SER A 60 15.481 -10.393 7.081 1.00 0.00 H new ATOM 931 N VAL A 61 10.398 -8.076 7.429 1.00 0.00 N ATOM 932 CA VAL A 61 9.151 -7.900 8.196 1.00 0.00 C ATOM 933 C VAL A 61 7.997 -8.571 7.430 1.00 0.00 C ATOM 934 O VAL A 61 7.788 -8.301 6.252 1.00 0.00 O ATOM 935 CB VAL A 61 8.840 -6.372 8.467 1.00 0.00 C ATOM 936 CG1 VAL A 61 9.017 -5.527 7.183 1.00 0.00 C ATOM 937 CG2 VAL A 61 7.433 -6.162 9.103 1.00 0.00 C ATOM 0 H VAL A 61 10.259 -8.032 6.420 1.00 0.00 H new ATOM 0 HA VAL A 61 9.267 -8.372 9.171 1.00 0.00 H new ATOM 0 HB VAL A 61 9.569 -6.021 9.197 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.796 -4.482 7.402 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.044 -5.614 6.829 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.336 -5.888 6.413 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.265 -5.098 9.271 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.668 -6.549 8.430 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.381 -6.692 10.054 1.00 0.00 H new ATOM 947 N THR A 62 7.280 -9.481 8.100 1.00 0.00 N ATOM 948 CA THR A 62 6.095 -10.163 7.544 1.00 0.00 C ATOM 949 C THR A 62 5.022 -10.289 8.634 1.00 0.00 C ATOM 950 O THR A 62 5.345 -10.507 9.809 1.00 0.00 O ATOM 951 CB THR A 62 6.459 -11.576 6.950 1.00 0.00 C ATOM 952 OG1 THR A 62 7.466 -12.206 7.763 1.00 0.00 O ATOM 953 CG2 THR A 62 6.943 -11.492 5.487 1.00 0.00 C ATOM 0 H THR A 62 7.504 -9.770 9.052 1.00 0.00 H new ATOM 0 HA THR A 62 5.707 -9.563 6.721 1.00 0.00 H new ATOM 0 HB THR A 62 5.548 -12.174 6.957 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.686 -13.085 7.389 1.00 0.00 H new ATOM 0 HG21 THR A 62 7.181 -12.492 5.125 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.157 -11.059 4.868 1.00 0.00 H new ATOM 0 HG23 THR A 62 7.833 -10.865 5.434 1.00 0.00 H new ATOM 961 N GLY A 63 3.748 -10.132 8.231 1.00 0.00 N ATOM 962 CA GLY A 63 2.618 -10.141 9.169 1.00 0.00 C ATOM 963 C GLY A 63 2.507 -8.846 9.966 1.00 0.00 C ATOM 964 O GLY A 63 1.918 -8.825 11.052 1.00 0.00 O ATOM 0 H GLY A 63 3.478 -9.997 7.257 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.693 -10.303 8.616 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.729 -10.979 9.858 1.00 0.00 H new ATOM 968 N GLY A 64 3.075 -7.759 9.410 1.00 0.00 N ATOM 969 CA GLY A 64 3.082 -6.459 10.066 1.00 0.00 C ATOM 970 C GLY A 64 3.344 -5.325 9.091 1.00 0.00 C ATOM 971 O GLY A 64 4.150 -5.472 8.159 1.00 0.00 O ATOM 0 H GLY A 64 3.536 -7.767 8.500 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.123 -6.298 10.559 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.846 -6.451 10.844 1.00 0.00 H new ATOM 975 N GLY A 65 2.632 -4.204 9.292 1.00 0.00 N ATOM 976 CA GLY A 65 2.761 -3.010 8.463 1.00 0.00 C ATOM 977 C GLY A 65 1.428 -2.299 8.302 1.00 0.00 C ATOM 978 O GLY A 65 0.538 -2.452 9.146 1.00 0.00 O ATOM 0 H GLY A 65 1.947 -4.107 10.042 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.485 -2.330 8.912 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.148 -3.286 7.482 1.00 0.00 H new ATOM 982 N GLY A 66 1.295 -1.518 7.216 1.00 0.00 N ATOM 983 CA GLY A 66 0.046 -0.810 6.898 1.00 0.00 C ATOM 984 C GLY A 66 -1.014 -1.725 6.318 1.00 0.00 C ATOM 985 O GLY A 66 -0.721 -2.864 5.955 1.00 0.00 O ATOM 0 H GLY A 66 2.043 -1.362 6.541 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.341 -0.340 7.802 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.257 -0.010 6.188 1.00 0.00 H new ATOM 989 N GLU A 67 -2.232 -1.205 6.153 1.00 0.00 N ATOM 990 CA GLU A 67 -3.387 -2.009 5.725 1.00 0.00 C ATOM 991 C GLU A 67 -3.616 -1.806 4.223 1.00 0.00 C ATOM 992 O GLU A 67 -3.289 -0.745 3.678 1.00 0.00 O ATOM 993 CB GLU A 67 -4.667 -1.565 6.478 1.00 0.00 C ATOM 994 CG GLU A 67 -4.586 -1.570 8.022 1.00 0.00 C ATOM 995 CD GLU A 67 -5.936 -1.229 8.690 1.00 0.00 C ATOM 996 OE1 GLU A 67 -6.721 -0.452 8.097 1.00 0.00 O ATOM 997 OE2 GLU A 67 -6.240 -1.772 9.775 1.00 0.00 O ATOM 0 H GLU A 67 -2.449 -0.221 6.310 1.00 0.00 H new ATOM 0 HA GLU A 67 -3.181 -3.056 5.945 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.925 -0.557 6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.486 -2.217 6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.255 -2.551 8.361 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -3.833 -0.851 8.345 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.187 -2.814 3.556 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.620 -2.685 2.162 1.00 0.00 C ATOM 1006 C LEU A 68 -6.148 -2.701 2.165 1.00 0.00 C ATOM 1007 O LEU A 68 -6.738 -3.770 2.314 1.00 0.00 O ATOM 1008 CB LEU A 68 -4.035 -3.813 1.267 1.00 0.00 C ATOM 1009 CG LEU A 68 -4.345 -3.684 -0.264 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -3.759 -2.377 -0.858 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -3.870 -4.929 -1.048 1.00 0.00 C ATOM 0 H LEU A 68 -4.361 -3.733 3.963 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.249 -1.753 1.735 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.954 -3.836 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.420 -4.770 1.619 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.428 -3.629 -0.370 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.994 -2.323 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.193 -1.518 -0.346 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.677 -2.370 -0.725 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.102 -4.803 -2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.794 -5.048 -0.924 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.379 -5.815 -0.668 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.786 -1.536 2.062 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.226 -1.416 2.317 1.00 0.00 C ATOM 1025 C ALA A 69 -9.055 -1.769 1.065 1.00 0.00 C ATOM 1026 O ALA A 69 -9.011 -1.062 0.052 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.557 -0.025 2.862 1.00 0.00 C ATOM 0 H ALA A 69 -6.331 -0.660 1.804 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.502 -2.143 3.081 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.629 0.048 3.046 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -8.017 0.138 3.794 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.261 0.731 2.134 1.00 0.00 H new ATOM 1033 N PHE A 70 -9.809 -2.877 1.166 1.00 0.00 N ATOM 1034 CA PHE A 70 -10.700 -3.382 0.118 1.00 0.00 C ATOM 1035 C PHE A 70 -12.100 -2.812 0.374 1.00 0.00 C ATOM 1036 O PHE A 70 -12.781 -3.212 1.324 1.00 0.00 O ATOM 1037 CB PHE A 70 -10.747 -4.938 0.165 1.00 0.00 C ATOM 1038 CG PHE A 70 -9.479 -5.651 -0.299 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.330 -5.656 0.483 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -9.450 -6.337 -1.514 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.195 -6.318 0.065 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -8.313 -6.998 -1.926 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.185 -6.990 -1.137 1.00 0.00 C ATOM 0 H PHE A 70 -9.813 -3.459 2.004 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.339 -3.078 -0.864 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -10.962 -5.246 1.188 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -11.579 -5.277 -0.452 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.326 -5.135 1.429 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -10.330 -6.350 -2.140 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.310 -6.309 0.683 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -8.307 -7.523 -2.870 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.295 -7.509 -1.460 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.504 -1.850 -0.454 1.00 0.00 N ATOM 1054 CA ARG A 71 -13.775 -1.136 -0.281 1.00 0.00 C ATOM 1055 C ARG A 71 -14.923 -1.814 -1.030 1.00 0.00 C ATOM 1056 O ARG A 71 -14.794 -2.166 -2.209 1.00 0.00 O ATOM 1057 CB ARG A 71 -13.657 0.318 -0.789 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.575 1.168 -0.101 1.00 0.00 C ATOM 1059 CD ARG A 71 -12.874 2.663 -0.226 1.00 0.00 C ATOM 1060 NE ARG A 71 -12.727 3.171 -1.606 1.00 0.00 N ATOM 1061 CZ ARG A 71 -13.525 4.086 -2.190 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -14.618 4.540 -1.577 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -13.238 4.526 -3.402 1.00 0.00 N ATOM 0 H ARG A 71 -11.964 -1.542 -1.262 1.00 0.00 H new ATOM 0 HA ARG A 71 -13.993 -1.149 0.787 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.453 0.296 -1.859 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.621 0.811 -0.658 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.512 0.895 0.952 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -11.603 0.952 -0.545 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -13.890 2.854 0.119 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.205 3.217 0.432 1.00 0.00 H new ATOM 0 HE ARG A 71 -11.958 2.798 -2.162 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -14.863 4.195 -0.649 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -15.209 5.233 -2.036 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -12.416 4.173 -3.891 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -13.839 5.219 -3.849 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.037 -2.002 -0.304 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.296 -2.560 -0.842 1.00 0.00 C ATOM 1079 C VAL A 72 -18.501 -1.719 -0.377 1.00 0.00 C ATOM 1080 O VAL A 72 -18.389 -0.903 0.554 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.549 -4.058 -0.412 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.428 -5.012 -0.859 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -17.808 -4.186 1.105 1.00 0.00 C ATOM 0 H VAL A 72 -16.093 -1.769 0.687 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.191 -2.530 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.453 -4.366 -0.938 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -16.661 -6.026 -0.533 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.344 -4.991 -1.946 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.484 -4.697 -0.416 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -17.977 -5.233 1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.943 -3.815 1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.687 -3.601 1.375 1.00 0.00 H new ATOM 1093 N GLU A 73 -19.646 -1.940 -1.049 1.00 0.00 N ATOM 1094 CA GLU A 73 -20.884 -1.181 -0.824 1.00 0.00 C ATOM 1095 C GLU A 73 -21.549 -1.470 0.547 1.00 0.00 C ATOM 1096 O GLU A 73 -21.965 -0.526 1.233 1.00 0.00 O ATOM 1097 CB GLU A 73 -21.890 -1.439 -1.988 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.226 -2.921 -2.239 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.339 -3.145 -3.277 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -24.532 -3.158 -2.894 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -23.033 -3.323 -4.474 1.00 0.00 O ATOM 0 H GLU A 73 -19.736 -2.657 -1.769 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.604 -0.128 -0.805 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -22.815 -0.903 -1.775 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.480 -1.014 -2.904 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.325 -3.436 -2.572 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.525 -3.379 -1.296 1.00 0.00 H new ATOM 1108 N ASN A 74 -21.636 -2.759 0.972 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.371 -3.115 2.211 1.00 0.00 C ATOM 1110 C ASN A 74 -21.873 -4.430 2.838 1.00 0.00 C ATOM 1111 O ASN A 74 -20.990 -5.106 2.295 1.00 0.00 O ATOM 1112 CB ASN A 74 -23.902 -3.213 1.939 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.300 -4.448 1.126 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -24.557 -5.511 1.677 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.370 -4.317 -0.179 1.00 0.00 N ATOM 0 H ASN A 74 -21.216 -3.551 0.486 1.00 0.00 H new ATOM 0 HA ASN A 74 -22.177 -2.314 2.924 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.432 -3.228 2.891 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.227 -2.318 1.408 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -24.643 -5.111 -0.757 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.151 -3.421 -0.614 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.491 -4.764 3.992 1.00 0.00 N ATOM 1123 CA ASP A 75 -22.036 -5.815 4.929 1.00 0.00 C ATOM 1124 C ASP A 75 -21.962 -7.197 4.267 1.00 0.00 C ATOM 1125 O ASP A 75 -21.111 -8.027 4.619 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.968 -5.853 6.173 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.416 -6.260 5.841 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -25.198 -5.392 5.391 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.773 -7.449 6.003 1.00 0.00 O ATOM 0 H ASP A 75 -23.342 -4.298 4.306 1.00 0.00 H new ATOM 0 HA ASP A 75 -21.023 -5.561 5.241 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.560 -6.553 6.902 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.974 -4.870 6.644 1.00 0.00 H new ATOM 1134 N ALA A 76 -22.878 -7.430 3.313 1.00 0.00 N ATOM 1135 CA ALA A 76 -22.992 -8.709 2.616 1.00 0.00 C ATOM 1136 C ALA A 76 -21.789 -8.932 1.699 1.00 0.00 C ATOM 1137 O ALA A 76 -21.217 -10.013 1.684 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.302 -8.788 1.827 1.00 0.00 C ATOM 0 H ALA A 76 -23.557 -6.733 3.008 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.003 -9.503 3.363 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.362 -9.750 1.317 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.145 -8.686 2.510 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.332 -7.985 1.091 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.386 -7.861 0.980 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.225 -7.876 0.076 1.00 0.00 C ATOM 1146 C GLN A 77 -18.890 -8.103 0.822 1.00 0.00 C ATOM 1147 O GLN A 77 -17.926 -8.594 0.236 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.144 -6.541 -0.711 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.248 -6.307 -1.754 1.00 0.00 C ATOM 1150 CD GLN A 77 -21.147 -7.212 -2.987 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -20.057 -7.634 -3.383 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -22.273 -7.487 -3.626 1.00 0.00 N ATOM 0 H GLN A 77 -21.862 -6.960 1.014 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.372 -8.713 -0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.167 -5.719 0.004 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.179 -6.498 -1.216 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.218 -6.462 -1.281 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -21.213 -5.266 -2.077 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -23.160 -7.125 -3.276 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -22.254 -8.061 -4.469 1.00 0.00 H new ATOM 1161 N VAL A 78 -18.867 -7.757 2.128 1.00 0.00 N ATOM 1162 CA VAL A 78 -17.725 -8.049 3.023 1.00 0.00 C ATOM 1163 C VAL A 78 -17.644 -9.562 3.297 1.00 0.00 C ATOM 1164 O VAL A 78 -16.562 -10.152 3.323 1.00 0.00 O ATOM 1165 CB VAL A 78 -17.848 -7.292 4.402 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.663 -7.601 5.354 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -17.992 -5.776 4.202 1.00 0.00 C ATOM 0 H VAL A 78 -19.635 -7.270 2.590 1.00 0.00 H new ATOM 0 HA VAL A 78 -16.823 -7.703 2.517 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.756 -7.666 4.876 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.795 -7.056 6.289 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.631 -8.671 5.559 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.729 -7.294 4.884 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -18.074 -5.287 5.173 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -17.117 -5.394 3.676 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -18.887 -5.570 3.615 1.00 0.00 H new ATOM 1177 N ASP A 79 -18.836 -10.168 3.483 1.00 0.00 N ATOM 1178 CA ASP A 79 -18.995 -11.598 3.785 1.00 0.00 C ATOM 1179 C ASP A 79 -18.734 -12.464 2.536 1.00 0.00 C ATOM 1180 O ASP A 79 -18.282 -13.608 2.646 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.418 -11.853 4.346 1.00 0.00 C ATOM 1182 CG ASP A 79 -20.656 -13.322 4.727 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -20.292 -13.718 5.845 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.197 -14.087 3.893 1.00 0.00 O ATOM 0 H ASP A 79 -19.723 -9.668 3.426 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.259 -11.882 4.537 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.575 -11.225 5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.156 -11.552 3.602 1.00 0.00 H new ATOM 1189 N GLU A 80 -19.032 -11.903 1.353 1.00 0.00 N ATOM 1190 CA GLU A 80 -18.749 -12.560 0.061 1.00 0.00 C ATOM 1191 C GLU A 80 -17.235 -12.634 -0.143 1.00 0.00 C ATOM 1192 O GLU A 80 -16.683 -13.664 -0.555 1.00 0.00 O ATOM 1193 CB GLU A 80 -19.449 -11.814 -1.104 1.00 0.00 C ATOM 1194 CG GLU A 80 -20.971 -11.669 -0.899 1.00 0.00 C ATOM 1195 CD GLU A 80 -21.742 -11.243 -2.154 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -21.708 -11.990 -3.157 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -22.398 -10.176 -2.146 1.00 0.00 O ATOM 0 H GLU A 80 -19.473 -10.988 1.262 1.00 0.00 H new ATOM 0 HA GLU A 80 -19.150 -13.574 0.072 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -19.007 -10.824 -1.212 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -19.263 -12.349 -2.035 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.370 -12.621 -0.548 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -21.151 -10.938 -0.111 1.00 0.00 H new ATOM 1204 N THR A 81 -16.584 -11.509 0.192 1.00 0.00 N ATOM 1205 CA THR A 81 -15.128 -11.372 0.168 1.00 0.00 C ATOM 1206 C THR A 81 -14.481 -12.309 1.219 1.00 0.00 C ATOM 1207 O THR A 81 -13.454 -12.931 0.947 1.00 0.00 O ATOM 1208 CB THR A 81 -14.719 -9.880 0.416 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.325 -9.036 -0.580 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.203 -9.675 0.376 1.00 0.00 C ATOM 0 H THR A 81 -17.065 -10.660 0.490 1.00 0.00 H new ATOM 0 HA THR A 81 -14.762 -11.665 -0.816 1.00 0.00 H new ATOM 0 HB THR A 81 -15.070 -9.616 1.414 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.240 -8.814 -0.308 1.00 0.00 H new ATOM 0 HG21 THR A 81 -12.973 -8.624 0.554 1.00 0.00 H new ATOM 0 HG22 THR A 81 -12.733 -10.285 1.148 1.00 0.00 H new ATOM 0 HG23 THR A 81 -12.822 -9.970 -0.602 1.00 0.00 H new ATOM 1218 N PHE A 82 -15.143 -12.439 2.395 1.00 0.00 N ATOM 1219 CA PHE A 82 -14.704 -13.326 3.497 1.00 0.00 C ATOM 1220 C PHE A 82 -14.608 -14.776 2.987 1.00 0.00 C ATOM 1221 O PHE A 82 -13.533 -15.370 2.942 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.707 -13.208 4.695 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.391 -14.030 5.963 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -15.703 -15.394 6.045 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.806 -13.434 7.082 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.434 -16.123 7.189 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.537 -14.167 8.228 1.00 0.00 C ATOM 1228 CZ PHE A 82 -14.851 -15.509 8.279 1.00 0.00 C ATOM 0 H PHE A 82 -16.001 -11.928 2.605 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.717 -13.024 3.848 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.771 -12.158 4.980 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.694 -13.502 4.339 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -16.162 -15.885 5.199 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.559 -12.383 7.054 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -15.680 -17.174 7.230 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -14.081 -13.687 9.081 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.641 -16.079 9.172 1.00 0.00 H new ATOM 1238 N ALA A 83 -15.767 -15.281 2.539 1.00 0.00 N ATOM 1239 CA ALA A 83 -15.959 -16.687 2.151 1.00 0.00 C ATOM 1240 C ALA A 83 -15.048 -17.112 0.989 1.00 0.00 C ATOM 1241 O ALA A 83 -14.542 -18.238 0.979 1.00 0.00 O ATOM 1242 CB ALA A 83 -17.433 -16.927 1.793 1.00 0.00 C ATOM 0 H ALA A 83 -16.610 -14.716 2.434 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.680 -17.303 3.006 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.573 -17.969 1.506 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -18.059 -16.702 2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -17.715 -16.281 0.962 1.00 0.00 H new ATOM 1248 N GLY A 84 -14.864 -16.208 0.009 1.00 0.00 N ATOM 1249 CA GLY A 84 -14.022 -16.486 -1.155 1.00 0.00 C ATOM 1250 C GLY A 84 -12.530 -16.592 -0.828 1.00 0.00 C ATOM 1251 O GLY A 84 -11.834 -17.478 -1.344 1.00 0.00 O ATOM 0 H GLY A 84 -15.290 -15.281 0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -14.351 -17.418 -1.615 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -14.167 -15.697 -1.893 1.00 0.00 H new ATOM 1255 N TRP A 85 -12.055 -15.718 0.076 1.00 0.00 N ATOM 1256 CA TRP A 85 -10.661 -15.739 0.575 1.00 0.00 C ATOM 1257 C TRP A 85 -10.435 -16.999 1.421 1.00 0.00 C ATOM 1258 O TRP A 85 -9.384 -17.643 1.314 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.387 -14.455 1.383 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.356 -13.194 0.546 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -10.771 -13.031 -0.755 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -9.892 -11.909 0.968 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -10.573 -11.741 -1.156 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -10.037 -11.032 -0.120 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.367 -11.423 2.160 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.665 -9.703 -0.052 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -9.004 -10.099 2.226 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.158 -9.252 1.128 1.00 0.00 C ATOM 0 H TRP A 85 -12.623 -14.976 0.484 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.963 -15.768 -0.262 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -11.154 -14.350 2.150 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.433 -14.560 1.899 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -11.193 -13.811 -1.371 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -10.790 -11.368 -2.080 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.247 -12.071 3.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -9.772 -9.047 -0.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.592 -9.707 3.144 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -8.868 -8.215 1.216 1.00 0.00 H new ATOM 1279 N LYS A 86 -11.422 -17.322 2.267 1.00 0.00 N ATOM 1280 CA LYS A 86 -11.412 -18.528 3.118 1.00 0.00 C ATOM 1281 C LYS A 86 -11.273 -19.792 2.254 1.00 0.00 C ATOM 1282 O LYS A 86 -10.483 -20.691 2.560 1.00 0.00 O ATOM 1283 CB LYS A 86 -12.714 -18.563 3.953 1.00 0.00 C ATOM 1284 CG LYS A 86 -12.969 -19.855 4.756 1.00 0.00 C ATOM 1285 CD LYS A 86 -14.256 -19.772 5.614 1.00 0.00 C ATOM 1286 CE LYS A 86 -15.489 -19.310 4.815 1.00 0.00 C ATOM 1287 NZ LYS A 86 -16.731 -19.402 5.606 1.00 0.00 N ATOM 0 H LYS A 86 -12.259 -16.751 2.384 1.00 0.00 H new ATOM 0 HA LYS A 86 -10.557 -18.497 3.793 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.698 -17.724 4.649 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.557 -18.404 3.281 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -13.047 -20.697 4.069 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -12.115 -20.051 5.404 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -14.459 -20.751 6.049 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -14.089 -19.083 6.442 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -15.343 -18.280 4.488 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -15.587 -19.919 3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -17.535 -19.081 5.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -16.885 -20.389 5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -16.650 -18.801 6.451 1.00 0.00 H new ATOM 1301 N ALA A 87 -12.038 -19.809 1.154 1.00 0.00 N ATOM 1302 CA ALA A 87 -12.045 -20.911 0.181 1.00 0.00 C ATOM 1303 C ALA A 87 -10.694 -21.034 -0.550 1.00 0.00 C ATOM 1304 O ALA A 87 -10.275 -22.128 -0.931 1.00 0.00 O ATOM 1305 CB ALA A 87 -13.196 -20.719 -0.821 1.00 0.00 C ATOM 0 H ALA A 87 -12.676 -19.051 0.912 1.00 0.00 H new ATOM 0 HA ALA A 87 -12.201 -21.843 0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.194 -21.539 -1.539 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -14.146 -20.706 -0.286 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.065 -19.775 -1.349 1.00 0.00 H new ATOM 1311 N SER A 88 -10.017 -19.881 -0.714 1.00 0.00 N ATOM 1312 CA SER A 88 -8.740 -19.768 -1.446 1.00 0.00 C ATOM 1313 C SER A 88 -7.522 -19.668 -0.485 1.00 0.00 C ATOM 1314 O SER A 88 -6.410 -19.305 -0.891 1.00 0.00 O ATOM 1315 CB SER A 88 -8.800 -18.521 -2.365 1.00 0.00 C ATOM 1316 OG SER A 88 -9.906 -18.579 -3.260 1.00 0.00 O ATOM 0 H SER A 88 -10.345 -18.992 -0.338 1.00 0.00 H new ATOM 0 HA SER A 88 -8.603 -20.671 -2.040 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.873 -17.622 -1.754 1.00 0.00 H new ATOM 0 HB3 SER A 88 -7.874 -18.444 -2.935 1.00 0.00 H new ATOM 0 HG SER A 88 -10.709 -18.243 -2.810 1.00 0.00 H new ATOM 1322 N GLY A 89 -7.769 -20.008 0.798 1.00 0.00 N ATOM 1323 CA GLY A 89 -6.707 -20.319 1.761 1.00 0.00 C ATOM 1324 C GLY A 89 -6.094 -19.118 2.463 1.00 0.00 C ATOM 1325 O GLY A 89 -4.872 -19.023 2.563 1.00 0.00 O ATOM 0 H GLY A 89 -8.709 -20.073 1.188 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.110 -20.994 2.516 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.915 -20.859 1.242 1.00 0.00 H new ATOM 1329 N VAL A 90 -6.933 -18.203 2.954 1.00 0.00 N ATOM 1330 CA VAL A 90 -6.487 -17.052 3.775 1.00 0.00 C ATOM 1331 C VAL A 90 -6.770 -17.335 5.269 1.00 0.00 C ATOM 1332 O VAL A 90 -7.879 -17.753 5.610 1.00 0.00 O ATOM 1333 CB VAL A 90 -7.195 -15.728 3.304 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -6.846 -14.527 4.211 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -6.837 -15.414 1.826 1.00 0.00 C ATOM 0 H VAL A 90 -7.941 -18.230 2.800 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.413 -16.916 3.645 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.270 -15.892 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.357 -13.636 3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -7.165 -14.737 5.232 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.769 -14.360 4.195 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -7.336 -14.495 1.518 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.758 -15.291 1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -7.165 -16.236 1.190 1.00 0.00 H new ATOM 1345 N ALA A 91 -5.757 -17.095 6.137 1.00 0.00 N ATOM 1346 CA ALA A 91 -5.822 -17.397 7.595 1.00 0.00 C ATOM 1347 C ALA A 91 -6.942 -16.596 8.295 1.00 0.00 C ATOM 1348 O ALA A 91 -7.635 -17.135 9.166 1.00 0.00 O ATOM 1349 CB ALA A 91 -4.463 -17.114 8.264 1.00 0.00 C ATOM 0 H ALA A 91 -4.868 -16.686 5.849 1.00 0.00 H new ATOM 0 HA ALA A 91 -6.057 -18.456 7.701 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -4.527 -17.340 9.328 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.695 -17.738 7.807 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -4.204 -16.064 8.131 1.00 0.00 H new ATOM 1355 N MET A 92 -7.078 -15.308 7.893 1.00 0.00 N ATOM 1356 CA MET A 92 -8.180 -14.390 8.288 1.00 0.00 C ATOM 1357 C MET A 92 -8.428 -14.332 9.822 1.00 0.00 C ATOM 1358 O MET A 92 -9.292 -15.029 10.377 1.00 0.00 O ATOM 1359 CB MET A 92 -9.477 -14.674 7.457 1.00 0.00 C ATOM 1360 CG MET A 92 -10.229 -15.999 7.742 1.00 0.00 C ATOM 1361 SD MET A 92 -10.986 -16.734 6.283 1.00 0.00 S ATOM 1362 CE MET A 92 -11.912 -15.362 5.619 1.00 0.00 C ATOM 0 H MET A 92 -6.406 -14.865 7.267 1.00 0.00 H new ATOM 0 HA MET A 92 -7.853 -13.381 8.036 1.00 0.00 H new ATOM 0 HB2 MET A 92 -10.171 -13.850 7.623 1.00 0.00 H new ATOM 0 HB3 MET A 92 -9.211 -14.658 6.400 1.00 0.00 H new ATOM 0 HG2 MET A 92 -9.532 -16.715 8.178 1.00 0.00 H new ATOM 0 HG3 MET A 92 -11.003 -15.814 8.487 1.00 0.00 H new ATOM 0 HE1 MET A 92 -12.883 -15.713 5.271 1.00 0.00 H new ATOM 0 HE2 MET A 92 -12.055 -14.610 6.395 1.00 0.00 H new ATOM 0 HE3 MET A 92 -11.365 -14.923 4.785 1.00 0.00 H new ATOM 1372 N LEU A 93 -7.614 -13.528 10.525 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.701 -13.388 11.991 1.00 0.00 C ATOM 1374 C LEU A 93 -8.321 -12.022 12.354 1.00 0.00 C ATOM 1375 O LEU A 93 -7.616 -11.054 12.637 1.00 0.00 O ATOM 1376 CB LEU A 93 -6.307 -13.647 12.701 1.00 0.00 C ATOM 1377 CG LEU A 93 -4.971 -13.319 11.931 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -4.688 -14.326 10.798 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -4.930 -11.864 11.409 1.00 0.00 C ATOM 0 H LEU A 93 -6.882 -12.960 10.099 1.00 0.00 H new ATOM 0 HA LEU A 93 -8.364 -14.163 12.375 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.300 -13.072 13.627 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.273 -14.700 12.980 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.171 -13.419 12.664 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.758 -14.058 10.297 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.599 -15.329 11.216 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.507 -14.304 10.079 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.989 -11.691 10.887 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.761 -11.700 10.723 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.011 -11.174 12.249 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.661 -12.001 12.335 1.00 0.00 N ATOM 1392 CA GLN A 94 -10.506 -10.862 12.740 1.00 0.00 C ATOM 1393 C GLN A 94 -11.965 -11.246 12.498 1.00 0.00 C ATOM 1394 O GLN A 94 -12.293 -11.809 11.442 1.00 0.00 O ATOM 1395 CB GLN A 94 -10.168 -9.535 11.977 1.00 0.00 C ATOM 1396 CG GLN A 94 -11.134 -8.335 12.202 1.00 0.00 C ATOM 1397 CD GLN A 94 -11.220 -7.804 13.645 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -11.057 -8.534 14.621 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -11.508 -6.522 13.785 1.00 0.00 N ATOM 0 H GLN A 94 -10.209 -12.804 12.027 1.00 0.00 H new ATOM 0 HA GLN A 94 -10.315 -10.659 13.794 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -9.164 -9.223 12.265 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.140 -9.754 10.910 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.824 -7.517 11.552 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.133 -8.633 11.885 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.639 -5.936 12.961 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.599 -6.119 14.717 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.829 -10.960 13.478 1.00 0.00 N ATOM 1409 CA GLN A 95 -14.273 -11.151 13.335 1.00 0.00 C ATOM 1410 C GLN A 95 -14.845 -9.966 12.531 1.00 0.00 C ATOM 1411 O GLN A 95 -14.645 -8.812 12.937 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.956 -11.253 14.721 1.00 0.00 C ATOM 1413 CG GLN A 95 -14.327 -12.297 15.667 1.00 0.00 C ATOM 1414 CD GLN A 95 -15.052 -12.390 17.009 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.726 -11.666 17.947 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -16.029 -13.281 17.116 1.00 0.00 N ATOM 0 H GLN A 95 -12.548 -10.592 14.387 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.469 -12.084 12.807 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.920 -10.276 15.203 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -16.008 -11.499 14.577 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.340 -13.274 15.183 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.282 -12.041 15.840 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -16.275 -13.867 16.318 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -16.534 -13.380 17.996 1.00 0.00 H new ATOM 1425 N PRO A 96 -15.497 -10.216 11.350 1.00 0.00 N ATOM 1426 CA PRO A 96 -16.220 -9.168 10.602 1.00 0.00 C ATOM 1427 C PRO A 96 -17.327 -8.548 11.480 1.00 0.00 C ATOM 1428 O PRO A 96 -18.336 -9.196 11.768 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.792 -9.905 9.352 1.00 0.00 C ATOM 1430 CG PRO A 96 -16.711 -11.362 9.688 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.545 -11.517 10.640 1.00 0.00 C ATOM 0 HA PRO A 96 -15.584 -8.333 10.309 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.820 -9.603 9.152 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.212 -9.674 8.458 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -17.637 -11.706 10.149 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -16.561 -11.960 8.789 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -15.700 -12.345 11.331 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.616 -11.717 10.106 1.00 0.00 H new ATOM 1439 N ALA A 97 -17.091 -7.319 11.946 1.00 0.00 N ATOM 1440 CA ALA A 97 -17.993 -6.620 12.870 1.00 0.00 C ATOM 1441 C ALA A 97 -18.100 -5.144 12.488 1.00 0.00 C ATOM 1442 O ALA A 97 -17.184 -4.579 11.876 1.00 0.00 O ATOM 1443 CB ALA A 97 -17.497 -6.781 14.319 1.00 0.00 C ATOM 0 H ALA A 97 -16.265 -6.777 11.693 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.987 -7.062 12.799 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -18.174 -6.259 14.995 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -17.470 -7.839 14.579 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -16.496 -6.359 14.410 1.00 0.00 H new ATOM 1449 N LYS A 98 -19.248 -4.540 12.825 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.484 -3.103 12.665 1.00 0.00 C ATOM 1451 C LYS A 98 -18.503 -2.297 13.533 1.00 0.00 C ATOM 1452 O LYS A 98 -18.243 -2.653 14.690 1.00 0.00 O ATOM 1453 CB LYS A 98 -20.964 -2.745 13.021 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.977 -2.824 11.861 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.591 -1.936 10.655 1.00 0.00 C ATOM 1456 CE LYS A 98 -21.565 -0.440 11.001 1.00 0.00 C ATOM 1457 NZ LYS A 98 -22.912 0.073 11.360 1.00 0.00 N ATOM 0 H LYS A 98 -20.044 -5.041 13.219 1.00 0.00 H new ATOM 0 HA LYS A 98 -19.313 -2.839 11.621 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -21.298 -3.414 13.815 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -20.985 -1.734 13.427 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -22.061 -3.859 11.530 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.960 -2.525 12.224 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -20.610 -2.236 10.288 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -22.300 -2.104 9.844 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -20.880 -0.272 11.832 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -21.178 0.122 10.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -22.868 1.104 11.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -23.584 -0.154 10.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -23.228 -0.372 12.245 1.00 0.00 H new ATOM 1471 N MET A 99 -17.974 -1.217 12.952 1.00 0.00 N ATOM 1472 CA MET A 99 -16.947 -0.379 13.579 1.00 0.00 C ATOM 1473 C MET A 99 -17.204 1.099 13.222 1.00 0.00 C ATOM 1474 O MET A 99 -18.114 1.407 12.441 1.00 0.00 O ATOM 1475 CB MET A 99 -15.538 -0.859 13.098 1.00 0.00 C ATOM 1476 CG MET A 99 -14.353 -0.382 13.948 1.00 0.00 C ATOM 1477 SD MET A 99 -12.766 -1.004 13.353 1.00 0.00 S ATOM 1478 CE MET A 99 -11.650 -0.429 14.633 1.00 0.00 C ATOM 0 H MET A 99 -18.249 -0.896 12.024 1.00 0.00 H new ATOM 0 HA MET A 99 -16.985 -0.469 14.665 1.00 0.00 H new ATOM 0 HB2 MET A 99 -15.532 -1.949 13.077 1.00 0.00 H new ATOM 0 HB3 MET A 99 -15.388 -0.519 12.073 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.332 0.708 13.953 1.00 0.00 H new ATOM 0 HG3 MET A 99 -14.500 -0.703 14.979 1.00 0.00 H new ATOM 0 HE1 MET A 99 -10.769 -1.070 14.663 1.00 0.00 H new ATOM 0 HE2 MET A 99 -11.346 0.595 14.417 1.00 0.00 H new ATOM 0 HE3 MET A 99 -12.156 -0.462 15.598 1.00 0.00 H new ATOM 1488 N GLU A 100 -16.387 1.992 13.804 1.00 0.00 N ATOM 1489 CA GLU A 100 -16.404 3.449 13.568 1.00 0.00 C ATOM 1490 C GLU A 100 -16.353 3.818 12.061 1.00 0.00 C ATOM 1491 O GLU A 100 -16.926 4.825 11.638 1.00 0.00 O ATOM 1492 CB GLU A 100 -15.178 4.066 14.301 1.00 0.00 C ATOM 1493 CG GLU A 100 -15.126 5.607 14.325 1.00 0.00 C ATOM 1494 CD GLU A 100 -16.282 6.245 15.111 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -16.255 6.194 16.356 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -17.216 6.793 14.497 1.00 0.00 O ATOM 0 H GLU A 100 -15.671 1.712 14.475 1.00 0.00 H new ATOM 0 HA GLU A 100 -17.343 3.847 13.952 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.171 3.703 15.329 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -14.269 3.696 13.826 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.180 5.924 14.763 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -15.144 5.980 13.301 1.00 0.00 H new ATOM 1503 N PHE A 101 -15.661 2.981 11.267 1.00 0.00 N ATOM 1504 CA PHE A 101 -15.407 3.235 9.824 1.00 0.00 C ATOM 1505 C PHE A 101 -16.326 2.375 8.931 1.00 0.00 C ATOM 1506 O PHE A 101 -16.321 2.512 7.700 1.00 0.00 O ATOM 1507 CB PHE A 101 -13.901 2.972 9.529 1.00 0.00 C ATOM 1508 CG PHE A 101 -12.996 3.591 10.603 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -12.922 4.974 10.761 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -12.280 2.789 11.495 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -12.154 5.533 11.762 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -11.516 3.351 12.500 1.00 0.00 C ATOM 1513 CZ PHE A 101 -11.451 4.720 12.632 1.00 0.00 C ATOM 0 H PHE A 101 -15.258 2.106 11.602 1.00 0.00 H new ATOM 0 HA PHE A 101 -15.640 4.274 9.590 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -13.722 1.898 9.477 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -13.644 3.385 8.554 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.473 5.617 10.091 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.324 1.714 11.398 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.102 6.607 11.866 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -10.970 2.716 13.182 1.00 0.00 H new ATOM 0 HZ PHE A 101 -10.851 5.159 13.415 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.102 1.484 9.573 1.00 0.00 N ATOM 1524 CA GLY A 102 -18.084 0.635 8.892 1.00 0.00 C ATOM 1525 C GLY A 102 -17.907 -0.835 9.239 1.00 0.00 C ATOM 1526 O GLY A 102 -17.183 -1.167 10.183 1.00 0.00 O ATOM 0 H GLY A 102 -17.062 1.335 10.581 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.090 0.953 9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -17.991 0.766 7.814 1.00 0.00 H new ATOM 1530 N TYR A 103 -18.581 -1.723 8.475 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.528 -3.177 8.723 1.00 0.00 C ATOM 1532 C TYR A 103 -17.196 -3.714 8.206 1.00 0.00 C ATOM 1533 O TYR A 103 -17.038 -3.922 7.003 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.717 -3.899 8.033 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.964 -5.307 8.579 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -20.537 -5.457 9.830 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.624 -6.464 7.874 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.779 -6.685 10.372 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.864 -7.716 8.409 1.00 0.00 C ATOM 1540 CZ TYR A 103 -20.442 -7.825 9.661 1.00 0.00 C ATOM 1541 OH TYR A 103 -20.676 -9.073 10.203 1.00 0.00 O ATOM 0 H TYR A 103 -19.166 -1.457 7.683 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.608 -3.366 9.793 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.620 -3.303 8.161 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.525 -3.960 6.962 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -20.801 -4.575 10.394 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.168 -6.379 6.899 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -21.231 -6.768 11.350 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.602 -8.604 7.853 1.00 0.00 H new ATOM 0 HH TYR A 103 -19.940 -9.311 10.805 1.00 0.00 H new ATOM 1551 N THR A 104 -16.241 -3.954 9.108 1.00 0.00 N ATOM 1552 CA THR A 104 -14.850 -4.215 8.727 1.00 0.00 C ATOM 1553 C THR A 104 -14.423 -5.635 9.111 1.00 0.00 C ATOM 1554 O THR A 104 -14.903 -6.214 10.090 1.00 0.00 O ATOM 1555 CB THR A 104 -13.887 -3.153 9.357 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.544 -3.368 8.909 1.00 0.00 O ATOM 1557 CG2 THR A 104 -13.913 -3.164 10.888 1.00 0.00 C ATOM 0 H THR A 104 -16.407 -3.973 10.114 1.00 0.00 H new ATOM 0 HA THR A 104 -14.784 -4.131 7.642 1.00 0.00 H new ATOM 0 HB THR A 104 -14.244 -2.178 9.025 1.00 0.00 H new ATOM 0 HG1 THR A 104 -12.557 -3.737 8.001 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.227 -2.408 11.269 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.923 -2.946 11.236 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.608 -4.146 11.250 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.516 -6.163 8.297 1.00 0.00 N ATOM 1566 CA PHE A 105 -12.927 -7.484 8.437 1.00 0.00 C ATOM 1567 C PHE A 105 -11.474 -7.427 7.941 1.00 0.00 C ATOM 1568 O PHE A 105 -11.229 -6.947 6.839 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.776 -8.520 7.624 1.00 0.00 C ATOM 1570 CG PHE A 105 -13.014 -9.747 7.121 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.443 -10.660 8.010 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -12.838 -9.957 5.749 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.728 -11.737 7.541 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.118 -11.030 5.285 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.565 -11.920 6.177 1.00 0.00 C ATOM 0 H PHE A 105 -13.157 -5.658 7.487 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.925 -7.801 9.480 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.601 -8.858 8.251 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.215 -8.010 6.766 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.564 -10.519 9.074 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.275 -9.265 5.044 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.293 -12.440 8.236 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -11.986 -11.175 4.223 1.00 0.00 H new ATOM 0 HZ PHE A 105 -11.001 -12.766 5.812 1.00 0.00 H new ATOM 1585 N THR A 106 -10.528 -7.917 8.737 1.00 0.00 N ATOM 1586 CA THR A 106 -9.095 -7.809 8.421 1.00 0.00 C ATOM 1587 C THR A 106 -8.479 -9.212 8.328 1.00 0.00 C ATOM 1588 O THR A 106 -8.500 -9.979 9.293 1.00 0.00 O ATOM 1589 CB THR A 106 -8.360 -6.953 9.492 1.00 0.00 C ATOM 1590 OG1 THR A 106 -9.097 -5.738 9.719 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.905 -6.611 9.086 1.00 0.00 C ATOM 0 H THR A 106 -10.724 -8.398 9.615 1.00 0.00 H new ATOM 0 HA THR A 106 -8.981 -7.310 7.459 1.00 0.00 H new ATOM 0 HB THR A 106 -8.308 -7.546 10.405 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.906 -5.403 10.620 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.440 -6.013 9.869 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.339 -7.533 8.949 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.911 -6.047 8.153 1.00 0.00 H new ATOM 1599 N ALA A 107 -7.948 -9.535 7.150 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.409 -10.857 6.836 1.00 0.00 C ATOM 1601 C ALA A 107 -5.876 -10.861 6.765 1.00 0.00 C ATOM 1602 O ALA A 107 -5.243 -9.815 6.569 1.00 0.00 O ATOM 1603 CB ALA A 107 -8.004 -11.326 5.506 1.00 0.00 C ATOM 0 H ALA A 107 -7.879 -8.875 6.375 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.686 -11.540 7.639 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.610 -12.312 5.259 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.089 -11.380 5.592 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.737 -10.621 4.719 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.301 -12.059 6.920 1.00 0.00 N ATOM 1610 CA ALA A 108 -3.878 -12.332 6.689 1.00 0.00 C ATOM 1611 C ALA A 108 -3.785 -13.704 6.024 1.00 0.00 C ATOM 1612 O ALA A 108 -4.412 -14.641 6.498 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.091 -12.315 8.008 1.00 0.00 C ATOM 0 H ALA A 108 -5.823 -12.884 7.216 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.443 -11.562 6.051 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.040 -12.520 7.807 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.186 -11.335 8.476 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.488 -13.077 8.678 1.00 0.00 H new ATOM 1619 N ASP A 109 -3.094 -13.799 4.894 1.00 0.00 N ATOM 1620 CA ASP A 109 -2.908 -15.076 4.164 1.00 0.00 C ATOM 1621 C ASP A 109 -1.675 -15.858 4.747 1.00 0.00 C ATOM 1622 O ASP A 109 -1.047 -15.358 5.693 1.00 0.00 O ATOM 1623 CB ASP A 109 -2.761 -14.733 2.645 1.00 0.00 C ATOM 1624 CG ASP A 109 -1.357 -14.268 2.255 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -0.756 -13.473 3.005 1.00 0.00 O ATOM 1626 OD2 ASP A 109 -0.850 -14.691 1.204 1.00 0.00 O ATOM 0 H ASP A 109 -2.642 -13.001 4.447 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.764 -15.739 4.287 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.020 -15.613 2.056 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.478 -13.954 2.386 1.00 0.00 H new ATOM 1631 N PRO A 110 -1.318 -17.101 4.234 1.00 0.00 N ATOM 1632 CA PRO A 110 -0.097 -17.842 4.683 1.00 0.00 C ATOM 1633 C PRO A 110 1.213 -17.042 4.507 1.00 0.00 C ATOM 1634 O PRO A 110 2.143 -17.168 5.316 1.00 0.00 O ATOM 1635 CB PRO A 110 -0.087 -19.116 3.791 1.00 0.00 C ATOM 1636 CG PRO A 110 -1.515 -19.311 3.396 1.00 0.00 C ATOM 1637 CD PRO A 110 -2.081 -17.917 3.245 1.00 0.00 C ATOM 0 HA PRO A 110 -0.139 -18.052 5.752 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.551 -18.983 2.917 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.295 -19.979 4.337 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -1.592 -19.870 2.463 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.059 -19.876 4.153 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -1.947 -17.541 2.231 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.151 -17.897 3.453 1.00 0.00 H new ATOM 1645 N ASP A 111 1.273 -16.199 3.456 1.00 0.00 N ATOM 1646 CA ASP A 111 2.485 -15.409 3.129 1.00 0.00 C ATOM 1647 C ASP A 111 2.634 -14.196 4.077 1.00 0.00 C ATOM 1648 O ASP A 111 3.628 -13.458 4.004 1.00 0.00 O ATOM 1649 CB ASP A 111 2.464 -14.961 1.641 1.00 0.00 C ATOM 1650 CG ASP A 111 3.865 -14.663 1.079 1.00 0.00 C ATOM 1651 OD1 ASP A 111 4.651 -15.613 0.869 1.00 0.00 O ATOM 1652 OD2 ASP A 111 4.197 -13.491 0.880 1.00 0.00 O ATOM 0 H ASP A 111 0.495 -16.045 2.815 1.00 0.00 H new ATOM 0 HA ASP A 111 3.355 -16.049 3.276 1.00 0.00 H new ATOM 0 HB2 ASP A 111 1.997 -15.741 1.040 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.844 -14.070 1.545 1.00 0.00 H new ATOM 1657 N SER A 112 1.613 -14.004 4.946 1.00 0.00 N ATOM 1658 CA SER A 112 1.616 -13.040 6.052 1.00 0.00 C ATOM 1659 C SER A 112 1.490 -11.600 5.528 1.00 0.00 C ATOM 1660 O SER A 112 2.380 -10.755 5.715 1.00 0.00 O ATOM 1661 CB SER A 112 2.845 -13.240 6.978 1.00 0.00 C ATOM 1662 OG SER A 112 2.860 -14.547 7.533 1.00 0.00 O ATOM 0 H SER A 112 0.744 -14.535 4.888 1.00 0.00 H new ATOM 0 HA SER A 112 0.738 -13.227 6.670 1.00 0.00 H new ATOM 0 HB2 SER A 112 3.761 -13.071 6.413 1.00 0.00 H new ATOM 0 HB3 SER A 112 2.824 -12.502 7.779 1.00 0.00 H new ATOM 0 HG SER A 112 3.645 -14.648 8.111 1.00 0.00 H new ATOM 1668 N HIS A 113 0.373 -11.353 4.829 1.00 0.00 N ATOM 1669 CA HIS A 113 0.002 -10.016 4.336 1.00 0.00 C ATOM 1670 C HIS A 113 -1.001 -9.374 5.318 1.00 0.00 C ATOM 1671 O HIS A 113 -1.190 -9.860 6.441 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.598 -10.102 2.898 1.00 0.00 C ATOM 1673 CG HIS A 113 0.251 -10.821 1.877 1.00 0.00 C ATOM 1674 ND1 HIS A 113 -0.292 -11.476 0.790 1.00 0.00 N ATOM 1675 CD2 HIS A 113 1.586 -11.036 1.800 1.00 0.00 C ATOM 1676 CE1 HIS A 113 0.664 -12.051 0.103 1.00 0.00 C ATOM 1677 NE2 HIS A 113 1.806 -11.799 0.691 1.00 0.00 N ATOM 0 H HIS A 113 -0.303 -12.078 4.588 1.00 0.00 H new ATOM 0 HA HIS A 113 0.894 -9.392 4.280 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.565 -10.602 2.957 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -0.784 -9.089 2.541 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.335 -10.672 2.487 1.00 0.00 H new ATOM 0 HE1 HIS A 113 0.532 -12.634 -0.796 1.00 0.00 H new ATOM 0 HE2 HIS A 113 2.718 -12.123 0.370 1.00 0.00 H new ATOM 1686 N ARG A 114 -1.636 -8.278 4.879 1.00 0.00 N ATOM 1687 CA ARG A 114 -2.538 -7.460 5.706 1.00 0.00 C ATOM 1688 C ARG A 114 -3.570 -6.807 4.779 1.00 0.00 C ATOM 1689 O ARG A 114 -3.317 -5.766 4.155 1.00 0.00 O ATOM 1690 CB ARG A 114 -1.693 -6.432 6.521 1.00 0.00 C ATOM 1691 CG ARG A 114 -0.423 -5.963 5.768 1.00 0.00 C ATOM 1692 CD ARG A 114 0.730 -5.545 6.689 1.00 0.00 C ATOM 1693 NE ARG A 114 2.028 -5.653 6.002 1.00 0.00 N ATOM 1694 CZ ARG A 114 2.406 -4.950 4.931 1.00 0.00 C ATOM 1695 NH1 ARG A 114 1.703 -3.899 4.491 1.00 0.00 N ATOM 1696 NH2 ARG A 114 3.528 -5.290 4.322 1.00 0.00 N ATOM 0 H ARG A 114 -1.537 -7.929 3.926 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.083 -8.059 6.436 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.311 -5.565 6.755 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -1.401 -6.881 7.470 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -0.081 -6.768 5.117 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -0.684 -5.122 5.125 1.00 0.00 H new ATOM 0 HD2 ARG A 114 0.577 -4.519 7.024 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.734 -6.174 7.579 1.00 0.00 H new ATOM 0 HE ARG A 114 2.698 -6.324 6.377 1.00 0.00 H new ATOM 0 HH11 ARG A 114 0.852 -3.615 4.977 1.00 0.00 H new ATOM 0 HH12 ARG A 114 2.018 -3.382 3.670 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.082 -6.072 4.672 1.00 0.00 H new ATOM 0 HH22 ARG A 114 3.841 -4.771 3.502 1.00 0.00 H new ATOM 1710 N LEU A 115 -4.713 -7.489 4.652 1.00 0.00 N ATOM 1711 CA LEU A 115 -5.761 -7.170 3.677 1.00 0.00 C ATOM 1712 C LEU A 115 -7.042 -6.777 4.435 1.00 0.00 C ATOM 1713 O LEU A 115 -7.760 -7.642 4.935 1.00 0.00 O ATOM 1714 CB LEU A 115 -5.999 -8.422 2.786 1.00 0.00 C ATOM 1715 CG LEU A 115 -4.735 -9.029 2.093 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -5.078 -10.317 1.317 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -4.046 -7.989 1.183 1.00 0.00 C ATOM 0 H LEU A 115 -4.940 -8.294 5.236 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.467 -6.335 3.041 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.458 -9.197 3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.721 -8.159 2.012 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.029 -9.303 2.877 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.176 -10.711 0.849 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.483 -11.059 2.005 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.818 -10.093 0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.171 -8.439 0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.743 -7.662 0.411 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -3.737 -7.131 1.780 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.319 -5.467 4.515 1.00 0.00 N ATOM 1730 CA ARG A 116 -8.375 -4.921 5.388 1.00 0.00 C ATOM 1731 C ARG A 116 -9.637 -4.552 4.578 1.00 0.00 C ATOM 1732 O ARG A 116 -9.715 -3.489 3.993 1.00 0.00 O ATOM 1733 CB ARG A 116 -7.794 -3.702 6.181 1.00 0.00 C ATOM 1734 CG ARG A 116 -8.421 -3.478 7.579 1.00 0.00 C ATOM 1735 CD ARG A 116 -9.778 -2.775 7.561 1.00 0.00 C ATOM 1736 NE ARG A 116 -9.668 -1.356 7.175 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.677 -0.478 7.200 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -11.859 -0.828 7.680 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -10.484 0.768 6.806 1.00 0.00 N ATOM 0 H ARG A 116 -6.821 -4.756 3.979 1.00 0.00 H new ATOM 0 HA ARG A 116 -8.691 -5.680 6.103 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.719 -3.842 6.299 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -7.935 -2.799 5.586 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -8.533 -4.444 8.072 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -7.730 -2.890 8.183 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -10.441 -3.288 6.865 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -10.235 -2.846 8.548 1.00 0.00 H new ATOM 0 HE ARG A 116 -8.756 -1.019 6.866 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -12.006 -1.773 8.034 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -12.623 -0.153 7.696 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -9.563 1.063 6.481 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -11.256 1.435 6.826 1.00 0.00 H new ATOM 1753 N VAL A 117 -10.632 -5.432 4.591 1.00 0.00 N ATOM 1754 CA VAL A 117 -11.924 -5.215 3.901 1.00 0.00 C ATOM 1755 C VAL A 117 -12.840 -4.366 4.797 1.00 0.00 C ATOM 1756 O VAL A 117 -12.812 -4.533 6.015 1.00 0.00 O ATOM 1757 CB VAL A 117 -12.638 -6.587 3.585 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -13.867 -6.408 2.650 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -11.635 -7.604 3.004 1.00 0.00 C ATOM 0 H VAL A 117 -10.577 -6.325 5.080 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.729 -4.701 2.960 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.016 -6.981 4.528 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.325 -7.379 2.461 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.594 -5.750 3.127 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.545 -5.969 1.706 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.149 -8.542 2.794 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.209 -7.209 2.082 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.837 -7.781 3.725 1.00 0.00 H new ATOM 1769 N TYR A 118 -13.609 -3.416 4.222 1.00 0.00 N ATOM 1770 CA TYR A 118 -14.702 -2.755 4.970 1.00 0.00 C ATOM 1771 C TYR A 118 -15.920 -2.454 4.090 1.00 0.00 C ATOM 1772 O TYR A 118 -15.807 -2.385 2.859 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.237 -1.498 5.757 1.00 0.00 C ATOM 1774 CG TYR A 118 -14.033 -0.206 4.955 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -12.882 0.002 4.205 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.990 0.822 4.986 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.685 1.184 3.528 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.799 2.001 4.298 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.646 2.181 3.569 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.438 3.371 2.896 1.00 0.00 O ATOM 0 H TYR A 118 -13.497 -3.094 3.261 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.018 -3.483 5.717 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -14.970 -1.298 6.539 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.298 -1.739 6.255 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.132 -0.774 4.153 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.894 0.686 5.561 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -11.777 1.335 2.962 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -15.549 2.778 4.331 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.476 3.532 2.805 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.058 -2.220 4.744 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.275 -1.686 4.127 1.00 0.00 C ATOM 1792 C ALA A 119 -18.482 -0.275 4.656 1.00 0.00 C ATOM 1793 O ALA A 119 -18.424 -0.077 5.872 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.485 -2.551 4.488 1.00 0.00 C ATOM 0 H ALA A 119 -17.163 -2.401 5.742 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.171 -1.684 3.042 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.379 -2.139 4.021 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.325 -3.568 4.130 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.614 -2.563 5.570 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.702 0.698 3.763 1.00 0.00 N ATOM 1801 CA PHE A 120 -18.817 2.112 4.150 1.00 0.00 C ATOM 1802 C PHE A 120 -20.095 2.339 4.974 1.00 0.00 C ATOM 1803 O PHE A 120 -21.188 1.971 4.520 1.00 0.00 O ATOM 1804 CB PHE A 120 -18.823 3.021 2.890 1.00 0.00 C ATOM 1805 CG PHE A 120 -19.004 4.520 3.185 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -17.916 5.311 3.557 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -20.261 5.129 3.106 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -18.079 6.654 3.834 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -20.422 6.473 3.385 1.00 0.00 C ATOM 1810 CZ PHE A 120 -19.332 7.235 3.749 1.00 0.00 C ATOM 0 H PHE A 120 -18.805 0.532 2.762 1.00 0.00 H new ATOM 0 HA PHE A 120 -17.954 2.373 4.763 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -17.886 2.880 2.352 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -19.624 2.695 2.226 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -16.934 4.867 3.629 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -21.120 4.539 2.822 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -17.226 7.253 4.118 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -21.400 6.926 3.318 1.00 0.00 H new ATOM 0 HZ PHE A 120 -19.456 8.285 3.968 1.00 0.00 H new ATOM 1820 N ALA A 121 -19.940 2.903 6.186 1.00 0.00 N ATOM 1821 CA ALA A 121 -21.056 3.147 7.111 1.00 0.00 C ATOM 1822 C ALA A 121 -22.097 4.078 6.465 1.00 0.00 C ATOM 1823 O ALA A 121 -21.962 5.306 6.489 1.00 0.00 O ATOM 1824 CB ALA A 121 -20.536 3.719 8.438 1.00 0.00 C ATOM 0 H ALA A 121 -19.035 3.202 6.550 1.00 0.00 H new ATOM 0 HA ALA A 121 -21.548 2.199 7.327 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -21.374 3.894 9.112 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -19.846 3.010 8.894 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -20.018 4.660 8.251 1.00 0.00 H new ATOM 1830 N GLY A 122 -23.114 3.457 5.856 1.00 0.00 N ATOM 1831 CA GLY A 122 -24.161 4.162 5.145 1.00 0.00 C ATOM 1832 C GLY A 122 -24.992 3.182 4.321 1.00 0.00 C ATOM 1833 O GLY A 122 -26.001 2.663 4.833 1.00 0.00 O ATOM 1834 OXT GLY A 122 -24.622 2.885 3.168 1.00 0.00 O ATOM 0 H GLY A 122 -23.225 2.443 5.849 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -24.802 4.687 5.854 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -23.722 4.917 4.492 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -11.926 -9.955 -7.172 1.00 0.00 N ATOM 1840 CA MET B 1 -13.232 -9.318 -7.452 1.00 0.00 C ATOM 1841 C MET B 1 -13.336 -7.982 -6.700 1.00 0.00 C ATOM 1842 O MET B 1 -13.806 -6.980 -7.254 1.00 0.00 O ATOM 1843 CB MET B 1 -14.397 -10.276 -7.079 1.00 0.00 C ATOM 1844 CG MET B 1 -14.497 -10.645 -5.583 1.00 0.00 C ATOM 1845 SD MET B 1 -13.003 -11.452 -4.954 1.00 0.00 S ATOM 1846 CE MET B 1 -13.422 -11.719 -3.229 1.00 0.00 C ATOM 0 H1 MET B 1 -11.730 -10.678 -7.894 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.177 -9.234 -7.192 1.00 0.00 H new ATOM 0 H3 MET B 1 -11.952 -10.402 -6.233 1.00 0.00 H new ATOM 0 HA MET B 1 -13.308 -9.112 -8.520 1.00 0.00 H new ATOM 0 HB2 MET B 1 -15.336 -9.816 -7.386 1.00 0.00 H new ATOM 0 HB3 MET B 1 -14.289 -11.194 -7.656 1.00 0.00 H new ATOM 0 HG2 MET B 1 -14.687 -9.742 -5.003 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.351 -11.306 -5.433 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.170 -12.742 -2.948 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.860 -11.023 -2.606 1.00 0.00 H new ATOM 0 HE3 MET B 1 -14.490 -11.555 -3.084 1.00 0.00 H new ATOM 1856 N THR B 2 -12.871 -7.978 -5.437 1.00 0.00 N ATOM 1857 CA THR B 2 -12.928 -6.811 -4.552 1.00 0.00 C ATOM 1858 C THR B 2 -11.823 -5.804 -4.926 1.00 0.00 C ATOM 1859 O THR B 2 -10.733 -6.208 -5.356 1.00 0.00 O ATOM 1860 CB THR B 2 -12.789 -7.262 -3.063 1.00 0.00 C ATOM 1861 OG1 THR B 2 -13.584 -8.438 -2.846 1.00 0.00 O ATOM 1862 CG2 THR B 2 -13.241 -6.167 -2.082 1.00 0.00 C ATOM 0 H THR B 2 -12.442 -8.795 -5.003 1.00 0.00 H new ATOM 0 HA THR B 2 -13.893 -6.318 -4.674 1.00 0.00 H new ATOM 0 HB THR B 2 -11.734 -7.467 -2.878 1.00 0.00 H new ATOM 0 HG1 THR B 2 -14.076 -8.349 -2.003 1.00 0.00 H new ATOM 0 HG21 THR B 2 -13.127 -6.525 -1.059 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.630 -5.276 -2.225 1.00 0.00 H new ATOM 0 HG23 THR B 2 -14.287 -5.923 -2.266 1.00 0.00 H new ATOM 1870 N HIS B 3 -12.119 -4.499 -4.770 1.00 0.00 N ATOM 1871 CA HIS B 3 -11.244 -3.400 -5.226 1.00 0.00 C ATOM 1872 C HIS B 3 -10.479 -2.785 -4.030 1.00 0.00 C ATOM 1873 O HIS B 3 -11.089 -2.107 -3.190 1.00 0.00 O ATOM 1874 CB HIS B 3 -12.084 -2.318 -5.959 1.00 0.00 C ATOM 1875 CG HIS B 3 -12.789 -2.815 -7.201 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -12.327 -2.581 -8.479 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -13.924 -3.545 -7.346 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -13.142 -3.141 -9.351 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -14.118 -3.735 -8.690 1.00 0.00 N ATOM 0 H HIS B 3 -12.976 -4.175 -4.322 1.00 0.00 H new ATOM 0 HA HIS B 3 -10.511 -3.801 -5.926 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -12.827 -1.921 -5.267 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -11.430 -1.490 -6.233 1.00 0.00 H new ATOM 0 HD1 HIS B 3 -11.485 -2.056 -8.714 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -14.557 -3.909 -6.550 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -13.030 -3.118 -10.425 1.00 0.00 H new ATOM 1888 N PRO B 4 -9.134 -3.043 -3.911 1.00 0.00 N ATOM 1889 CA PRO B 4 -8.264 -2.392 -2.909 1.00 0.00 C ATOM 1890 C PRO B 4 -7.644 -1.083 -3.446 1.00 0.00 C ATOM 1891 O PRO B 4 -6.421 -0.887 -3.420 1.00 0.00 O ATOM 1892 CB PRO B 4 -7.205 -3.480 -2.663 1.00 0.00 C ATOM 1893 CG PRO B 4 -7.005 -4.107 -4.010 1.00 0.00 C ATOM 1894 CD PRO B 4 -8.355 -4.027 -4.716 1.00 0.00 C ATOM 0 HA PRO B 4 -8.787 -2.078 -2.006 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -6.278 -3.054 -2.280 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -7.547 -4.211 -1.930 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -6.237 -3.579 -4.576 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -6.676 -5.142 -3.914 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -8.245 -3.697 -5.749 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -8.848 -4.999 -4.742 1.00 0.00 H new ATOM 1902 N ASP B 5 -8.515 -0.167 -3.888 1.00 0.00 N ATOM 1903 CA ASP B 5 -8.117 1.167 -4.400 1.00 0.00 C ATOM 1904 C ASP B 5 -7.767 2.149 -3.258 1.00 0.00 C ATOM 1905 O ASP B 5 -7.462 3.328 -3.500 1.00 0.00 O ATOM 1906 CB ASP B 5 -9.266 1.738 -5.251 1.00 0.00 C ATOM 1907 CG ASP B 5 -10.559 1.932 -4.439 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -11.331 0.957 -4.282 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -10.809 3.053 -3.956 1.00 0.00 O ATOM 0 H ASP B 5 -9.523 -0.323 -3.904 1.00 0.00 H new ATOM 0 HA ASP B 5 -7.219 1.046 -5.005 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -8.960 2.694 -5.675 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -9.463 1.067 -6.087 1.00 0.00 H new ATOM 1914 N PHE B 6 -7.796 1.635 -2.033 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.583 2.380 -0.807 1.00 0.00 C ATOM 1916 C PHE B 6 -6.424 1.687 -0.067 1.00 0.00 C ATOM 1917 O PHE B 6 -6.460 0.476 0.149 1.00 0.00 O ATOM 1918 CB PHE B 6 -8.912 2.381 0.011 1.00 0.00 C ATOM 1919 CG PHE B 6 -8.950 3.167 1.336 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -7.919 4.005 1.745 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -10.058 3.054 2.175 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -7.999 4.688 2.934 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.131 3.740 3.366 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.102 4.554 3.746 1.00 0.00 C ATOM 0 H PHE B 6 -7.977 0.645 -1.865 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.317 3.423 -0.980 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -9.699 2.775 -0.632 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -9.169 1.345 0.231 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -7.045 4.120 1.121 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -10.877 2.414 1.884 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.189 5.336 3.234 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -11.000 3.635 3.999 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.154 5.091 4.681 1.00 0.00 H new ATOM 1934 N THR B 7 -5.383 2.452 0.261 1.00 0.00 N ATOM 1935 CA THR B 7 -4.242 1.975 1.057 1.00 0.00 C ATOM 1936 C THR B 7 -4.145 2.831 2.324 1.00 0.00 C ATOM 1937 O THR B 7 -4.336 4.043 2.272 1.00 0.00 O ATOM 1938 CB THR B 7 -2.900 2.023 0.247 1.00 0.00 C ATOM 1939 OG1 THR B 7 -1.819 1.514 1.049 1.00 0.00 O ATOM 1940 CG2 THR B 7 -2.546 3.439 -0.252 1.00 0.00 C ATOM 0 H THR B 7 -5.303 3.430 -0.019 1.00 0.00 H new ATOM 0 HA THR B 7 -4.406 0.930 1.321 1.00 0.00 H new ATOM 0 HB THR B 7 -3.047 1.397 -0.633 1.00 0.00 H new ATOM 0 HG1 THR B 7 -0.965 1.706 0.608 1.00 0.00 H new ATOM 0 HG21 THR B 7 -1.607 3.406 -0.805 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.339 3.804 -0.905 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.441 4.110 0.601 1.00 0.00 H new ATOM 1948 N ILE B 8 -3.891 2.187 3.463 1.00 0.00 N ATOM 1949 CA ILE B 8 -3.811 2.855 4.768 1.00 0.00 C ATOM 1950 C ILE B 8 -2.396 2.694 5.339 1.00 0.00 C ATOM 1951 O ILE B 8 -1.822 1.601 5.298 1.00 0.00 O ATOM 1952 CB ILE B 8 -4.881 2.273 5.771 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.314 2.422 5.164 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -4.791 2.958 7.152 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.462 2.011 6.069 1.00 0.00 C ATOM 0 H ILE B 8 -3.733 1.180 3.510 1.00 0.00 H new ATOM 0 HA ILE B 8 -4.027 3.915 4.632 1.00 0.00 H new ATOM 0 HB ILE B 8 -4.671 1.214 5.922 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.459 3.463 4.875 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.365 1.828 4.252 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.542 2.533 7.818 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -3.799 2.797 7.574 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -4.969 4.028 7.040 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.407 2.156 5.546 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.354 0.961 6.339 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.450 2.621 6.972 1.00 0.00 H new ATOM 1967 N LEU B 9 -1.839 3.795 5.861 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.538 3.790 6.536 1.00 0.00 C ATOM 1969 C LEU B 9 -0.753 3.536 8.027 1.00 0.00 C ATOM 1970 O LEU B 9 -1.804 3.834 8.603 1.00 0.00 O ATOM 1971 CB LEU B 9 0.181 5.122 6.279 1.00 0.00 C ATOM 1972 CG LEU B 9 0.472 5.397 4.777 1.00 0.00 C ATOM 1973 CD1 LEU B 9 0.914 6.840 4.565 1.00 0.00 C ATOM 1974 CD2 LEU B 9 1.504 4.387 4.211 1.00 0.00 C ATOM 0 H LEU B 9 -2.280 4.714 5.826 1.00 0.00 H new ATOM 0 HA LEU B 9 0.095 2.994 6.143 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -0.426 5.935 6.677 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.122 5.129 6.829 1.00 0.00 H new ATOM 0 HG LEU B 9 -0.454 5.254 4.220 1.00 0.00 H new ATOM 0 HD11 LEU B 9 1.112 7.008 3.506 1.00 0.00 H new ATOM 0 HD12 LEU B 9 0.126 7.515 4.899 1.00 0.00 H new ATOM 0 HD13 LEU B 9 1.821 7.031 5.138 1.00 0.00 H new ATOM 0 HD21 LEU B 9 1.687 4.605 3.159 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.438 4.471 4.767 1.00 0.00 H new ATOM 0 HD23 LEU B 9 1.113 3.374 4.309 1.00 0.00 H new ATOM 1986 N TYR B 10 0.317 3.012 8.624 1.00 0.00 N ATOM 1987 CA TYR B 10 0.381 2.551 10.006 1.00 0.00 C ATOM 1988 C TYR B 10 1.210 3.566 10.813 1.00 0.00 C ATOM 1989 O TYR B 10 2.422 3.701 10.598 1.00 0.00 O ATOM 1990 CB TYR B 10 1.016 1.118 10.037 1.00 0.00 C ATOM 1991 CG TYR B 10 2.496 1.019 9.533 1.00 0.00 C ATOM 1992 CD1 TYR B 10 2.836 1.264 8.194 1.00 0.00 C ATOM 1993 CD2 TYR B 10 3.549 0.728 10.414 1.00 0.00 C ATOM 1994 CE1 TYR B 10 4.147 1.214 7.759 1.00 0.00 C ATOM 1995 CE2 TYR B 10 4.861 0.672 9.975 1.00 0.00 C ATOM 1996 CZ TYR B 10 5.157 0.923 8.653 1.00 0.00 C ATOM 1997 OH TYR B 10 6.471 0.884 8.221 1.00 0.00 O ATOM 0 H TYR B 10 1.203 2.893 8.132 1.00 0.00 H new ATOM 0 HA TYR B 10 -0.612 2.483 10.451 1.00 0.00 H new ATOM 0 HB2 TYR B 10 0.974 0.744 11.060 1.00 0.00 H new ATOM 0 HB3 TYR B 10 0.400 0.455 9.430 1.00 0.00 H new ATOM 0 HD1 TYR B 10 2.054 1.497 7.486 1.00 0.00 H new ATOM 0 HD2 TYR B 10 3.332 0.544 11.456 1.00 0.00 H new ATOM 0 HE1 TYR B 10 4.380 1.402 6.721 1.00 0.00 H new ATOM 0 HE2 TYR B 10 5.653 0.431 10.669 1.00 0.00 H new ATOM 0 HH TYR B 10 7.065 1.144 8.956 1.00 0.00 H new ATOM 2007 N VAL B 11 0.556 4.354 11.674 1.00 0.00 N ATOM 2008 CA VAL B 11 1.230 5.430 12.433 1.00 0.00 C ATOM 2009 C VAL B 11 0.996 5.264 13.939 1.00 0.00 C ATOM 2010 O VAL B 11 0.081 4.564 14.372 1.00 0.00 O ATOM 2011 CB VAL B 11 0.753 6.869 11.953 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.767 6.981 10.407 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -0.634 7.281 12.521 1.00 0.00 C ATOM 0 H VAL B 11 -0.442 4.271 11.867 1.00 0.00 H new ATOM 0 HA VAL B 11 2.299 5.348 12.236 1.00 0.00 H new ATOM 0 HB VAL B 11 1.477 7.573 12.363 1.00 0.00 H new ATOM 0 HG11 VAL B 11 0.436 7.976 10.111 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.779 6.811 10.039 1.00 0.00 H new ATOM 0 HG13 VAL B 11 0.096 6.234 9.982 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -0.898 8.273 12.154 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.387 6.562 12.198 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -0.591 7.297 13.610 1.00 0.00 H new ATOM 2023 N ASP B 12 1.871 5.903 14.722 1.00 0.00 N ATOM 2024 CA ASP B 12 1.825 5.904 16.179 1.00 0.00 C ATOM 2025 C ASP B 12 1.141 7.184 16.674 1.00 0.00 C ATOM 2026 O ASP B 12 0.083 7.120 17.307 1.00 0.00 O ATOM 2027 CB ASP B 12 3.264 5.784 16.754 1.00 0.00 C ATOM 2028 CG ASP B 12 3.313 5.890 18.288 1.00 0.00 C ATOM 2029 OD1 ASP B 12 2.913 4.924 18.967 1.00 0.00 O ATOM 2030 OD2 ASP B 12 3.731 6.939 18.819 1.00 0.00 O ATOM 0 H ASP B 12 2.648 6.446 14.346 1.00 0.00 H new ATOM 0 HA ASP B 12 1.247 5.048 16.526 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.692 4.830 16.448 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.888 6.566 16.322 1.00 0.00 H new ATOM 2035 N ASN B 13 1.748 8.348 16.363 1.00 0.00 N ATOM 2036 CA ASN B 13 1.295 9.663 16.868 1.00 0.00 C ATOM 2037 C ASN B 13 0.279 10.276 15.874 1.00 0.00 C ATOM 2038 O ASN B 13 0.693 10.717 14.798 1.00 0.00 O ATOM 2039 CB ASN B 13 2.541 10.587 17.057 1.00 0.00 C ATOM 2040 CG ASN B 13 2.276 11.910 17.793 1.00 0.00 C ATOM 2041 OD1 ASN B 13 1.214 12.518 17.673 1.00 0.00 O ATOM 2042 ND2 ASN B 13 3.252 12.366 18.575 1.00 0.00 N ATOM 0 H ASN B 13 2.565 8.404 15.755 1.00 0.00 H new ATOM 0 HA ASN B 13 0.796 9.553 17.831 1.00 0.00 H new ATOM 0 HB2 ASN B 13 3.303 10.033 17.605 1.00 0.00 H new ATOM 0 HB3 ASN B 13 2.956 10.814 16.075 1.00 0.00 H new ATOM 0 HD21 ASN B 13 3.127 13.237 19.091 1.00 0.00 H new ATOM 0 HD22 ASN B 13 4.124 11.844 18.659 1.00 0.00 H new ATOM 2049 N PRO B 14 -1.064 10.289 16.209 1.00 0.00 N ATOM 2050 CA PRO B 14 -2.106 10.819 15.297 1.00 0.00 C ATOM 2051 C PRO B 14 -1.863 12.307 14.849 1.00 0.00 C ATOM 2052 O PRO B 14 -1.653 12.504 13.651 1.00 0.00 O ATOM 2053 CB PRO B 14 -3.450 10.595 16.061 1.00 0.00 C ATOM 2054 CG PRO B 14 -3.125 9.556 17.095 1.00 0.00 C ATOM 2055 CD PRO B 14 -1.672 9.766 17.466 1.00 0.00 C ATOM 0 HA PRO B 14 -2.102 10.299 14.339 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -3.803 11.517 16.522 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.237 10.253 15.389 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -3.769 9.662 17.968 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -3.285 8.552 16.701 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -1.566 10.474 18.288 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -1.200 8.836 17.783 1.00 0.00 H new ATOM 2063 N PRO B 15 -1.809 13.375 15.768 1.00 0.00 N ATOM 2064 CA PRO B 15 -1.663 14.799 15.327 1.00 0.00 C ATOM 2065 C PRO B 15 -0.435 15.010 14.419 1.00 0.00 C ATOM 2066 O PRO B 15 -0.556 15.509 13.298 1.00 0.00 O ATOM 2067 CB PRO B 15 -1.533 15.598 16.656 1.00 0.00 C ATOM 2068 CG PRO B 15 -2.190 14.727 17.678 1.00 0.00 C ATOM 2069 CD PRO B 15 -1.870 13.309 17.259 1.00 0.00 C ATOM 0 HA PRO B 15 -2.509 15.124 14.722 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -0.489 15.786 16.906 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -2.024 16.569 16.586 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -1.809 14.937 18.677 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -3.267 14.896 17.705 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -0.924 12.972 17.682 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -2.636 12.611 17.596 1.00 0.00 H new ATOM 2077 N ALA B 16 0.723 14.544 14.911 1.00 0.00 N ATOM 2078 CA ALA B 16 2.035 14.830 14.303 1.00 0.00 C ATOM 2079 C ALA B 16 2.158 14.209 12.906 1.00 0.00 C ATOM 2080 O ALA B 16 2.605 14.867 11.956 1.00 0.00 O ATOM 2081 CB ALA B 16 3.159 14.324 15.214 1.00 0.00 C ATOM 0 H ALA B 16 0.778 13.957 15.743 1.00 0.00 H new ATOM 0 HA ALA B 16 2.124 15.911 14.191 1.00 0.00 H new ATOM 0 HB1 ALA B 16 4.124 14.540 14.756 1.00 0.00 H new ATOM 0 HB2 ALA B 16 3.096 14.824 16.181 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.057 13.248 15.354 1.00 0.00 H new ATOM 2087 N SER B 17 1.696 12.957 12.775 1.00 0.00 N ATOM 2088 CA SER B 17 1.791 12.205 11.518 1.00 0.00 C ATOM 2089 C SER B 17 0.700 12.656 10.529 1.00 0.00 C ATOM 2090 O SER B 17 0.865 12.481 9.312 1.00 0.00 O ATOM 2091 CB SER B 17 1.670 10.689 11.777 1.00 0.00 C ATOM 2092 OG SER B 17 1.750 9.951 10.566 1.00 0.00 O ATOM 0 H SER B 17 1.249 12.441 13.533 1.00 0.00 H new ATOM 0 HA SER B 17 2.768 12.409 11.080 1.00 0.00 H new ATOM 0 HB2 SER B 17 2.462 10.369 12.453 1.00 0.00 H new ATOM 0 HB3 SER B 17 0.723 10.477 12.273 1.00 0.00 H new ATOM 0 HG SER B 17 2.068 10.536 9.847 1.00 0.00 H new ATOM 2098 N THR B 18 -0.382 13.284 11.029 1.00 0.00 N ATOM 2099 CA THR B 18 -1.493 13.715 10.175 1.00 0.00 C ATOM 2100 C THR B 18 -1.145 14.991 9.393 1.00 0.00 C ATOM 2101 O THR B 18 -1.307 15.062 8.173 1.00 0.00 O ATOM 2102 CB THR B 18 -2.823 13.918 10.985 1.00 0.00 C ATOM 2103 OG1 THR B 18 -3.286 12.645 11.480 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.949 14.568 10.144 1.00 0.00 C ATOM 0 H THR B 18 -0.505 13.501 12.018 1.00 0.00 H new ATOM 0 HA THR B 18 -1.659 12.908 9.461 1.00 0.00 H new ATOM 0 HB THR B 18 -2.592 14.597 11.806 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.760 12.389 12.266 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.842 14.682 10.758 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.622 15.547 9.793 1.00 0.00 H new ATOM 0 HG23 THR B 18 -4.176 13.933 9.288 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.549 15.950 10.142 1.00 0.00 N ATOM 2113 CA GLN B 19 -0.041 17.232 9.600 1.00 0.00 C ATOM 2114 C GLN B 19 1.169 16.960 8.689 1.00 0.00 C ATOM 2115 O GLN B 19 1.420 17.705 7.733 1.00 0.00 O ATOM 2116 CB GLN B 19 0.367 18.183 10.763 1.00 0.00 C ATOM 2117 CG GLN B 19 -0.689 18.346 11.884 1.00 0.00 C ATOM 2118 CD GLN B 19 -1.856 19.286 11.568 1.00 0.00 C ATOM 2119 OE1 GLN B 19 -2.218 19.495 10.423 1.00 0.00 O ATOM 2120 NE2 GLN B 19 -2.482 19.832 12.599 1.00 0.00 N ATOM 0 H GLN B 19 -0.407 15.854 11.147 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.828 17.713 9.019 1.00 0.00 H new ATOM 0 HB2 GLN B 19 1.291 17.812 11.207 1.00 0.00 H new ATOM 0 HB3 GLN B 19 0.586 19.166 10.347 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -1.094 17.362 12.122 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -0.187 18.709 12.780 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -2.161 19.643 13.549 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -3.285 20.442 12.444 1.00 0.00 H new ATOM 2129 N PHE B 20 1.916 15.886 9.025 1.00 0.00 N ATOM 2130 CA PHE B 20 3.089 15.444 8.261 1.00 0.00 C ATOM 2131 C PHE B 20 2.696 15.085 6.814 1.00 0.00 C ATOM 2132 O PHE B 20 3.288 15.624 5.881 1.00 0.00 O ATOM 2133 CB PHE B 20 3.774 14.232 8.962 1.00 0.00 C ATOM 2134 CG PHE B 20 4.914 13.581 8.167 1.00 0.00 C ATOM 2135 CD1 PHE B 20 6.142 14.226 8.017 1.00 0.00 C ATOM 2136 CD2 PHE B 20 4.745 12.336 7.549 1.00 0.00 C ATOM 2137 CE1 PHE B 20 7.157 13.648 7.282 1.00 0.00 C ATOM 2138 CE2 PHE B 20 5.760 11.763 6.810 1.00 0.00 C ATOM 2139 CZ PHE B 20 6.965 12.418 6.677 1.00 0.00 C ATOM 0 H PHE B 20 1.716 15.303 9.838 1.00 0.00 H new ATOM 0 HA PHE B 20 3.802 16.267 8.224 1.00 0.00 H new ATOM 0 HB2 PHE B 20 4.165 14.562 9.924 1.00 0.00 H new ATOM 0 HB3 PHE B 20 3.017 13.475 9.168 1.00 0.00 H new ATOM 0 HD1 PHE B 20 6.300 15.188 8.481 1.00 0.00 H new ATOM 0 HD2 PHE B 20 3.804 11.815 7.652 1.00 0.00 H new ATOM 0 HE1 PHE B 20 8.104 14.157 7.179 1.00 0.00 H new ATOM 0 HE2 PHE B 20 5.610 10.804 6.337 1.00 0.00 H new ATOM 0 HZ PHE B 20 7.761 11.971 6.100 1.00 0.00 H new ATOM 2149 N TYR B 21 1.659 14.239 6.627 1.00 0.00 N ATOM 2150 CA TYR B 21 1.174 13.882 5.268 1.00 0.00 C ATOM 2151 C TYR B 21 0.438 15.054 4.618 1.00 0.00 C ATOM 2152 O TYR B 21 0.399 15.125 3.383 1.00 0.00 O ATOM 2153 CB TYR B 21 0.328 12.597 5.294 1.00 0.00 C ATOM 2154 CG TYR B 21 1.218 11.372 5.499 1.00 0.00 C ATOM 2155 CD1 TYR B 21 1.977 10.869 4.442 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.346 10.760 6.738 1.00 0.00 C ATOM 2157 CE1 TYR B 21 2.829 9.807 4.619 1.00 0.00 C ATOM 2158 CE2 TYR B 21 2.201 9.698 6.921 1.00 0.00 C ATOM 2159 CZ TYR B 21 2.935 9.223 5.859 1.00 0.00 C ATOM 2160 OH TYR B 21 3.778 8.156 6.032 1.00 0.00 O ATOM 0 H TYR B 21 1.145 13.794 7.387 1.00 0.00 H new ATOM 0 HA TYR B 21 2.043 13.671 4.644 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -0.409 12.656 6.095 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -0.224 12.500 4.359 1.00 0.00 H new ATOM 0 HD1 TYR B 21 1.893 11.324 3.466 1.00 0.00 H new ATOM 0 HD2 TYR B 21 0.765 11.124 7.572 1.00 0.00 H new ATOM 0 HE1 TYR B 21 3.412 9.433 3.790 1.00 0.00 H new ATOM 0 HE2 TYR B 21 2.296 9.239 7.894 1.00 0.00 H new ATOM 0 HH TYR B 21 4.406 8.350 6.759 1.00 0.00 H new ATOM 2170 N LYS B 22 -0.166 15.948 5.420 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.876 17.125 4.877 1.00 0.00 C ATOM 2172 C LYS B 22 0.028 17.991 3.981 1.00 0.00 C ATOM 2173 O LYS B 22 -0.329 18.325 2.857 1.00 0.00 O ATOM 2174 CB LYS B 22 -1.490 17.982 6.002 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.769 17.396 6.621 1.00 0.00 C ATOM 2176 CD LYS B 22 -3.290 18.240 7.799 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.597 19.703 7.414 1.00 0.00 C ATOM 2178 NZ LYS B 22 -4.128 20.490 8.555 1.00 0.00 N ATOM 0 H LYS B 22 -0.179 15.882 6.438 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.683 16.737 4.256 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.747 18.113 6.789 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.713 18.973 5.607 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.542 17.329 5.856 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.571 16.381 6.964 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -4.194 17.779 8.195 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -2.550 18.230 8.599 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -2.688 20.176 7.042 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -4.320 19.717 6.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -4.064 21.505 8.336 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -5.122 20.234 8.721 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -3.570 20.284 9.408 1.00 0.00 H new ATOM 2192 N ALA B 23 1.207 18.336 4.520 1.00 0.00 N ATOM 2193 CA ALA B 23 2.218 19.136 3.805 1.00 0.00 C ATOM 2194 C ALA B 23 2.972 18.276 2.763 1.00 0.00 C ATOM 2195 O ALA B 23 3.313 18.758 1.678 1.00 0.00 O ATOM 2196 CB ALA B 23 3.197 19.758 4.818 1.00 0.00 C ATOM 0 H ALA B 23 1.488 18.069 5.463 1.00 0.00 H new ATOM 0 HA ALA B 23 1.714 19.937 3.264 1.00 0.00 H new ATOM 0 HB1 ALA B 23 3.943 20.349 4.287 1.00 0.00 H new ATOM 0 HB2 ALA B 23 2.648 20.400 5.507 1.00 0.00 H new ATOM 0 HB3 ALA B 23 3.693 18.965 5.378 1.00 0.00 H new ATOM 2202 N LEU B 24 3.205 17.000 3.120 1.00 0.00 N ATOM 2203 CA LEU B 24 4.003 16.043 2.313 1.00 0.00 C ATOM 2204 C LEU B 24 3.389 15.802 0.919 1.00 0.00 C ATOM 2205 O LEU B 24 4.093 15.775 -0.103 1.00 0.00 O ATOM 2206 CB LEU B 24 4.073 14.672 3.055 1.00 0.00 C ATOM 2207 CG LEU B 24 5.254 13.734 2.656 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.556 14.200 3.327 1.00 0.00 C ATOM 2209 CD2 LEU B 24 4.959 12.253 2.973 1.00 0.00 C ATOM 0 H LEU B 24 2.844 16.595 3.984 1.00 0.00 H new ATOM 0 HA LEU B 24 4.994 16.477 2.185 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.135 14.865 4.126 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.138 14.139 2.880 1.00 0.00 H new ATOM 0 HG LEU B 24 5.376 13.801 1.575 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.371 13.536 3.040 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.786 15.217 3.008 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.435 14.178 4.410 1.00 0.00 H new ATOM 0 HD21 LEU B 24 5.811 11.641 2.677 1.00 0.00 H new ATOM 0 HD22 LEU B 24 4.784 12.138 4.043 1.00 0.00 H new ATOM 0 HD23 LEU B 24 4.074 11.933 2.424 1.00 0.00 H new ATOM 2221 N LEU B 25 2.059 15.642 0.908 1.00 0.00 N ATOM 2222 CA LEU B 25 1.272 15.402 -0.313 1.00 0.00 C ATOM 2223 C LEU B 25 0.720 16.743 -0.826 1.00 0.00 C ATOM 2224 O LEU B 25 0.638 16.952 -2.043 1.00 0.00 O ATOM 2225 CB LEU B 25 0.150 14.379 0.000 1.00 0.00 C ATOM 2226 CG LEU B 25 0.622 13.094 0.768 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -0.525 12.092 0.968 1.00 0.00 C ATOM 2228 CD2 LEU B 25 1.822 12.433 0.072 1.00 0.00 C ATOM 0 H LEU B 25 1.491 15.676 1.755 1.00 0.00 H new ATOM 0 HA LEU B 25 1.892 14.978 -1.103 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.620 14.875 0.591 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.315 14.074 -0.937 1.00 0.00 H new ATOM 0 HG LEU B 25 0.947 13.415 1.758 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.155 11.218 1.503 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.321 12.561 1.546 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.914 11.785 -0.003 1.00 0.00 H new ATOM 0 HD21 LEU B 25 2.123 11.546 0.630 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.542 12.146 -0.942 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.653 13.137 0.033 1.00 0.00 H new ATOM 2240 N GLY B 26 0.361 17.646 0.104 1.00 0.00 N ATOM 2241 CA GLY B 26 -0.294 18.917 -0.241 1.00 0.00 C ATOM 2242 C GLY B 26 -1.810 18.799 -0.210 1.00 0.00 C ATOM 2243 O GLY B 26 -2.513 19.396 -1.035 1.00 0.00 O ATOM 0 H GLY B 26 0.515 17.516 1.104 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.024 19.691 0.457 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.026 19.233 -1.234 1.00 0.00 H new ATOM 2247 N VAL B 27 -2.305 18.007 0.762 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.737 17.668 0.921 1.00 0.00 C ATOM 2249 C VAL B 27 -4.184 17.906 2.380 1.00 0.00 C ATOM 2250 O VAL B 27 -3.401 18.381 3.205 1.00 0.00 O ATOM 2251 CB VAL B 27 -4.023 16.169 0.507 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.666 15.918 -0.981 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.286 15.168 1.440 1.00 0.00 C ATOM 0 H VAL B 27 -1.712 17.577 1.472 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.309 18.318 0.259 1.00 0.00 H new ATOM 0 HB VAL B 27 -5.093 15.997 0.625 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -3.874 14.879 -1.235 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -4.265 16.573 -1.614 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.608 16.126 -1.141 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -3.506 14.148 1.125 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.211 15.342 1.383 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.623 15.312 2.467 1.00 0.00 H new ATOM 2263 N ASP B 28 -5.455 17.592 2.679 1.00 0.00 N ATOM 2264 CA ASP B 28 -6.012 17.641 4.051 1.00 0.00 C ATOM 2265 C ASP B 28 -6.960 16.436 4.267 1.00 0.00 C ATOM 2266 O ASP B 28 -7.564 15.956 3.299 1.00 0.00 O ATOM 2267 CB ASP B 28 -6.752 18.988 4.303 1.00 0.00 C ATOM 2268 CG ASP B 28 -7.954 19.229 3.368 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -7.745 19.727 2.246 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -9.109 18.918 3.747 1.00 0.00 O ATOM 0 H ASP B 28 -6.132 17.295 1.976 1.00 0.00 H new ATOM 0 HA ASP B 28 -5.194 17.579 4.769 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -7.098 19.012 5.336 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -6.043 19.808 4.185 1.00 0.00 H new ATOM 2275 N PRO B 29 -7.083 15.902 5.527 1.00 0.00 N ATOM 2276 CA PRO B 29 -7.998 14.785 5.828 1.00 0.00 C ATOM 2277 C PRO B 29 -9.484 15.202 5.703 1.00 0.00 C ATOM 2278 O PRO B 29 -9.994 15.972 6.520 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.625 14.381 7.279 1.00 0.00 C ATOM 2280 CG PRO B 29 -7.039 15.624 7.878 1.00 0.00 C ATOM 2281 CD PRO B 29 -6.333 16.329 6.740 1.00 0.00 C ATOM 0 HA PRO B 29 -7.891 13.958 5.126 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.501 14.048 7.835 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -6.909 13.560 7.290 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -7.816 16.256 8.309 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -6.343 15.382 8.681 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -6.359 17.412 6.864 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -5.284 16.040 6.682 1.00 0.00 H new ATOM 2289 N VAL B 30 -10.151 14.701 4.646 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.594 14.922 4.409 1.00 0.00 C ATOM 2291 C VAL B 30 -12.439 14.248 5.526 1.00 0.00 C ATOM 2292 O VAL B 30 -13.507 14.745 5.900 1.00 0.00 O ATOM 2293 CB VAL B 30 -12.014 14.426 2.970 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.645 12.939 2.743 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.514 14.698 2.681 1.00 0.00 C ATOM 0 H VAL B 30 -9.704 14.129 3.929 1.00 0.00 H new ATOM 0 HA VAL B 30 -11.792 15.993 4.448 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.440 15.011 2.251 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -11.951 12.637 1.741 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.568 12.811 2.847 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -12.157 12.320 3.480 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -13.762 14.342 1.681 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -14.127 14.175 3.415 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -13.708 15.769 2.743 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.926 13.123 6.057 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.431 12.487 7.294 1.00 0.00 C ATOM 2307 C GLU B 31 -11.288 12.464 8.321 1.00 0.00 C ATOM 2308 O GLU B 31 -10.132 12.282 7.938 1.00 0.00 O ATOM 2309 CB GLU B 31 -12.927 11.041 7.019 1.00 0.00 C ATOM 2310 CG GLU B 31 -14.102 10.939 6.030 1.00 0.00 C ATOM 2311 CD GLU B 31 -14.595 9.494 5.814 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -15.222 8.929 6.735 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -14.368 8.916 4.725 1.00 0.00 O ATOM 0 H GLU B 31 -11.142 12.623 5.638 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.278 13.058 7.675 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -12.094 10.453 6.634 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.226 10.588 7.964 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -14.930 11.547 6.396 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -13.798 11.359 5.071 1.00 0.00 H new ATOM 2320 N SER B 32 -11.601 12.661 9.613 1.00 0.00 N ATOM 2321 CA SER B 32 -10.586 12.646 10.682 1.00 0.00 C ATOM 2322 C SER B 32 -11.231 12.389 12.055 1.00 0.00 C ATOM 2323 O SER B 32 -12.411 12.674 12.280 1.00 0.00 O ATOM 2324 CB SER B 32 -9.762 13.963 10.698 1.00 0.00 C ATOM 2325 OG SER B 32 -8.661 13.880 11.602 1.00 0.00 O ATOM 0 H SER B 32 -12.551 12.833 9.943 1.00 0.00 H new ATOM 0 HA SER B 32 -9.900 11.825 10.471 1.00 0.00 H new ATOM 0 HB2 SER B 32 -9.395 14.176 9.694 1.00 0.00 H new ATOM 0 HB3 SER B 32 -10.407 14.794 10.984 1.00 0.00 H new ATOM 0 HG SER B 32 -7.937 13.365 11.189 1.00 0.00 H new ATOM 2331 N SER B 33 -10.418 11.825 12.946 1.00 0.00 N ATOM 2332 CA SER B 33 -10.763 11.469 14.331 1.00 0.00 C ATOM 2333 C SER B 33 -9.500 11.731 15.207 1.00 0.00 C ATOM 2334 O SER B 33 -8.407 11.898 14.649 1.00 0.00 O ATOM 2335 CB SER B 33 -11.186 9.972 14.390 1.00 0.00 C ATOM 2336 OG SER B 33 -12.264 9.686 13.505 1.00 0.00 O ATOM 0 H SER B 33 -9.452 11.590 12.716 1.00 0.00 H new ATOM 0 HA SER B 33 -11.598 12.065 14.700 1.00 0.00 H new ATOM 0 HB2 SER B 33 -10.332 9.344 14.136 1.00 0.00 H new ATOM 0 HB3 SER B 33 -11.477 9.718 15.409 1.00 0.00 H new ATOM 0 HG SER B 33 -12.498 8.737 13.571 1.00 0.00 H new ATOM 2342 N PRO B 34 -9.596 11.784 16.581 1.00 0.00 N ATOM 2343 CA PRO B 34 -8.395 11.962 17.454 1.00 0.00 C ATOM 2344 C PRO B 34 -7.358 10.811 17.308 1.00 0.00 C ATOM 2345 O PRO B 34 -6.215 10.952 17.737 1.00 0.00 O ATOM 2346 CB PRO B 34 -8.990 12.025 18.891 1.00 0.00 C ATOM 2347 CG PRO B 34 -10.335 11.366 18.778 1.00 0.00 C ATOM 2348 CD PRO B 34 -10.843 11.716 17.392 1.00 0.00 C ATOM 0 HA PRO B 34 -7.829 12.854 17.186 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -8.353 11.504 19.606 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -9.082 13.055 19.237 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -10.255 10.286 18.906 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -11.016 11.728 19.548 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -11.530 10.960 17.012 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -11.379 12.665 17.387 1.00 0.00 H new ATOM 2356 N THR B 35 -7.772 9.675 16.706 1.00 0.00 N ATOM 2357 CA THR B 35 -6.894 8.504 16.509 1.00 0.00 C ATOM 2358 C THR B 35 -6.881 8.010 15.030 1.00 0.00 C ATOM 2359 O THR B 35 -6.376 6.909 14.739 1.00 0.00 O ATOM 2360 CB THR B 35 -7.328 7.354 17.481 1.00 0.00 C ATOM 2361 OG1 THR B 35 -6.335 6.320 17.511 1.00 0.00 O ATOM 2362 CG2 THR B 35 -8.696 6.754 17.095 1.00 0.00 C ATOM 0 H THR B 35 -8.717 9.545 16.346 1.00 0.00 H new ATOM 0 HA THR B 35 -5.873 8.809 16.739 1.00 0.00 H new ATOM 0 HB THR B 35 -7.425 7.794 18.474 1.00 0.00 H new ATOM 0 HG1 THR B 35 -5.688 6.508 18.223 1.00 0.00 H new ATOM 0 HG21 THR B 35 -8.956 5.961 17.796 1.00 0.00 H new ATOM 0 HG22 THR B 35 -9.458 7.533 17.129 1.00 0.00 H new ATOM 0 HG23 THR B 35 -8.642 6.344 16.087 1.00 0.00 H new ATOM 2370 N PHE B 36 -7.414 8.822 14.094 1.00 0.00 N ATOM 2371 CA PHE B 36 -7.526 8.422 12.667 1.00 0.00 C ATOM 2372 C PHE B 36 -7.547 9.664 11.750 1.00 0.00 C ATOM 2373 O PHE B 36 -7.830 10.769 12.200 1.00 0.00 O ATOM 2374 CB PHE B 36 -8.815 7.560 12.463 1.00 0.00 C ATOM 2375 CG PHE B 36 -8.985 6.951 11.059 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -8.293 5.793 10.700 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -9.831 7.530 10.105 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -8.440 5.235 9.443 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -9.977 6.969 8.848 1.00 0.00 C ATOM 2380 CZ PHE B 36 -9.279 5.823 8.517 1.00 0.00 C ATOM 0 H PHE B 36 -7.773 9.755 14.294 1.00 0.00 H new ATOM 0 HA PHE B 36 -6.655 7.825 12.398 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -8.810 6.751 13.194 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -9.685 8.180 12.680 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -7.632 5.325 11.415 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -10.378 8.428 10.354 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -7.897 4.337 9.185 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -10.637 7.427 8.126 1.00 0.00 H new ATOM 0 HZ PHE B 36 -9.390 5.388 7.535 1.00 0.00 H new ATOM 2390 N SER B 37 -7.221 9.456 10.467 1.00 0.00 N ATOM 2391 CA SER B 37 -7.358 10.460 9.396 1.00 0.00 C ATOM 2392 C SER B 37 -7.545 9.749 8.046 1.00 0.00 C ATOM 2393 O SER B 37 -7.120 8.609 7.872 1.00 0.00 O ATOM 2394 CB SER B 37 -6.139 11.411 9.359 1.00 0.00 C ATOM 2395 OG SER B 37 -6.106 12.239 10.511 1.00 0.00 O ATOM 0 H SER B 37 -6.847 8.567 10.135 1.00 0.00 H new ATOM 0 HA SER B 37 -8.237 11.072 9.599 1.00 0.00 H new ATOM 0 HB2 SER B 37 -5.220 10.828 9.299 1.00 0.00 H new ATOM 0 HB3 SER B 37 -6.183 12.030 8.463 1.00 0.00 H new ATOM 0 HG SER B 37 -5.186 12.301 10.843 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.196 10.435 7.106 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.491 9.922 5.770 1.00 0.00 C ATOM 2403 C LEU B 38 -8.434 11.102 4.794 1.00 0.00 C ATOM 2404 O LEU B 38 -9.186 12.060 4.948 1.00 0.00 O ATOM 2405 CB LEU B 38 -9.871 9.199 5.783 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.395 8.573 4.442 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -11.241 9.559 3.621 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -9.245 8.013 3.590 1.00 0.00 C ATOM 0 H LEU B 38 -8.540 11.383 7.257 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.761 9.180 5.447 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -9.822 8.402 6.525 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.617 9.913 6.131 1.00 0.00 H new ATOM 0 HG LEU B 38 -11.045 7.746 4.729 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -11.577 9.074 2.704 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -12.107 9.870 4.206 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -10.640 10.433 3.370 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -9.647 7.588 2.670 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.549 8.816 3.345 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -8.722 7.237 4.149 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.587 10.984 3.767 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.503 11.940 2.643 1.00 0.00 C ATOM 2422 C PHE B 39 -7.553 11.151 1.320 1.00 0.00 C ATOM 2423 O PHE B 39 -6.936 10.094 1.188 1.00 0.00 O ATOM 2424 CB PHE B 39 -6.227 12.832 2.755 1.00 0.00 C ATOM 2425 CG PHE B 39 -4.972 12.108 3.243 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.174 11.366 2.373 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -4.593 12.168 4.584 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.053 10.710 2.834 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -3.473 11.512 5.030 1.00 0.00 C ATOM 2430 CZ PHE B 39 -2.701 10.783 4.158 1.00 0.00 C ATOM 0 H PHE B 39 -6.927 10.211 3.686 1.00 0.00 H new ATOM 0 HA PHE B 39 -8.351 12.624 2.673 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -6.020 13.267 1.777 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.438 13.658 3.434 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -4.437 11.305 1.327 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -5.189 12.738 5.281 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -2.448 10.135 2.149 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -3.197 11.569 6.073 1.00 0.00 H new ATOM 0 HZ PHE B 39 -1.820 10.269 4.514 1.00 0.00 H new ATOM 2440 N VAL B 40 -8.303 11.680 0.346 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.538 11.014 -0.947 1.00 0.00 C ATOM 2442 C VAL B 40 -7.844 11.825 -2.054 1.00 0.00 C ATOM 2443 O VAL B 40 -8.121 13.022 -2.214 1.00 0.00 O ATOM 2444 CB VAL B 40 -10.081 10.895 -1.265 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -10.338 10.015 -2.518 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -10.876 10.374 -0.043 1.00 0.00 C ATOM 0 H VAL B 40 -8.767 12.585 0.430 1.00 0.00 H new ATOM 0 HA VAL B 40 -8.130 10.005 -0.898 1.00 0.00 H new ATOM 0 HB VAL B 40 -10.442 11.899 -1.488 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.410 9.955 -2.707 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -9.841 10.458 -3.382 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -9.943 9.014 -2.346 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -11.933 10.305 -0.299 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -10.506 9.388 0.238 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -10.749 11.061 0.793 1.00 0.00 H new ATOM 2456 N LEU B 41 -6.953 11.170 -2.810 1.00 0.00 N ATOM 2457 CA LEU B 41 -6.028 11.856 -3.731 1.00 0.00 C ATOM 2458 C LEU B 41 -6.669 11.999 -5.122 1.00 0.00 C ATOM 2459 O LEU B 41 -7.436 11.128 -5.552 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.680 11.082 -3.796 1.00 0.00 C ATOM 2461 CG LEU B 41 -3.937 10.894 -2.420 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -2.604 10.135 -2.583 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -3.711 12.243 -1.705 1.00 0.00 C ATOM 0 H LEU B 41 -6.851 10.155 -2.803 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.823 12.860 -3.360 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -4.867 10.098 -4.225 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -4.013 11.606 -4.480 1.00 0.00 H new ATOM 0 HG LEU B 41 -4.590 10.286 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -2.125 10.028 -1.610 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -2.796 9.148 -3.004 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -1.947 10.692 -3.251 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -3.196 12.072 -0.760 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -3.105 12.892 -2.336 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -4.673 12.719 -1.513 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.308 13.089 -5.830 1.00 0.00 N ATOM 2476 CA ALA B 42 -6.913 13.476 -7.129 1.00 0.00 C ATOM 2477 C ALA B 42 -6.605 12.485 -8.274 1.00 0.00 C ATOM 2478 O ALA B 42 -7.161 12.605 -9.371 1.00 0.00 O ATOM 2479 CB ALA B 42 -6.442 14.889 -7.506 1.00 0.00 C ATOM 0 H ALA B 42 -5.582 13.733 -5.517 1.00 0.00 H new ATOM 0 HA ALA B 42 -7.995 13.455 -6.997 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -6.884 15.177 -8.460 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.752 15.594 -6.734 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.355 14.900 -7.592 1.00 0.00 H new ATOM 2485 N ASN B 43 -5.724 11.510 -8.008 1.00 0.00 N ATOM 2486 CA ASN B 43 -5.319 10.477 -8.989 1.00 0.00 C ATOM 2487 C ASN B 43 -6.342 9.321 -9.078 1.00 0.00 C ATOM 2488 O ASN B 43 -6.110 8.342 -9.795 1.00 0.00 O ATOM 2489 CB ASN B 43 -3.906 9.936 -8.630 1.00 0.00 C ATOM 2490 CG ASN B 43 -2.802 11.005 -8.688 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -3.033 12.186 -8.419 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -1.591 10.596 -9.037 1.00 0.00 N ATOM 0 H ASN B 43 -5.266 11.410 -7.102 1.00 0.00 H new ATOM 0 HA ASN B 43 -5.288 10.946 -9.973 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -3.934 9.509 -7.627 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.652 9.126 -9.314 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -0.822 11.264 -9.088 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -1.428 9.613 -9.254 1.00 0.00 H new ATOM 2499 N GLY B 44 -7.474 9.448 -8.353 1.00 0.00 N ATOM 2500 CA GLY B 44 -8.540 8.438 -8.369 1.00 0.00 C ATOM 2501 C GLY B 44 -8.338 7.356 -7.313 1.00 0.00 C ATOM 2502 O GLY B 44 -9.028 6.334 -7.322 1.00 0.00 O ATOM 0 H GLY B 44 -7.668 10.246 -7.748 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -9.501 8.926 -8.205 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -8.582 7.975 -9.355 1.00 0.00 H new ATOM 2506 N MET B 45 -7.396 7.600 -6.385 1.00 0.00 N ATOM 2507 CA MET B 45 -7.030 6.643 -5.327 1.00 0.00 C ATOM 2508 C MET B 45 -7.340 7.252 -3.952 1.00 0.00 C ATOM 2509 O MET B 45 -7.652 8.447 -3.848 1.00 0.00 O ATOM 2510 CB MET B 45 -5.528 6.255 -5.469 1.00 0.00 C ATOM 2511 CG MET B 45 -4.519 7.351 -5.077 1.00 0.00 C ATOM 2512 SD MET B 45 -4.234 7.428 -3.295 1.00 0.00 S ATOM 2513 CE MET B 45 -3.410 5.867 -2.972 1.00 0.00 C ATOM 0 H MET B 45 -6.865 8.470 -6.348 1.00 0.00 H new ATOM 0 HA MET B 45 -7.618 5.730 -5.425 1.00 0.00 H new ATOM 0 HB2 MET B 45 -5.339 5.375 -4.854 1.00 0.00 H new ATOM 0 HB3 MET B 45 -5.341 5.967 -6.504 1.00 0.00 H new ATOM 0 HG2 MET B 45 -3.572 7.167 -5.585 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.884 8.317 -5.425 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.707 5.990 -2.148 1.00 0.00 H new ATOM 0 HE2 MET B 45 -4.151 5.113 -2.707 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.871 5.549 -3.864 1.00 0.00 H new ATOM 2523 N LYS B 46 -7.223 6.436 -2.901 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.616 6.824 -1.543 1.00 0.00 C ATOM 2525 C LYS B 46 -6.529 6.377 -0.548 1.00 0.00 C ATOM 2526 O LYS B 46 -5.973 5.281 -0.693 1.00 0.00 O ATOM 2527 CB LYS B 46 -8.994 6.182 -1.250 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.704 6.690 0.011 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.122 6.101 0.144 1.00 0.00 C ATOM 2530 CE LYS B 46 -11.876 6.635 1.361 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.255 6.115 1.422 1.00 0.00 N ATOM 0 H LYS B 46 -6.853 5.488 -2.967 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.710 7.905 -1.442 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.645 6.354 -2.107 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.862 5.104 -1.162 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.117 6.426 0.890 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.763 7.778 -0.018 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.690 6.328 -0.758 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -11.054 5.015 0.213 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.342 6.357 2.270 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -11.899 7.724 1.325 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -13.859 6.792 1.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -13.619 5.984 0.457 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.260 5.203 1.921 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.223 7.224 0.456 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.088 6.989 1.378 1.00 0.00 C ATOM 2547 C LEU B 47 -5.501 7.328 2.838 1.00 0.00 C ATOM 2548 O LEU B 47 -5.945 8.439 3.134 1.00 0.00 O ATOM 2549 CB LEU B 47 -3.843 7.810 0.892 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.434 7.155 1.100 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.324 8.024 0.476 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.139 6.869 2.586 1.00 0.00 C ATOM 0 H LEU B 47 -6.745 8.078 0.651 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.809 5.935 1.370 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.967 8.016 -0.171 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.849 8.771 1.406 1.00 0.00 H new ATOM 0 HG LEU B 47 -2.449 6.194 0.585 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -0.357 7.547 0.634 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.505 8.132 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.325 9.008 0.946 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.152 6.416 2.680 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.165 7.802 3.148 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.891 6.186 2.981 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.346 6.335 3.738 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.718 6.449 5.153 1.00 0.00 C ATOM 2566 C GLY B 48 -4.521 6.686 6.057 1.00 0.00 C ATOM 2567 O GLY B 48 -3.367 6.527 5.646 1.00 0.00 O ATOM 0 H GLY B 48 -4.955 5.425 3.495 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.427 7.268 5.273 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.229 5.538 5.465 1.00 0.00 H new ATOM 2571 N LEU B 49 -4.823 7.026 7.317 1.00 0.00 N ATOM 2572 CA LEU B 49 -3.865 7.096 8.428 1.00 0.00 C ATOM 2573 C LEU B 49 -4.553 6.474 9.643 1.00 0.00 C ATOM 2574 O LEU B 49 -5.443 7.089 10.235 1.00 0.00 O ATOM 2575 CB LEU B 49 -3.439 8.562 8.746 1.00 0.00 C ATOM 2576 CG LEU B 49 -2.515 9.272 7.716 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -2.099 10.667 8.221 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -1.281 8.415 7.369 1.00 0.00 C ATOM 0 H LEU B 49 -5.773 7.268 7.600 1.00 0.00 H new ATOM 0 HA LEU B 49 -2.953 6.562 8.161 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -4.343 9.160 8.857 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.934 8.565 9.712 1.00 0.00 H new ATOM 0 HG LEU B 49 -3.087 9.400 6.797 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -1.453 11.143 7.483 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -2.988 11.279 8.374 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -1.561 10.567 9.164 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.661 8.946 6.647 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.703 8.226 8.274 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -1.605 7.467 6.941 1.00 0.00 H new ATOM 2590 N TRP B 50 -4.153 5.251 10.000 1.00 0.00 N ATOM 2591 CA TRP B 50 -4.737 4.513 11.131 1.00 0.00 C ATOM 2592 C TRP B 50 -3.663 4.337 12.217 1.00 0.00 C ATOM 2593 O TRP B 50 -2.541 3.900 11.929 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.274 3.146 10.632 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.227 2.425 11.567 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.099 2.230 12.906 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.445 1.763 11.199 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.153 1.518 13.389 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -7.981 1.199 12.361 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -8.122 1.595 10.000 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -9.157 0.468 12.362 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -9.295 0.876 9.999 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -9.802 0.313 11.172 1.00 0.00 C ATOM 0 H TRP B 50 -3.415 4.741 9.515 1.00 0.00 H new ATOM 0 HA TRP B 50 -5.574 5.065 11.560 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -5.780 3.303 9.679 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.423 2.493 10.438 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -5.275 2.590 13.504 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -7.298 1.265 14.366 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -7.736 2.020 9.085 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.548 0.037 13.272 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -9.834 0.744 9.073 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -10.720 -0.254 11.135 1.00 0.00 H new ATOM 2614 N SER B 51 -4.019 4.698 13.458 1.00 0.00 N ATOM 2615 CA SER B 51 -3.129 4.566 14.615 1.00 0.00 C ATOM 2616 C SER B 51 -3.084 3.110 15.129 1.00 0.00 C ATOM 2617 O SER B 51 -4.126 2.466 15.288 1.00 0.00 O ATOM 2618 CB SER B 51 -3.568 5.537 15.724 1.00 0.00 C ATOM 2619 OG SER B 51 -3.550 6.875 15.254 1.00 0.00 O ATOM 0 H SER B 51 -4.933 5.090 13.686 1.00 0.00 H new ATOM 0 HA SER B 51 -2.117 4.825 14.305 1.00 0.00 H new ATOM 0 HB2 SER B 51 -4.571 5.279 16.064 1.00 0.00 H new ATOM 0 HB3 SER B 51 -2.905 5.439 16.584 1.00 0.00 H new ATOM 0 HG SER B 51 -4.454 7.138 14.981 1.00 0.00 H new ATOM 2625 N ARG B 52 -1.872 2.611 15.410 1.00 0.00 N ATOM 2626 CA ARG B 52 -1.633 1.195 15.768 1.00 0.00 C ATOM 2627 C ARG B 52 -2.234 0.809 17.146 1.00 0.00 C ATOM 2628 O ARG B 52 -2.433 -0.377 17.427 1.00 0.00 O ATOM 2629 CB ARG B 52 -0.110 0.903 15.742 1.00 0.00 C ATOM 2630 CG ARG B 52 0.701 1.717 16.774 1.00 0.00 C ATOM 2631 CD ARG B 52 2.184 1.340 16.824 1.00 0.00 C ATOM 2632 NE ARG B 52 2.887 2.112 17.870 1.00 0.00 N ATOM 2633 CZ ARG B 52 3.548 1.591 18.914 1.00 0.00 C ATOM 2634 NH1 ARG B 52 3.642 0.275 19.081 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.114 2.400 19.793 1.00 0.00 N ATOM 0 H ARG B 52 -1.023 3.176 15.397 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.144 0.582 15.026 1.00 0.00 H new ATOM 0 HB2 ARG B 52 0.049 -0.160 15.926 1.00 0.00 H new ATOM 0 HB3 ARG B 52 0.274 1.115 14.744 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.612 2.778 16.538 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.265 1.572 17.762 1.00 0.00 H new ATOM 0 HD2 ARG B 52 2.286 0.273 17.023 1.00 0.00 H new ATOM 0 HD3 ARG B 52 2.645 1.529 15.854 1.00 0.00 H new ATOM 0 HE ARG B 52 2.868 3.129 17.791 1.00 0.00 H new ATOM 0 HH11 ARG B 52 3.207 -0.357 18.409 1.00 0.00 H new ATOM 0 HH12 ARG B 52 4.149 -0.103 19.881 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.046 3.411 19.674 1.00 0.00 H new ATOM 0 HH22 ARG B 52 4.619 2.014 20.591 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.518 1.817 17.999 1.00 0.00 N ATOM 2650 CA HIS B 53 -3.100 1.584 19.340 1.00 0.00 C ATOM 2651 C HIS B 53 -4.624 1.332 19.255 1.00 0.00 C ATOM 2652 O HIS B 53 -5.241 0.960 20.256 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.794 2.769 20.308 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.636 4.014 20.119 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.867 4.165 20.715 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -3.421 5.163 19.430 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -5.371 5.338 20.398 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -4.514 5.964 19.625 1.00 0.00 N ATOM 0 H HIS B 53 -2.354 2.800 17.783 1.00 0.00 H new ATOM 0 HA HIS B 53 -2.630 0.688 19.745 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.924 2.419 21.332 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.745 3.043 20.195 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -5.320 3.473 21.312 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -2.550 5.401 18.838 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -6.328 5.721 20.719 1.00 0.00 H new ATOM 2667 N THR B 54 -5.227 1.542 18.063 1.00 0.00 N ATOM 2668 CA THR B 54 -6.682 1.371 17.854 1.00 0.00 C ATOM 2669 C THR B 54 -6.972 0.468 16.634 1.00 0.00 C ATOM 2670 O THR B 54 -8.133 0.329 16.223 1.00 0.00 O ATOM 2671 CB THR B 54 -7.390 2.768 17.690 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.822 2.637 17.794 1.00 0.00 O ATOM 2673 CG2 THR B 54 -7.049 3.443 16.345 1.00 0.00 C ATOM 0 H THR B 54 -4.723 1.833 17.225 1.00 0.00 H new ATOM 0 HA THR B 54 -7.088 0.880 18.738 1.00 0.00 H new ATOM 0 HB THR B 54 -7.015 3.396 18.498 1.00 0.00 H new ATOM 0 HG1 THR B 54 -9.114 1.842 17.301 1.00 0.00 H new ATOM 0 HG21 THR B 54 -7.561 4.403 16.280 1.00 0.00 H new ATOM 0 HG22 THR B 54 -5.972 3.601 16.280 1.00 0.00 H new ATOM 0 HG23 THR B 54 -7.372 2.803 15.524 1.00 0.00 H new ATOM 2681 N VAL B 55 -5.917 -0.144 16.051 1.00 0.00 N ATOM 2682 CA VAL B 55 -6.070 -1.041 14.888 1.00 0.00 C ATOM 2683 C VAL B 55 -6.773 -2.342 15.315 1.00 0.00 C ATOM 2684 O VAL B 55 -6.639 -2.779 16.467 1.00 0.00 O ATOM 2685 CB VAL B 55 -4.689 -1.333 14.181 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -3.729 -2.146 15.080 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -4.890 -2.013 12.800 1.00 0.00 C ATOM 0 H VAL B 55 -4.954 -0.032 16.367 1.00 0.00 H new ATOM 0 HA VAL B 55 -6.693 -0.536 14.150 1.00 0.00 H new ATOM 0 HB VAL B 55 -4.214 -0.367 14.008 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.793 -2.321 14.549 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -3.528 -1.589 15.995 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -4.188 -3.102 15.331 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -3.919 -2.199 12.341 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -5.416 -2.958 12.933 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -5.476 -1.359 12.154 1.00 0.00 H new ATOM 2697 N GLU B 56 -7.568 -2.920 14.402 1.00 0.00 N ATOM 2698 CA GLU B 56 -8.302 -4.171 14.646 1.00 0.00 C ATOM 2699 C GLU B 56 -8.031 -5.175 13.505 1.00 0.00 C ATOM 2700 O GLU B 56 -8.419 -4.911 12.366 1.00 0.00 O ATOM 2701 CB GLU B 56 -9.815 -3.886 14.856 1.00 0.00 C ATOM 2702 CG GLU B 56 -10.125 -3.370 16.286 1.00 0.00 C ATOM 2703 CD GLU B 56 -11.605 -3.427 16.681 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -12.224 -4.501 16.522 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -12.144 -2.423 17.185 1.00 0.00 O ATOM 0 H GLU B 56 -7.720 -2.532 13.471 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.944 -4.630 15.567 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.148 -3.148 14.126 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -10.383 -4.797 14.670 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -9.549 -3.957 17.002 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -9.781 -2.339 16.368 1.00 0.00 H new ATOM 2712 N PRO B 57 -7.337 -6.345 13.776 1.00 0.00 N ATOM 2713 CA PRO B 57 -6.849 -6.759 15.124 1.00 0.00 C ATOM 2714 C PRO B 57 -5.632 -5.936 15.612 1.00 0.00 C ATOM 2715 O PRO B 57 -4.787 -5.514 14.808 1.00 0.00 O ATOM 2716 CB PRO B 57 -6.479 -8.247 14.914 1.00 0.00 C ATOM 2717 CG PRO B 57 -6.060 -8.317 13.479 1.00 0.00 C ATOM 2718 CD PRO B 57 -6.976 -7.359 12.751 1.00 0.00 C ATOM 0 HA PRO B 57 -7.597 -6.596 15.900 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.674 -8.556 15.580 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.327 -8.901 15.114 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.015 -8.030 13.359 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -6.159 -9.330 13.089 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -6.476 -6.901 11.898 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.860 -7.868 12.367 1.00 0.00 H new ATOM 2726 N LYS B 58 -5.612 -5.673 16.937 1.00 0.00 N ATOM 2727 CA LYS B 58 -4.539 -4.927 17.614 1.00 0.00 C ATOM 2728 C LYS B 58 -3.160 -5.541 17.283 1.00 0.00 C ATOM 2729 O LYS B 58 -2.939 -6.735 17.489 1.00 0.00 O ATOM 2730 CB LYS B 58 -4.782 -4.890 19.162 1.00 0.00 C ATOM 2731 CG LYS B 58 -4.364 -3.568 19.883 1.00 0.00 C ATOM 2732 CD LYS B 58 -2.861 -3.204 19.753 1.00 0.00 C ATOM 2733 CE LYS B 58 -1.921 -4.274 20.348 1.00 0.00 C ATOM 2734 NZ LYS B 58 -2.141 -4.474 21.800 1.00 0.00 N ATOM 0 H LYS B 58 -6.351 -5.978 17.570 1.00 0.00 H new ATOM 0 HA LYS B 58 -4.549 -3.900 17.248 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -5.842 -5.065 19.349 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -4.237 -5.718 19.616 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -4.958 -2.748 19.481 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -4.613 -3.653 20.941 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -2.618 -3.062 18.700 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -2.680 -2.252 20.253 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -2.074 -5.219 19.826 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -0.885 -3.980 20.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -1.453 -5.164 22.164 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -2.019 -3.569 22.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -3.105 -4.830 21.959 1.00 0.00 H new ATOM 2748 N ALA B 59 -2.258 -4.685 16.795 1.00 0.00 N ATOM 2749 CA ALA B 59 -0.900 -5.054 16.390 1.00 0.00 C ATOM 2750 C ALA B 59 0.071 -3.918 16.739 1.00 0.00 C ATOM 2751 O ALA B 59 -0.334 -2.752 16.856 1.00 0.00 O ATOM 2752 CB ALA B 59 -0.868 -5.362 14.883 1.00 0.00 C ATOM 0 H ALA B 59 -2.457 -3.693 16.668 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.590 -5.950 16.928 1.00 0.00 H new ATOM 0 HB1 ALA B 59 0.145 -5.636 14.589 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -1.545 -6.189 14.666 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -1.182 -4.480 14.325 1.00 0.00 H new ATOM 2758 N SER B 60 1.355 -4.270 16.901 1.00 0.00 N ATOM 2759 CA SER B 60 2.426 -3.316 17.223 1.00 0.00 C ATOM 2760 C SER B 60 3.617 -3.570 16.293 1.00 0.00 C ATOM 2761 O SER B 60 4.448 -4.452 16.554 1.00 0.00 O ATOM 2762 CB SER B 60 2.837 -3.446 18.711 1.00 0.00 C ATOM 2763 OG SER B 60 1.739 -3.202 19.577 1.00 0.00 O ATOM 0 H SER B 60 1.682 -5.232 16.811 1.00 0.00 H new ATOM 0 HA SER B 60 2.070 -2.297 17.070 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.232 -4.445 18.895 1.00 0.00 H new ATOM 0 HB3 SER B 60 3.639 -2.741 18.931 1.00 0.00 H new ATOM 0 HG SER B 60 2.030 -3.293 20.508 1.00 0.00 H new ATOM 2769 N VAL B 61 3.639 -2.841 15.161 1.00 0.00 N ATOM 2770 CA VAL B 61 4.731 -2.881 14.165 1.00 0.00 C ATOM 2771 C VAL B 61 4.963 -1.454 13.634 1.00 0.00 C ATOM 2772 O VAL B 61 4.016 -0.803 13.184 1.00 0.00 O ATOM 2773 CB VAL B 61 4.427 -3.866 12.956 1.00 0.00 C ATOM 2774 CG1 VAL B 61 5.528 -3.783 11.856 1.00 0.00 C ATOM 2775 CG2 VAL B 61 4.261 -5.332 13.438 1.00 0.00 C ATOM 0 H VAL B 61 2.889 -2.198 14.907 1.00 0.00 H new ATOM 0 HA VAL B 61 5.624 -3.263 14.660 1.00 0.00 H new ATOM 0 HB VAL B 61 3.482 -3.542 12.519 1.00 0.00 H new ATOM 0 HG11 VAL B 61 5.285 -4.471 11.046 1.00 0.00 H new ATOM 0 HG12 VAL B 61 5.577 -2.766 11.466 1.00 0.00 H new ATOM 0 HG13 VAL B 61 6.493 -4.054 12.285 1.00 0.00 H new ATOM 0 HG21 VAL B 61 4.054 -5.975 12.583 1.00 0.00 H new ATOM 0 HG22 VAL B 61 5.179 -5.661 13.926 1.00 0.00 H new ATOM 0 HG23 VAL B 61 3.433 -5.391 14.145 1.00 0.00 H new ATOM 2785 N THR B 62 6.213 -0.973 13.722 1.00 0.00 N ATOM 2786 CA THR B 62 6.628 0.342 13.190 1.00 0.00 C ATOM 2787 C THR B 62 8.018 0.212 12.548 1.00 0.00 C ATOM 2788 O THR B 62 8.874 -0.519 13.060 1.00 0.00 O ATOM 2789 CB THR B 62 6.637 1.453 14.306 1.00 0.00 C ATOM 2790 OG1 THR B 62 7.231 0.932 15.510 1.00 0.00 O ATOM 2791 CG2 THR B 62 5.226 1.994 14.620 1.00 0.00 C ATOM 0 H THR B 62 6.973 -1.487 14.167 1.00 0.00 H new ATOM 0 HA THR B 62 5.902 0.652 12.439 1.00 0.00 H new ATOM 0 HB THR B 62 7.226 2.286 13.922 1.00 0.00 H new ATOM 0 HG1 THR B 62 7.236 1.628 16.200 1.00 0.00 H new ATOM 0 HG21 THR B 62 5.293 2.757 15.396 1.00 0.00 H new ATOM 0 HG22 THR B 62 4.795 2.430 13.719 1.00 0.00 H new ATOM 0 HG23 THR B 62 4.592 1.178 14.967 1.00 0.00 H new ATOM 2799 N GLY B 63 8.222 0.916 11.421 1.00 0.00 N ATOM 2800 CA GLY B 63 9.472 0.840 10.655 1.00 0.00 C ATOM 2801 C GLY B 63 9.578 -0.446 9.842 1.00 0.00 C ATOM 2802 O GLY B 63 10.682 -0.874 9.486 1.00 0.00 O ATOM 0 H GLY B 63 7.529 1.548 11.020 1.00 0.00 H new ATOM 0 HA2 GLY B 63 9.537 1.697 9.985 1.00 0.00 H new ATOM 0 HA3 GLY B 63 10.318 0.905 11.339 1.00 0.00 H new ATOM 2806 N GLY B 64 8.413 -1.035 9.521 1.00 0.00 N ATOM 2807 CA GLY B 64 8.346 -2.287 8.788 1.00 0.00 C ATOM 2808 C GLY B 64 6.973 -2.516 8.173 1.00 0.00 C ATOM 2809 O GLY B 64 5.949 -2.223 8.799 1.00 0.00 O ATOM 0 H GLY B 64 7.501 -0.649 9.766 1.00 0.00 H new ATOM 0 HA2 GLY B 64 9.100 -2.287 8.001 1.00 0.00 H new ATOM 0 HA3 GLY B 64 8.585 -3.113 9.458 1.00 0.00 H new ATOM 2813 N GLY B 65 6.964 -3.027 6.935 1.00 0.00 N ATOM 2814 CA GLY B 65 5.743 -3.336 6.204 1.00 0.00 C ATOM 2815 C GLY B 65 5.922 -3.114 4.715 1.00 0.00 C ATOM 2816 O GLY B 65 7.046 -3.170 4.213 1.00 0.00 O ATOM 0 H GLY B 65 7.815 -3.237 6.414 1.00 0.00 H new ATOM 0 HA2 GLY B 65 5.459 -4.372 6.388 1.00 0.00 H new ATOM 0 HA3 GLY B 65 4.929 -2.712 6.572 1.00 0.00 H new ATOM 2820 N GLY B 66 4.802 -2.862 4.010 1.00 0.00 N ATOM 2821 CA GLY B 66 4.820 -2.582 2.569 1.00 0.00 C ATOM 2822 C GLY B 66 5.267 -1.167 2.270 1.00 0.00 C ATOM 2823 O GLY B 66 5.362 -0.336 3.183 1.00 0.00 O ATOM 0 H GLY B 66 3.869 -2.848 4.423 1.00 0.00 H new ATOM 0 HA2 GLY B 66 5.488 -3.285 2.072 1.00 0.00 H new ATOM 0 HA3 GLY B 66 3.824 -2.742 2.156 1.00 0.00 H new ATOM 2827 N GLU B 67 5.462 -0.863 0.985 1.00 0.00 N ATOM 2828 CA GLU B 67 6.030 0.419 0.545 1.00 0.00 C ATOM 2829 C GLU B 67 4.886 1.336 0.098 1.00 0.00 C ATOM 2830 O GLU B 67 3.845 0.853 -0.375 1.00 0.00 O ATOM 2831 CB GLU B 67 6.993 0.198 -0.665 1.00 0.00 C ATOM 2832 CG GLU B 67 7.939 -1.023 -0.573 1.00 0.00 C ATOM 2833 CD GLU B 67 9.126 -0.856 0.391 1.00 0.00 C ATOM 2834 OE1 GLU B 67 10.056 -0.070 0.072 1.00 0.00 O ATOM 2835 OE2 GLU B 67 9.146 -1.505 1.464 1.00 0.00 O ATOM 0 H GLU B 67 5.232 -1.496 0.219 1.00 0.00 H new ATOM 0 HA GLU B 67 6.585 0.866 1.370 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.391 0.097 -1.568 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.602 1.094 -0.786 1.00 0.00 H new ATOM 0 HG2 GLU B 67 7.358 -1.891 -0.262 1.00 0.00 H new ATOM 0 HG3 GLU B 67 8.327 -1.239 -1.569 1.00 0.00 H new ATOM 2842 N LEU B 68 5.075 2.656 0.227 1.00 0.00 N ATOM 2843 CA LEU B 68 4.144 3.634 -0.335 1.00 0.00 C ATOM 2844 C LEU B 68 4.854 4.313 -1.501 1.00 0.00 C ATOM 2845 O LEU B 68 5.709 5.170 -1.271 1.00 0.00 O ATOM 2846 CB LEU B 68 3.669 4.673 0.713 1.00 0.00 C ATOM 2847 CG LEU B 68 2.594 5.679 0.188 1.00 0.00 C ATOM 2848 CD1 LEU B 68 1.278 4.962 -0.205 1.00 0.00 C ATOM 2849 CD2 LEU B 68 2.346 6.815 1.195 1.00 0.00 C ATOM 0 H LEU B 68 5.868 3.069 0.718 1.00 0.00 H new ATOM 0 HA LEU B 68 3.240 3.126 -0.671 1.00 0.00 H new ATOM 0 HB2 LEU B 68 3.262 4.142 1.573 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.533 5.236 1.066 1.00 0.00 H new ATOM 0 HG LEU B 68 2.992 6.132 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.557 5.696 -0.565 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.480 4.236 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.869 4.449 0.665 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.593 7.496 0.797 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.994 6.395 2.138 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.275 7.360 1.365 1.00 0.00 H new ATOM 2861 N ALA B 69 4.553 3.917 -2.735 1.00 0.00 N ATOM 2862 CA ALA B 69 5.359 4.314 -3.895 1.00 0.00 C ATOM 2863 C ALA B 69 4.930 5.693 -4.440 1.00 0.00 C ATOM 2864 O ALA B 69 3.816 5.857 -4.949 1.00 0.00 O ATOM 2865 CB ALA B 69 5.315 3.230 -4.974 1.00 0.00 C ATOM 0 H ALA B 69 3.757 3.321 -2.962 1.00 0.00 H new ATOM 0 HA ALA B 69 6.395 4.418 -3.571 1.00 0.00 H new ATOM 0 HB1 ALA B 69 5.918 3.541 -5.827 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.711 2.298 -4.570 1.00 0.00 H new ATOM 0 HB3 ALA B 69 4.284 3.077 -5.295 1.00 0.00 H new ATOM 2871 N PHE B 70 5.847 6.671 -4.318 1.00 0.00 N ATOM 2872 CA PHE B 70 5.667 8.046 -4.790 1.00 0.00 C ATOM 2873 C PHE B 70 6.258 8.137 -6.204 1.00 0.00 C ATOM 2874 O PHE B 70 7.481 8.098 -6.377 1.00 0.00 O ATOM 2875 CB PHE B 70 6.411 9.033 -3.845 1.00 0.00 C ATOM 2876 CG PHE B 70 5.789 9.222 -2.467 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.872 8.227 -1.502 1.00 0.00 C ATOM 2878 CD2 PHE B 70 5.137 10.406 -2.133 1.00 0.00 C ATOM 2879 CE1 PHE B 70 5.325 8.410 -0.250 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.594 10.585 -0.884 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.685 9.587 0.062 1.00 0.00 C ATOM 0 H PHE B 70 6.754 6.517 -3.877 1.00 0.00 H new ATOM 0 HA PHE B 70 4.609 8.309 -4.799 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.435 8.682 -3.716 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.466 10.005 -4.335 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.371 7.298 -1.735 1.00 0.00 H new ATOM 0 HD2 PHE B 70 5.057 11.195 -2.866 1.00 0.00 H new ATOM 0 HE1 PHE B 70 5.399 7.626 0.489 1.00 0.00 H new ATOM 0 HE2 PHE B 70 4.094 11.511 -0.642 1.00 0.00 H new ATOM 0 HZ PHE B 70 4.256 9.728 1.043 1.00 0.00 H new ATOM 2891 N ARG B 71 5.383 8.215 -7.207 1.00 0.00 N ATOM 2892 CA ARG B 71 5.792 8.208 -8.618 1.00 0.00 C ATOM 2893 C ARG B 71 6.036 9.624 -9.149 1.00 0.00 C ATOM 2894 O ARG B 71 5.228 10.533 -8.938 1.00 0.00 O ATOM 2895 CB ARG B 71 4.705 7.545 -9.497 1.00 0.00 C ATOM 2896 CG ARG B 71 4.270 6.133 -9.068 1.00 0.00 C ATOM 2897 CD ARG B 71 3.472 5.438 -10.175 1.00 0.00 C ATOM 2898 NE ARG B 71 2.272 6.204 -10.567 1.00 0.00 N ATOM 2899 CZ ARG B 71 1.817 6.364 -11.820 1.00 0.00 C ATOM 2900 NH1 ARG B 71 2.473 5.853 -12.855 1.00 0.00 N ATOM 2901 NH2 ARG B 71 0.707 7.056 -12.025 1.00 0.00 N ATOM 0 H ARG B 71 4.375 8.285 -7.069 1.00 0.00 H new ATOM 0 HA ARG B 71 6.722 7.642 -8.670 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.826 8.190 -9.504 1.00 0.00 H new ATOM 0 HB3 ARG B 71 5.072 7.496 -10.522 1.00 0.00 H new ATOM 0 HG2 ARG B 71 5.149 5.538 -8.822 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.664 6.195 -8.164 1.00 0.00 H new ATOM 0 HD2 ARG B 71 4.111 5.297 -11.047 1.00 0.00 H new ATOM 0 HD3 ARG B 71 3.172 4.446 -9.836 1.00 0.00 H new ATOM 0 HE ARG B 71 1.742 6.651 -9.819 1.00 0.00 H new ATOM 0 HH11 ARG B 71 3.336 5.330 -12.704 1.00 0.00 H new ATOM 0 HH12 ARG B 71 2.114 5.983 -13.801 1.00 0.00 H new ATOM 0 HH21 ARG B 71 0.206 7.462 -11.235 1.00 0.00 H new ATOM 0 HH22 ARG B 71 0.353 7.183 -12.973 1.00 0.00 H new ATOM 2915 N VAL B 72 7.197 9.790 -9.807 1.00 0.00 N ATOM 2916 CA VAL B 72 7.596 11.036 -10.496 1.00 0.00 C ATOM 2917 C VAL B 72 8.151 10.724 -11.899 1.00 0.00 C ATOM 2918 O VAL B 72 8.468 9.567 -12.225 1.00 0.00 O ATOM 2919 CB VAL B 72 8.684 11.865 -9.705 1.00 0.00 C ATOM 2920 CG1 VAL B 72 8.144 12.433 -8.374 1.00 0.00 C ATOM 2921 CG2 VAL B 72 9.972 11.052 -9.477 1.00 0.00 C ATOM 0 H VAL B 72 7.897 9.052 -9.878 1.00 0.00 H new ATOM 0 HA VAL B 72 6.691 11.641 -10.561 1.00 0.00 H new ATOM 0 HB VAL B 72 8.935 12.716 -10.338 1.00 0.00 H new ATOM 0 HG11 VAL B 72 8.932 12.994 -7.871 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.301 13.094 -8.576 1.00 0.00 H new ATOM 0 HG13 VAL B 72 7.817 11.613 -7.734 1.00 0.00 H new ATOM 0 HG21 VAL B 72 10.693 11.659 -8.930 1.00 0.00 H new ATOM 0 HG22 VAL B 72 9.740 10.157 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.396 10.764 -10.439 1.00 0.00 H new ATOM 2931 N GLU B 73 8.254 11.788 -12.714 1.00 0.00 N ATOM 2932 CA GLU B 73 8.668 11.706 -14.126 1.00 0.00 C ATOM 2933 C GLU B 73 10.157 11.327 -14.312 1.00 0.00 C ATOM 2934 O GLU B 73 10.467 10.475 -15.151 1.00 0.00 O ATOM 2935 CB GLU B 73 8.338 13.046 -14.845 1.00 0.00 C ATOM 2936 CG GLU B 73 8.968 14.276 -14.175 1.00 0.00 C ATOM 2937 CD GLU B 73 8.554 15.620 -14.787 1.00 0.00 C ATOM 2938 OE1 GLU B 73 7.484 16.141 -14.407 1.00 0.00 O ATOM 2939 OE2 GLU B 73 9.299 16.160 -15.626 1.00 0.00 O ATOM 0 H GLU B 73 8.050 12.739 -12.408 1.00 0.00 H new ATOM 0 HA GLU B 73 8.101 10.894 -14.580 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.683 12.989 -15.877 1.00 0.00 H new ATOM 0 HB3 GLU B 73 7.256 13.174 -14.877 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.700 14.275 -13.119 1.00 0.00 H new ATOM 0 HG3 GLU B 73 10.053 14.186 -14.228 1.00 0.00 H new ATOM 2946 N ASN B 74 11.089 11.931 -13.527 1.00 0.00 N ATOM 2947 CA ASN B 74 12.540 11.693 -13.730 1.00 0.00 C ATOM 2948 C ASN B 74 13.364 11.935 -12.457 1.00 0.00 C ATOM 2949 O ASN B 74 12.834 12.326 -11.411 1.00 0.00 O ATOM 2950 CB ASN B 74 13.094 12.566 -14.897 1.00 0.00 C ATOM 2951 CG ASN B 74 13.175 14.052 -14.563 1.00 0.00 C ATOM 2952 OD1 ASN B 74 14.169 14.527 -14.012 1.00 0.00 O ATOM 2953 ND2 ASN B 74 12.150 14.797 -14.908 1.00 0.00 N ATOM 0 H ASN B 74 10.867 12.572 -12.765 1.00 0.00 H new ATOM 0 HA ASN B 74 12.643 10.640 -13.991 1.00 0.00 H new ATOM 0 HB2 ASN B 74 14.088 12.208 -15.167 1.00 0.00 H new ATOM 0 HB3 ASN B 74 12.458 12.433 -15.772 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.162 15.800 -14.721 1.00 0.00 H new ATOM 0 HD22 ASN B 74 11.342 14.373 -15.363 1.00 0.00 H new ATOM 2960 N ASP B 75 14.679 11.689 -12.600 1.00 0.00 N ATOM 2961 CA ASP B 75 15.662 11.580 -11.501 1.00 0.00 C ATOM 2962 C ASP B 75 15.727 12.848 -10.640 1.00 0.00 C ATOM 2963 O ASP B 75 15.964 12.781 -9.426 1.00 0.00 O ATOM 2964 CB ASP B 75 17.058 11.251 -12.092 1.00 0.00 C ATOM 2965 CG ASP B 75 17.567 12.335 -13.071 1.00 0.00 C ATOM 2966 OD1 ASP B 75 17.086 12.384 -14.226 1.00 0.00 O ATOM 2967 OD2 ASP B 75 18.438 13.147 -12.686 1.00 0.00 O ATOM 0 H ASP B 75 15.104 11.555 -13.517 1.00 0.00 H new ATOM 0 HA ASP B 75 15.337 10.775 -10.842 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.774 11.138 -11.278 1.00 0.00 H new ATOM 0 HB3 ASP B 75 17.011 10.293 -12.610 1.00 0.00 H new ATOM 2972 N ALA B 76 15.517 13.997 -11.293 1.00 0.00 N ATOM 2973 CA ALA B 76 15.597 15.306 -10.651 1.00 0.00 C ATOM 2974 C ALA B 76 14.432 15.503 -9.675 1.00 0.00 C ATOM 2975 O ALA B 76 14.626 15.971 -8.562 1.00 0.00 O ATOM 2976 CB ALA B 76 15.615 16.420 -11.707 1.00 0.00 C ATOM 0 H ALA B 76 15.286 14.041 -12.286 1.00 0.00 H new ATOM 0 HA ALA B 76 16.526 15.355 -10.083 1.00 0.00 H new ATOM 0 HB1 ALA B 76 15.675 17.389 -11.212 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.480 16.291 -12.358 1.00 0.00 H new ATOM 0 HB3 ALA B 76 14.703 16.372 -12.302 1.00 0.00 H new ATOM 2982 N GLN B 77 13.227 15.083 -10.109 1.00 0.00 N ATOM 2983 CA GLN B 77 11.996 15.155 -9.301 1.00 0.00 C ATOM 2984 C GLN B 77 12.053 14.242 -8.056 1.00 0.00 C ATOM 2985 O GLN B 77 11.368 14.497 -7.068 1.00 0.00 O ATOM 2986 CB GLN B 77 10.777 14.764 -10.171 1.00 0.00 C ATOM 2987 CG GLN B 77 10.518 15.673 -11.382 1.00 0.00 C ATOM 2988 CD GLN B 77 10.000 17.067 -11.029 1.00 0.00 C ATOM 2989 OE1 GLN B 77 9.330 17.261 -10.014 1.00 0.00 O ATOM 2990 NE2 GLN B 77 10.263 18.039 -11.889 1.00 0.00 N ATOM 0 H GLN B 77 13.081 14.682 -11.036 1.00 0.00 H new ATOM 0 HA GLN B 77 11.899 16.183 -8.951 1.00 0.00 H new ATOM 0 HB2 GLN B 77 10.917 13.743 -10.527 1.00 0.00 H new ATOM 0 HB3 GLN B 77 9.887 14.763 -9.541 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.444 15.776 -11.948 1.00 0.00 H new ATOM 0 HG3 GLN B 77 9.796 15.186 -12.038 1.00 0.00 H new ATOM 0 HE21 GLN B 77 10.821 17.847 -12.721 1.00 0.00 H new ATOM 0 HE22 GLN B 77 9.908 18.980 -11.720 1.00 0.00 H new ATOM 2999 N VAL B 78 12.897 13.190 -8.123 1.00 0.00 N ATOM 3000 CA VAL B 78 13.189 12.310 -6.967 1.00 0.00 C ATOM 3001 C VAL B 78 14.031 13.072 -5.923 1.00 0.00 C ATOM 3002 O VAL B 78 13.808 12.963 -4.717 1.00 0.00 O ATOM 3003 CB VAL B 78 13.973 11.009 -7.398 1.00 0.00 C ATOM 3004 CG1 VAL B 78 14.290 10.086 -6.193 1.00 0.00 C ATOM 3005 CG2 VAL B 78 13.215 10.234 -8.486 1.00 0.00 C ATOM 0 H VAL B 78 13.393 12.926 -8.974 1.00 0.00 H new ATOM 0 HA VAL B 78 12.231 12.011 -6.541 1.00 0.00 H new ATOM 0 HB VAL B 78 14.924 11.343 -7.812 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.830 9.205 -6.541 1.00 0.00 H new ATOM 0 HG12 VAL B 78 14.904 10.626 -5.472 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.360 9.777 -5.717 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.781 9.344 -8.760 1.00 0.00 H new ATOM 0 HG22 VAL B 78 12.236 9.939 -8.108 1.00 0.00 H new ATOM 0 HG23 VAL B 78 13.088 10.868 -9.363 1.00 0.00 H new ATOM 3015 N ASP B 79 14.997 13.860 -6.443 1.00 0.00 N ATOM 3016 CA ASP B 79 15.932 14.670 -5.642 1.00 0.00 C ATOM 3017 C ASP B 79 15.227 15.897 -5.029 1.00 0.00 C ATOM 3018 O ASP B 79 15.601 16.357 -3.944 1.00 0.00 O ATOM 3019 CB ASP B 79 17.127 15.101 -6.540 1.00 0.00 C ATOM 3020 CG ASP B 79 18.122 16.056 -5.848 1.00 0.00 C ATOM 3021 OD1 ASP B 79 18.810 15.630 -4.899 1.00 0.00 O ATOM 3022 OD2 ASP B 79 18.226 17.232 -6.257 1.00 0.00 O ATOM 0 H ASP B 79 15.149 13.950 -7.448 1.00 0.00 H new ATOM 0 HA ASP B 79 16.303 14.069 -4.812 1.00 0.00 H new ATOM 0 HB2 ASP B 79 17.663 14.209 -6.866 1.00 0.00 H new ATOM 0 HB3 ASP B 79 16.738 15.585 -7.436 1.00 0.00 H new ATOM 3027 N GLU B 80 14.200 16.410 -5.733 1.00 0.00 N ATOM 3028 CA GLU B 80 13.365 17.515 -5.230 1.00 0.00 C ATOM 3029 C GLU B 80 12.541 17.021 -4.033 1.00 0.00 C ATOM 3030 O GLU B 80 12.417 17.699 -3.004 1.00 0.00 O ATOM 3031 CB GLU B 80 12.448 18.077 -6.344 1.00 0.00 C ATOM 3032 CG GLU B 80 13.204 18.559 -7.600 1.00 0.00 C ATOM 3033 CD GLU B 80 12.418 19.591 -8.423 1.00 0.00 C ATOM 3034 OE1 GLU B 80 11.501 19.200 -9.160 1.00 0.00 O ATOM 3035 OE2 GLU B 80 12.717 20.800 -8.332 1.00 0.00 O ATOM 0 H GLU B 80 13.928 16.074 -6.657 1.00 0.00 H new ATOM 0 HA GLU B 80 14.012 18.330 -4.907 1.00 0.00 H new ATOM 0 HB2 GLU B 80 11.735 17.306 -6.636 1.00 0.00 H new ATOM 0 HB3 GLU B 80 11.871 18.908 -5.939 1.00 0.00 H new ATOM 0 HG2 GLU B 80 14.156 18.995 -7.298 1.00 0.00 H new ATOM 0 HG3 GLU B 80 13.432 17.700 -8.230 1.00 0.00 H new ATOM 3042 N THR B 81 12.002 15.801 -4.206 1.00 0.00 N ATOM 3043 CA THR B 81 11.250 15.092 -3.172 1.00 0.00 C ATOM 3044 C THR B 81 12.175 14.751 -1.977 1.00 0.00 C ATOM 3045 O THR B 81 11.762 14.865 -0.821 1.00 0.00 O ATOM 3046 CB THR B 81 10.597 13.800 -3.764 1.00 0.00 C ATOM 3047 OG1 THR B 81 9.743 14.144 -4.869 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.774 13.031 -2.729 1.00 0.00 C ATOM 0 H THR B 81 12.081 15.280 -5.079 1.00 0.00 H new ATOM 0 HA THR B 81 10.451 15.738 -2.810 1.00 0.00 H new ATOM 0 HB THR B 81 11.414 13.157 -4.092 1.00 0.00 H new ATOM 0 HG1 THR B 81 10.287 14.280 -5.673 1.00 0.00 H new ATOM 0 HG21 THR B 81 9.343 12.144 -3.193 1.00 0.00 H new ATOM 0 HG22 THR B 81 10.418 12.732 -1.902 1.00 0.00 H new ATOM 0 HG23 THR B 81 8.974 13.669 -2.354 1.00 0.00 H new ATOM 3056 N PHE B 82 13.444 14.392 -2.284 1.00 0.00 N ATOM 3057 CA PHE B 82 14.474 14.071 -1.274 1.00 0.00 C ATOM 3058 C PHE B 82 14.674 15.279 -0.341 1.00 0.00 C ATOM 3059 O PHE B 82 14.409 15.219 0.854 1.00 0.00 O ATOM 3060 CB PHE B 82 15.811 13.679 -1.983 1.00 0.00 C ATOM 3061 CG PHE B 82 16.937 13.168 -1.066 1.00 0.00 C ATOM 3062 CD1 PHE B 82 17.690 14.042 -0.276 1.00 0.00 C ATOM 3063 CD2 PHE B 82 17.249 11.810 -1.001 1.00 0.00 C ATOM 3064 CE1 PHE B 82 18.700 13.576 0.541 1.00 0.00 C ATOM 3065 CE2 PHE B 82 18.262 11.348 -0.180 1.00 0.00 C ATOM 3066 CZ PHE B 82 18.982 12.229 0.590 1.00 0.00 C ATOM 0 H PHE B 82 13.781 14.317 -3.244 1.00 0.00 H new ATOM 0 HA PHE B 82 14.148 13.222 -0.674 1.00 0.00 H new ATOM 0 HB2 PHE B 82 15.594 12.908 -2.723 1.00 0.00 H new ATOM 0 HB3 PHE B 82 16.179 14.549 -2.527 1.00 0.00 H new ATOM 0 HD1 PHE B 82 17.478 15.100 -0.306 1.00 0.00 H new ATOM 0 HD2 PHE B 82 16.690 11.108 -1.602 1.00 0.00 H new ATOM 0 HE1 PHE B 82 19.270 14.269 1.143 1.00 0.00 H new ATOM 0 HE2 PHE B 82 18.487 10.292 -0.144 1.00 0.00 H new ATOM 0 HZ PHE B 82 19.769 11.865 1.234 1.00 0.00 H new ATOM 3076 N ALA B 83 15.091 16.394 -0.960 1.00 0.00 N ATOM 3077 CA ALA B 83 15.496 17.624 -0.262 1.00 0.00 C ATOM 3078 C ALA B 83 14.367 18.230 0.585 1.00 0.00 C ATOM 3079 O ALA B 83 14.614 18.725 1.685 1.00 0.00 O ATOM 3080 CB ALA B 83 16.011 18.649 -1.280 1.00 0.00 C ATOM 0 H ALA B 83 15.157 16.468 -1.975 1.00 0.00 H new ATOM 0 HA ALA B 83 16.293 17.356 0.431 1.00 0.00 H new ATOM 0 HB1 ALA B 83 16.310 19.559 -0.760 1.00 0.00 H new ATOM 0 HB2 ALA B 83 16.869 18.235 -1.811 1.00 0.00 H new ATOM 0 HB3 ALA B 83 15.221 18.882 -1.994 1.00 0.00 H new ATOM 3086 N GLY B 84 13.131 18.175 0.058 1.00 0.00 N ATOM 3087 CA GLY B 84 11.964 18.711 0.762 1.00 0.00 C ATOM 3088 C GLY B 84 11.579 17.921 2.012 1.00 0.00 C ATOM 3089 O GLY B 84 11.250 18.509 3.050 1.00 0.00 O ATOM 0 H GLY B 84 12.920 17.765 -0.852 1.00 0.00 H new ATOM 0 HA2 GLY B 84 12.165 19.744 1.045 1.00 0.00 H new ATOM 0 HA3 GLY B 84 11.115 18.727 0.078 1.00 0.00 H new ATOM 3093 N TRP B 85 11.672 16.586 1.922 1.00 0.00 N ATOM 3094 CA TRP B 85 11.424 15.674 3.060 1.00 0.00 C ATOM 3095 C TRP B 85 12.526 15.851 4.114 1.00 0.00 C ATOM 3096 O TRP B 85 12.245 15.865 5.316 1.00 0.00 O ATOM 3097 CB TRP B 85 11.358 14.220 2.547 1.00 0.00 C ATOM 3098 CG TRP B 85 10.141 13.920 1.700 1.00 0.00 C ATOM 3099 CD1 TRP B 85 9.258 14.816 1.144 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.688 12.628 1.304 1.00 0.00 C ATOM 3101 NE1 TRP B 85 8.283 14.149 0.457 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.526 12.808 0.536 1.00 0.00 C ATOM 3103 CE3 TRP B 85 10.153 11.337 1.531 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.822 11.747 -0.001 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.454 10.284 0.993 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.302 10.494 0.233 1.00 0.00 C ATOM 0 H TRP B 85 11.921 16.103 1.059 1.00 0.00 H new ATOM 0 HA TRP B 85 10.470 15.912 3.530 1.00 0.00 H new ATOM 0 HB2 TRP B 85 12.254 14.011 1.963 1.00 0.00 H new ATOM 0 HB3 TRP B 85 11.369 13.543 3.402 1.00 0.00 H new ATOM 0 HD1 TRP B 85 9.325 15.890 1.237 1.00 0.00 H new ATOM 0 HE1 TRP B 85 7.501 14.582 -0.035 1.00 0.00 H new ATOM 0 HE3 TRP B 85 11.044 11.166 2.117 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 6.926 11.905 -0.583 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.802 9.275 1.161 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.779 9.643 -0.179 1.00 0.00 H new ATOM 3117 N LYS B 86 13.772 15.969 3.645 1.00 0.00 N ATOM 3118 CA LYS B 86 14.951 16.191 4.504 1.00 0.00 C ATOM 3119 C LYS B 86 14.783 17.486 5.312 1.00 0.00 C ATOM 3120 O LYS B 86 15.048 17.522 6.516 1.00 0.00 O ATOM 3121 CB LYS B 86 16.205 16.248 3.611 1.00 0.00 C ATOM 3122 CG LYS B 86 17.535 16.534 4.330 1.00 0.00 C ATOM 3123 CD LYS B 86 18.746 16.444 3.368 1.00 0.00 C ATOM 3124 CE LYS B 86 18.492 17.169 2.031 1.00 0.00 C ATOM 3125 NZ LYS B 86 19.683 17.186 1.159 1.00 0.00 N ATOM 0 H LYS B 86 13.998 15.913 2.652 1.00 0.00 H new ATOM 0 HA LYS B 86 15.057 15.373 5.216 1.00 0.00 H new ATOM 0 HB2 LYS B 86 16.296 15.297 3.086 1.00 0.00 H new ATOM 0 HB3 LYS B 86 16.052 17.017 2.853 1.00 0.00 H new ATOM 0 HG2 LYS B 86 17.499 17.528 4.776 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.666 15.823 5.146 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.623 16.876 3.851 1.00 0.00 H new ATOM 0 HD3 LYS B 86 18.973 15.396 3.172 1.00 0.00 H new ATOM 0 HE2 LYS B 86 17.670 16.681 1.508 1.00 0.00 H new ATOM 0 HE3 LYS B 86 18.178 18.193 2.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 19.458 17.685 0.274 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.462 17.676 1.644 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 19.969 16.210 0.943 1.00 0.00 H new ATOM 3139 N ALA B 87 14.299 18.524 4.618 1.00 0.00 N ATOM 3140 CA ALA B 87 14.036 19.844 5.206 1.00 0.00 C ATOM 3141 C ALA B 87 12.903 19.787 6.247 1.00 0.00 C ATOM 3142 O ALA B 87 12.890 20.549 7.218 1.00 0.00 O ATOM 3143 CB ALA B 87 13.708 20.851 4.091 1.00 0.00 C ATOM 0 H ALA B 87 14.077 18.471 3.624 1.00 0.00 H new ATOM 0 HA ALA B 87 14.934 20.172 5.730 1.00 0.00 H new ATOM 0 HB1 ALA B 87 13.513 21.829 4.530 1.00 0.00 H new ATOM 0 HB2 ALA B 87 14.552 20.922 3.405 1.00 0.00 H new ATOM 0 HB3 ALA B 87 12.826 20.516 3.546 1.00 0.00 H new ATOM 3149 N SER B 88 11.961 18.847 6.027 1.00 0.00 N ATOM 3150 CA SER B 88 10.757 18.673 6.867 1.00 0.00 C ATOM 3151 C SER B 88 10.888 17.472 7.840 1.00 0.00 C ATOM 3152 O SER B 88 9.903 17.010 8.428 1.00 0.00 O ATOM 3153 CB SER B 88 9.524 18.486 5.951 1.00 0.00 C ATOM 3154 OG SER B 88 9.378 19.582 5.063 1.00 0.00 O ATOM 0 H SER B 88 12.015 18.182 5.255 1.00 0.00 H new ATOM 0 HA SER B 88 10.640 19.567 7.480 1.00 0.00 H new ATOM 0 HB2 SER B 88 9.627 17.563 5.381 1.00 0.00 H new ATOM 0 HB3 SER B 88 8.626 18.385 6.560 1.00 0.00 H new ATOM 0 HG SER B 88 9.929 19.433 4.266 1.00 0.00 H new ATOM 3160 N GLY B 89 12.140 16.993 7.997 1.00 0.00 N ATOM 3161 CA GLY B 89 12.529 16.124 9.114 1.00 0.00 C ATOM 3162 C GLY B 89 12.253 14.641 8.901 1.00 0.00 C ATOM 3163 O GLY B 89 11.715 13.979 9.787 1.00 0.00 O ATOM 0 H GLY B 89 12.903 17.200 7.352 1.00 0.00 H new ATOM 0 HA2 GLY B 89 13.594 16.257 9.304 1.00 0.00 H new ATOM 0 HA3 GLY B 89 12.002 16.451 10.010 1.00 0.00 H new ATOM 3167 N VAL B 90 12.630 14.114 7.731 1.00 0.00 N ATOM 3168 CA VAL B 90 12.547 12.667 7.429 1.00 0.00 C ATOM 3169 C VAL B 90 13.954 12.035 7.540 1.00 0.00 C ATOM 3170 O VAL B 90 14.908 12.573 6.979 1.00 0.00 O ATOM 3171 CB VAL B 90 11.934 12.426 6.001 1.00 0.00 C ATOM 3172 CG1 VAL B 90 11.927 10.929 5.612 1.00 0.00 C ATOM 3173 CG2 VAL B 90 10.504 13.015 5.916 1.00 0.00 C ATOM 0 H VAL B 90 13.002 14.672 6.962 1.00 0.00 H new ATOM 0 HA VAL B 90 11.887 12.191 8.154 1.00 0.00 H new ATOM 0 HB VAL B 90 12.574 12.943 5.285 1.00 0.00 H new ATOM 0 HG11 VAL B 90 11.495 10.813 4.618 1.00 0.00 H new ATOM 0 HG12 VAL B 90 12.949 10.549 5.610 1.00 0.00 H new ATOM 0 HG13 VAL B 90 11.333 10.368 6.334 1.00 0.00 H new ATOM 0 HG21 VAL B 90 10.096 12.839 4.921 1.00 0.00 H new ATOM 0 HG22 VAL B 90 9.868 12.534 6.659 1.00 0.00 H new ATOM 0 HG23 VAL B 90 10.540 14.087 6.108 1.00 0.00 H new ATOM 3183 N ALA B 91 14.053 10.892 8.265 1.00 0.00 N ATOM 3184 CA ALA B 91 15.339 10.199 8.549 1.00 0.00 C ATOM 3185 C ALA B 91 16.044 9.733 7.260 1.00 0.00 C ATOM 3186 O ALA B 91 17.271 9.829 7.158 1.00 0.00 O ATOM 3187 CB ALA B 91 15.102 9.005 9.487 1.00 0.00 C ATOM 0 H ALA B 91 13.243 10.423 8.670 1.00 0.00 H new ATOM 0 HA ALA B 91 15.996 10.918 9.037 1.00 0.00 H new ATOM 0 HB1 ALA B 91 16.050 8.506 9.687 1.00 0.00 H new ATOM 0 HB2 ALA B 91 14.673 9.358 10.424 1.00 0.00 H new ATOM 0 HB3 ALA B 91 14.415 8.303 9.015 1.00 0.00 H new ATOM 3193 N MET B 92 15.232 9.227 6.300 1.00 0.00 N ATOM 3194 CA MET B 92 15.646 8.862 4.916 1.00 0.00 C ATOM 3195 C MET B 92 16.922 7.980 4.847 1.00 0.00 C ATOM 3196 O MET B 92 18.045 8.466 4.664 1.00 0.00 O ATOM 3197 CB MET B 92 15.729 10.112 3.980 1.00 0.00 C ATOM 3198 CG MET B 92 16.693 11.233 4.382 1.00 0.00 C ATOM 3199 SD MET B 92 16.849 12.504 3.120 1.00 0.00 S ATOM 3200 CE MET B 92 15.134 12.902 2.784 1.00 0.00 C ATOM 0 H MET B 92 14.241 9.055 6.469 1.00 0.00 H new ATOM 0 HA MET B 92 14.848 8.225 4.534 1.00 0.00 H new ATOM 0 HB2 MET B 92 16.009 9.769 2.984 1.00 0.00 H new ATOM 0 HB3 MET B 92 14.730 10.540 3.901 1.00 0.00 H new ATOM 0 HG2 MET B 92 16.346 11.689 5.309 1.00 0.00 H new ATOM 0 HG3 MET B 92 17.675 10.806 4.585 1.00 0.00 H new ATOM 0 HE1 MET B 92 15.023 13.982 2.687 1.00 0.00 H new ATOM 0 HE2 MET B 92 14.824 12.421 1.857 1.00 0.00 H new ATOM 0 HE3 MET B 92 14.510 12.546 3.604 1.00 0.00 H new ATOM 3210 N LEU B 93 16.734 6.666 5.038 1.00 0.00 N ATOM 3211 CA LEU B 93 17.841 5.691 5.033 1.00 0.00 C ATOM 3212 C LEU B 93 17.804 4.859 3.733 1.00 0.00 C ATOM 3213 O LEU B 93 17.271 3.751 3.695 1.00 0.00 O ATOM 3214 CB LEU B 93 17.848 4.796 6.339 1.00 0.00 C ATOM 3215 CG LEU B 93 16.488 4.505 7.088 1.00 0.00 C ATOM 3216 CD1 LEU B 93 15.968 5.740 7.857 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.402 3.929 6.148 1.00 0.00 C ATOM 0 H LEU B 93 15.817 6.248 5.200 1.00 0.00 H new ATOM 0 HA LEU B 93 18.786 6.235 5.050 1.00 0.00 H new ATOM 0 HB2 LEU B 93 18.287 3.834 6.074 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.521 5.268 7.055 1.00 0.00 H new ATOM 0 HG LEU B 93 16.712 3.734 7.825 1.00 0.00 H new ATOM 0 HD11 LEU B 93 15.031 5.490 8.355 1.00 0.00 H new ATOM 0 HD12 LEU B 93 16.705 6.043 8.601 1.00 0.00 H new ATOM 0 HD13 LEU B 93 15.800 6.560 7.158 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.489 3.748 6.715 1.00 0.00 H new ATOM 0 HD22 LEU B 93 15.198 4.641 5.349 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.754 2.991 5.717 1.00 0.00 H new ATOM 3229 N GLN B 94 18.396 5.449 2.682 1.00 0.00 N ATOM 3230 CA GLN B 94 18.596 4.838 1.355 1.00 0.00 C ATOM 3231 C GLN B 94 19.249 5.878 0.446 1.00 0.00 C ATOM 3232 O GLN B 94 18.825 7.042 0.430 1.00 0.00 O ATOM 3233 CB GLN B 94 17.276 4.305 0.700 1.00 0.00 C ATOM 3234 CG GLN B 94 17.385 3.811 -0.773 1.00 0.00 C ATOM 3235 CD GLN B 94 18.318 2.606 -1.014 1.00 0.00 C ATOM 3236 OE1 GLN B 94 19.310 2.401 -0.317 1.00 0.00 O ATOM 3237 NE2 GLN B 94 18.011 1.815 -2.028 1.00 0.00 N ATOM 0 H GLN B 94 18.762 6.400 2.734 1.00 0.00 H new ATOM 0 HA GLN B 94 19.234 3.964 1.486 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.900 3.483 1.309 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.530 5.099 0.740 1.00 0.00 H new ATOM 0 HG2 GLN B 94 16.387 3.548 -1.122 1.00 0.00 H new ATOM 0 HG3 GLN B 94 17.730 4.641 -1.389 1.00 0.00 H new ATOM 0 HE21 GLN B 94 17.182 2.006 -2.591 1.00 0.00 H new ATOM 0 HE22 GLN B 94 18.603 1.013 -2.247 1.00 0.00 H new ATOM 3246 N GLN B 95 20.288 5.461 -0.287 1.00 0.00 N ATOM 3247 CA GLN B 95 20.920 6.302 -1.302 1.00 0.00 C ATOM 3248 C GLN B 95 20.041 6.299 -2.570 1.00 0.00 C ATOM 3249 O GLN B 95 19.751 5.217 -3.102 1.00 0.00 O ATOM 3250 CB GLN B 95 22.351 5.796 -1.629 1.00 0.00 C ATOM 3251 CG GLN B 95 23.313 5.782 -0.426 1.00 0.00 C ATOM 3252 CD GLN B 95 24.701 5.236 -0.782 1.00 0.00 C ATOM 3253 OE1 GLN B 95 24.947 4.038 -0.686 1.00 0.00 O ATOM 3254 NE2 GLN B 95 25.611 6.111 -1.194 1.00 0.00 N ATOM 0 H GLN B 95 20.710 4.537 -0.192 1.00 0.00 H new ATOM 0 HA GLN B 95 21.011 7.319 -0.921 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.282 4.787 -2.035 1.00 0.00 H new ATOM 0 HB3 GLN B 95 22.776 6.426 -2.411 1.00 0.00 H new ATOM 0 HG2 GLN B 95 23.415 6.795 -0.036 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.882 5.176 0.371 1.00 0.00 H new ATOM 0 HE21 GLN B 95 25.373 7.100 -1.262 1.00 0.00 H new ATOM 0 HE22 GLN B 95 26.548 5.794 -1.442 1.00 0.00 H new ATOM 3263 N PRO B 96 19.556 7.493 -3.045 1.00 0.00 N ATOM 3264 CA PRO B 96 18.840 7.607 -4.332 1.00 0.00 C ATOM 3265 C PRO B 96 19.750 7.148 -5.487 1.00 0.00 C ATOM 3266 O PRO B 96 20.724 7.825 -5.832 1.00 0.00 O ATOM 3267 CB PRO B 96 18.468 9.117 -4.432 1.00 0.00 C ATOM 3268 CG PRO B 96 19.392 9.803 -3.468 1.00 0.00 C ATOM 3269 CD PRO B 96 19.655 8.804 -2.361 1.00 0.00 C ATOM 0 HA PRO B 96 17.952 6.977 -4.393 1.00 0.00 H new ATOM 0 HB2 PRO B 96 18.605 9.492 -5.446 1.00 0.00 H new ATOM 0 HB3 PRO B 96 17.424 9.286 -4.168 1.00 0.00 H new ATOM 0 HG2 PRO B 96 20.320 10.096 -3.958 1.00 0.00 H new ATOM 0 HG3 PRO B 96 18.939 10.713 -3.073 1.00 0.00 H new ATOM 0 HD2 PRO B 96 20.638 8.950 -1.914 1.00 0.00 H new ATOM 0 HD3 PRO B 96 18.924 8.894 -1.558 1.00 0.00 H new ATOM 3277 N ALA B 97 19.462 5.961 -6.028 1.00 0.00 N ATOM 3278 CA ALA B 97 20.284 5.329 -7.066 1.00 0.00 C ATOM 3279 C ALA B 97 19.391 4.668 -8.115 1.00 0.00 C ATOM 3280 O ALA B 97 18.253 4.279 -7.825 1.00 0.00 O ATOM 3281 CB ALA B 97 21.244 4.306 -6.437 1.00 0.00 C ATOM 0 H ALA B 97 18.649 5.408 -5.758 1.00 0.00 H new ATOM 0 HA ALA B 97 20.882 6.095 -7.560 1.00 0.00 H new ATOM 0 HB1 ALA B 97 21.848 3.845 -7.219 1.00 0.00 H new ATOM 0 HB2 ALA B 97 21.897 4.810 -5.724 1.00 0.00 H new ATOM 0 HB3 ALA B 97 20.669 3.537 -5.921 1.00 0.00 H new ATOM 3287 N LYS B 98 19.917 4.576 -9.346 1.00 0.00 N ATOM 3288 CA LYS B 98 19.265 3.862 -10.448 1.00 0.00 C ATOM 3289 C LYS B 98 19.134 2.364 -10.112 1.00 0.00 C ATOM 3290 O LYS B 98 20.059 1.756 -9.564 1.00 0.00 O ATOM 3291 CB LYS B 98 20.051 4.074 -11.772 1.00 0.00 C ATOM 3292 CG LYS B 98 19.798 5.420 -12.480 1.00 0.00 C ATOM 3293 CD LYS B 98 18.351 5.582 -12.994 1.00 0.00 C ATOM 3294 CE LYS B 98 18.031 4.652 -14.168 1.00 0.00 C ATOM 3295 NZ LYS B 98 18.914 4.908 -15.333 1.00 0.00 N ATOM 0 H LYS B 98 20.810 4.997 -9.603 1.00 0.00 H new ATOM 0 HA LYS B 98 18.262 4.266 -10.585 1.00 0.00 H new ATOM 0 HB2 LYS B 98 21.117 3.988 -11.560 1.00 0.00 H new ATOM 0 HB3 LYS B 98 19.797 3.267 -12.459 1.00 0.00 H new ATOM 0 HG2 LYS B 98 20.023 6.233 -11.790 1.00 0.00 H new ATOM 0 HG3 LYS B 98 20.486 5.515 -13.320 1.00 0.00 H new ATOM 0 HD2 LYS B 98 17.656 5.382 -12.178 1.00 0.00 H new ATOM 0 HD3 LYS B 98 18.193 6.616 -13.302 1.00 0.00 H new ATOM 0 HE2 LYS B 98 18.141 3.615 -13.850 1.00 0.00 H new ATOM 0 HE3 LYS B 98 16.991 4.786 -14.464 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 18.515 4.452 -16.178 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 18.988 5.933 -15.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 19.860 4.519 -15.144 1.00 0.00 H new ATOM 3309 N MET B 99 17.973 1.800 -10.450 1.00 0.00 N ATOM 3310 CA MET B 99 17.605 0.421 -10.104 1.00 0.00 C ATOM 3311 C MET B 99 16.804 -0.195 -11.274 1.00 0.00 C ATOM 3312 O MET B 99 16.489 0.500 -12.253 1.00 0.00 O ATOM 3313 CB MET B 99 16.765 0.452 -8.789 1.00 0.00 C ATOM 3314 CG MET B 99 16.563 -0.886 -8.068 1.00 0.00 C ATOM 3315 SD MET B 99 15.259 -0.800 -6.819 1.00 0.00 S ATOM 3316 CE MET B 99 15.483 -2.352 -5.952 1.00 0.00 C ATOM 0 H MET B 99 17.252 2.292 -10.978 1.00 0.00 H new ATOM 0 HA MET B 99 18.490 -0.194 -9.939 1.00 0.00 H new ATOM 0 HB2 MET B 99 17.244 1.143 -8.096 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.783 0.864 -9.022 1.00 0.00 H new ATOM 0 HG2 MET B 99 16.314 -1.656 -8.798 1.00 0.00 H new ATOM 0 HG3 MET B 99 17.498 -1.186 -7.595 1.00 0.00 H new ATOM 0 HE1 MET B 99 14.545 -2.907 -5.951 1.00 0.00 H new ATOM 0 HE2 MET B 99 16.252 -2.940 -6.452 1.00 0.00 H new ATOM 0 HE3 MET B 99 15.788 -2.154 -4.925 1.00 0.00 H new ATOM 3326 N GLU B 100 16.482 -1.491 -11.145 1.00 0.00 N ATOM 3327 CA GLU B 100 15.673 -2.266 -12.109 1.00 0.00 C ATOM 3328 C GLU B 100 14.323 -1.580 -12.457 1.00 0.00 C ATOM 3329 O GLU B 100 13.826 -1.703 -13.580 1.00 0.00 O ATOM 3330 CB GLU B 100 15.398 -3.664 -11.494 1.00 0.00 C ATOM 3331 CG GLU B 100 14.782 -4.690 -12.459 1.00 0.00 C ATOM 3332 CD GLU B 100 15.727 -5.074 -13.610 1.00 0.00 C ATOM 3333 OE1 GLU B 100 16.722 -5.792 -13.357 1.00 0.00 O ATOM 3334 OE2 GLU B 100 15.474 -4.675 -14.768 1.00 0.00 O ATOM 0 H GLU B 100 16.784 -2.048 -10.346 1.00 0.00 H new ATOM 0 HA GLU B 100 16.236 -2.339 -13.040 1.00 0.00 H new ATOM 0 HB2 GLU B 100 16.336 -4.066 -11.111 1.00 0.00 H new ATOM 0 HB3 GLU B 100 14.730 -3.544 -10.641 1.00 0.00 H new ATOM 0 HG2 GLU B 100 14.512 -5.588 -11.903 1.00 0.00 H new ATOM 0 HG3 GLU B 100 13.860 -4.283 -12.874 1.00 0.00 H new ATOM 3341 N PHE B 101 13.752 -0.861 -11.471 1.00 0.00 N ATOM 3342 CA PHE B 101 12.413 -0.229 -11.584 1.00 0.00 C ATOM 3343 C PHE B 101 12.530 1.290 -11.856 1.00 0.00 C ATOM 3344 O PHE B 101 11.517 1.974 -12.074 1.00 0.00 O ATOM 3345 CB PHE B 101 11.601 -0.500 -10.282 1.00 0.00 C ATOM 3346 CG PHE B 101 11.732 -1.935 -9.764 1.00 0.00 C ATOM 3347 CD1 PHE B 101 11.335 -3.017 -10.552 1.00 0.00 C ATOM 3348 CD2 PHE B 101 12.280 -2.202 -8.508 1.00 0.00 C ATOM 3349 CE1 PHE B 101 11.484 -4.312 -10.100 1.00 0.00 C ATOM 3350 CE2 PHE B 101 12.421 -3.497 -8.055 1.00 0.00 C ATOM 3351 CZ PHE B 101 12.027 -4.552 -8.852 1.00 0.00 C ATOM 0 H PHE B 101 14.203 -0.699 -10.571 1.00 0.00 H new ATOM 0 HA PHE B 101 11.888 -0.669 -12.432 1.00 0.00 H new ATOM 0 HB2 PHE B 101 11.934 0.189 -9.506 1.00 0.00 H new ATOM 0 HB3 PHE B 101 10.549 -0.285 -10.469 1.00 0.00 H new ATOM 0 HD1 PHE B 101 10.906 -2.838 -11.527 1.00 0.00 H new ATOM 0 HD2 PHE B 101 12.598 -1.382 -7.882 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.176 -5.139 -10.722 1.00 0.00 H new ATOM 0 HE2 PHE B 101 12.839 -3.685 -7.077 1.00 0.00 H new ATOM 0 HZ PHE B 101 12.143 -5.566 -8.500 1.00 0.00 H new ATOM 3361 N GLY B 102 13.772 1.804 -11.812 1.00 0.00 N ATOM 3362 CA GLY B 102 14.072 3.209 -12.095 1.00 0.00 C ATOM 3363 C GLY B 102 14.908 3.857 -11.004 1.00 0.00 C ATOM 3364 O GLY B 102 15.445 3.159 -10.139 1.00 0.00 O ATOM 0 H GLY B 102 14.596 1.250 -11.578 1.00 0.00 H new ATOM 0 HA2 GLY B 102 14.602 3.280 -13.045 1.00 0.00 H new ATOM 0 HA3 GLY B 102 13.139 3.761 -12.209 1.00 0.00 H new ATOM 3368 N TYR B 103 15.029 5.198 -11.048 1.00 0.00 N ATOM 3369 CA TYR B 103 15.828 5.956 -10.066 1.00 0.00 C ATOM 3370 C TYR B 103 15.045 6.039 -8.755 1.00 0.00 C ATOM 3371 O TYR B 103 14.136 6.859 -8.628 1.00 0.00 O ATOM 3372 CB TYR B 103 16.143 7.380 -10.600 1.00 0.00 C ATOM 3373 CG TYR B 103 17.259 8.076 -9.823 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.555 7.626 -9.963 1.00 0.00 C ATOM 3375 CD2 TYR B 103 17.029 9.145 -8.957 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.596 8.196 -9.297 1.00 0.00 C ATOM 3377 CE2 TYR B 103 18.073 9.739 -8.274 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.362 9.259 -8.442 1.00 0.00 C ATOM 3379 OH TYR B 103 20.409 9.846 -7.765 1.00 0.00 O ATOM 0 H TYR B 103 14.582 5.780 -11.756 1.00 0.00 H new ATOM 0 HA TYR B 103 16.776 5.446 -9.896 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.426 7.314 -11.650 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.240 7.988 -10.551 1.00 0.00 H new ATOM 0 HD1 TYR B 103 18.750 6.794 -10.623 1.00 0.00 H new ATOM 0 HD2 TYR B 103 16.023 9.513 -8.819 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.599 7.821 -9.435 1.00 0.00 H new ATOM 0 HE2 TYR B 103 17.885 10.572 -7.613 1.00 0.00 H new ATOM 0 HH TYR B 103 20.668 9.279 -7.009 1.00 0.00 H new ATOM 3389 N THR B 104 15.402 5.204 -7.778 1.00 0.00 N ATOM 3390 CA THR B 104 14.582 4.996 -6.583 1.00 0.00 C ATOM 3391 C THR B 104 15.302 5.486 -5.320 1.00 0.00 C ATOM 3392 O THR B 104 16.537 5.463 -5.229 1.00 0.00 O ATOM 3393 CB THR B 104 14.178 3.488 -6.433 1.00 0.00 C ATOM 3394 OG1 THR B 104 13.197 3.331 -5.392 1.00 0.00 O ATOM 3395 CG2 THR B 104 15.383 2.575 -6.133 1.00 0.00 C ATOM 0 H THR B 104 16.262 4.656 -7.792 1.00 0.00 H new ATOM 0 HA THR B 104 13.673 5.585 -6.704 1.00 0.00 H new ATOM 0 HB THR B 104 13.760 3.184 -7.393 1.00 0.00 H new ATOM 0 HG1 THR B 104 12.696 4.166 -5.286 1.00 0.00 H new ATOM 0 HG21 THR B 104 15.044 1.543 -6.039 1.00 0.00 H new ATOM 0 HG22 THR B 104 16.105 2.647 -6.946 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.853 2.888 -5.201 1.00 0.00 H new ATOM 3403 N PHE B 105 14.492 5.935 -4.373 1.00 0.00 N ATOM 3404 CA PHE B 105 14.909 6.434 -3.074 1.00 0.00 C ATOM 3405 C PHE B 105 13.834 6.068 -2.043 1.00 0.00 C ATOM 3406 O PHE B 105 12.660 6.344 -2.269 1.00 0.00 O ATOM 3407 CB PHE B 105 15.128 7.983 -3.155 1.00 0.00 C ATOM 3408 CG PHE B 105 14.922 8.747 -1.843 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.709 8.482 -0.720 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.905 9.700 -1.731 1.00 0.00 C ATOM 3411 CE1 PHE B 105 15.485 9.147 0.464 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.680 10.361 -0.546 1.00 0.00 C ATOM 3413 CZ PHE B 105 14.470 10.086 0.551 1.00 0.00 C ATOM 0 H PHE B 105 13.480 5.962 -4.496 1.00 0.00 H new ATOM 0 HA PHE B 105 15.853 5.981 -2.769 1.00 0.00 H new ATOM 0 HB2 PHE B 105 16.141 8.171 -3.510 1.00 0.00 H new ATOM 0 HB3 PHE B 105 14.448 8.390 -3.903 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.500 7.749 -0.781 1.00 0.00 H new ATOM 0 HD2 PHE B 105 13.286 9.921 -2.588 1.00 0.00 H new ATOM 0 HE1 PHE B 105 16.101 8.937 1.326 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.888 11.092 -0.475 1.00 0.00 H new ATOM 0 HZ PHE B 105 14.296 10.605 1.482 1.00 0.00 H new ATOM 3423 N THR B 106 14.228 5.464 -0.926 1.00 0.00 N ATOM 3424 CA THR B 106 13.276 4.967 0.076 1.00 0.00 C ATOM 3425 C THR B 106 13.538 5.650 1.427 1.00 0.00 C ATOM 3426 O THR B 106 14.629 5.547 1.992 1.00 0.00 O ATOM 3427 CB THR B 106 13.366 3.418 0.196 1.00 0.00 C ATOM 3428 OG1 THR B 106 13.252 2.826 -1.112 1.00 0.00 O ATOM 3429 CG2 THR B 106 12.265 2.839 1.103 1.00 0.00 C ATOM 0 H THR B 106 15.206 5.304 -0.686 1.00 0.00 H new ATOM 0 HA THR B 106 12.262 5.213 -0.241 1.00 0.00 H new ATOM 0 HB THR B 106 14.331 3.182 0.645 1.00 0.00 H new ATOM 0 HG1 THR B 106 13.722 1.966 -1.124 1.00 0.00 H new ATOM 0 HG21 THR B 106 12.369 1.755 1.155 1.00 0.00 H new ATOM 0 HG22 THR B 106 12.358 3.261 2.103 1.00 0.00 H new ATOM 0 HG23 THR B 106 11.287 3.090 0.693 1.00 0.00 H new ATOM 3437 N ALA B 107 12.525 6.360 1.919 1.00 0.00 N ATOM 3438 CA ALA B 107 12.612 7.172 3.133 1.00 0.00 C ATOM 3439 C ALA B 107 11.855 6.546 4.313 1.00 0.00 C ATOM 3440 O ALA B 107 10.954 5.719 4.125 1.00 0.00 O ATOM 3441 CB ALA B 107 12.066 8.571 2.835 1.00 0.00 C ATOM 0 H ALA B 107 11.605 6.388 1.479 1.00 0.00 H new ATOM 0 HA ALA B 107 13.660 7.228 3.428 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.126 9.184 3.734 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.656 9.030 2.042 1.00 0.00 H new ATOM 0 HB3 ALA B 107 11.026 8.496 2.517 1.00 0.00 H new ATOM 3447 N ALA B 108 12.236 6.961 5.526 1.00 0.00 N ATOM 3448 CA ALA B 108 11.520 6.658 6.768 1.00 0.00 C ATOM 3449 C ALA B 108 11.564 7.917 7.627 1.00 0.00 C ATOM 3450 O ALA B 108 12.627 8.507 7.776 1.00 0.00 O ATOM 3451 CB ALA B 108 12.167 5.475 7.502 1.00 0.00 C ATOM 0 H ALA B 108 13.070 7.530 5.674 1.00 0.00 H new ATOM 0 HA ALA B 108 10.490 6.371 6.555 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.616 5.271 8.420 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.144 4.593 6.862 1.00 0.00 H new ATOM 0 HB3 ALA B 108 13.201 5.720 7.746 1.00 0.00 H new ATOM 3457 N ASP B 109 10.420 8.359 8.136 1.00 0.00 N ATOM 3458 CA ASP B 109 10.326 9.572 8.980 1.00 0.00 C ATOM 3459 C ASP B 109 10.556 9.178 10.487 1.00 0.00 C ATOM 3460 O ASP B 109 10.778 7.989 10.757 1.00 0.00 O ATOM 3461 CB ASP B 109 8.932 10.228 8.713 1.00 0.00 C ATOM 3462 CG ASP B 109 7.770 9.572 9.471 1.00 0.00 C ATOM 3463 OD1 ASP B 109 7.736 8.322 9.553 1.00 0.00 O ATOM 3464 OD2 ASP B 109 6.891 10.293 9.978 1.00 0.00 O ATOM 0 H ASP B 109 9.524 7.896 7.983 1.00 0.00 H new ATOM 0 HA ASP B 109 11.095 10.305 8.736 1.00 0.00 H new ATOM 0 HB2 ASP B 109 8.981 11.282 8.988 1.00 0.00 H new ATOM 0 HB3 ASP B 109 8.723 10.187 7.644 1.00 0.00 H new ATOM 3469 N PRO B 110 10.521 10.136 11.492 1.00 0.00 N ATOM 3470 CA PRO B 110 10.649 9.786 12.941 1.00 0.00 C ATOM 3471 C PRO B 110 9.557 8.805 13.431 1.00 0.00 C ATOM 3472 O PRO B 110 9.811 7.975 14.312 1.00 0.00 O ATOM 3473 CB PRO B 110 10.522 11.159 13.662 1.00 0.00 C ATOM 3474 CG PRO B 110 9.851 12.047 12.666 1.00 0.00 C ATOM 3475 CD PRO B 110 10.391 11.616 11.330 1.00 0.00 C ATOM 0 HA PRO B 110 11.586 9.268 13.143 1.00 0.00 H new ATOM 0 HB2 PRO B 110 9.935 11.074 14.576 1.00 0.00 H new ATOM 0 HB3 PRO B 110 11.499 11.549 13.946 1.00 0.00 H new ATOM 0 HG2 PRO B 110 8.767 11.937 12.707 1.00 0.00 H new ATOM 0 HG3 PRO B 110 10.073 13.096 12.861 1.00 0.00 H new ATOM 0 HD2 PRO B 110 9.714 11.877 10.516 1.00 0.00 H new ATOM 0 HD3 PRO B 110 11.350 12.085 11.110 1.00 0.00 H new ATOM 3483 N ASP B 111 8.348 8.899 12.841 1.00 0.00 N ATOM 3484 CA ASP B 111 7.187 8.064 13.247 1.00 0.00 C ATOM 3485 C ASP B 111 7.323 6.623 12.696 1.00 0.00 C ATOM 3486 O ASP B 111 6.498 5.752 12.996 1.00 0.00 O ATOM 3487 CB ASP B 111 5.860 8.721 12.781 1.00 0.00 C ATOM 3488 CG ASP B 111 4.624 8.244 13.567 1.00 0.00 C ATOM 3489 OD1 ASP B 111 4.296 8.842 14.616 1.00 0.00 O ATOM 3490 OD2 ASP B 111 3.987 7.267 13.150 1.00 0.00 O ATOM 0 H ASP B 111 8.145 9.546 12.079 1.00 0.00 H new ATOM 0 HA ASP B 111 7.171 8.000 14.335 1.00 0.00 H new ATOM 0 HB2 ASP B 111 5.947 9.803 12.879 1.00 0.00 H new ATOM 0 HB3 ASP B 111 5.711 8.508 11.723 1.00 0.00 H new ATOM 3495 N SER B 112 8.380 6.408 11.871 1.00 0.00 N ATOM 3496 CA SER B 112 8.818 5.091 11.381 1.00 0.00 C ATOM 3497 C SER B 112 7.838 4.551 10.328 1.00 0.00 C ATOM 3498 O SER B 112 7.197 3.503 10.503 1.00 0.00 O ATOM 3499 CB SER B 112 9.053 4.101 12.556 1.00 0.00 C ATOM 3500 OG SER B 112 9.925 4.662 13.531 1.00 0.00 O ATOM 0 H SER B 112 8.961 7.171 11.524 1.00 0.00 H new ATOM 0 HA SER B 112 9.782 5.206 10.885 1.00 0.00 H new ATOM 0 HB2 SER B 112 8.099 3.848 13.019 1.00 0.00 H new ATOM 0 HB3 SER B 112 9.478 3.173 12.174 1.00 0.00 H new ATOM 0 HG SER B 112 10.056 4.021 14.261 1.00 0.00 H new ATOM 3506 N HIS B 113 7.706 5.320 9.239 1.00 0.00 N ATOM 3507 CA HIS B 113 6.904 4.933 8.067 1.00 0.00 C ATOM 3508 C HIS B 113 7.832 4.341 6.984 1.00 0.00 C ATOM 3509 O HIS B 113 9.004 4.033 7.254 1.00 0.00 O ATOM 3510 CB HIS B 113 6.109 6.158 7.530 1.00 0.00 C ATOM 3511 CG HIS B 113 5.251 6.860 8.562 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.920 8.194 8.468 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.676 6.426 9.713 1.00 0.00 C ATOM 3514 CE1 HIS B 113 4.184 8.539 9.495 1.00 0.00 C ATOM 3515 NE2 HIS B 113 4.018 7.489 10.256 1.00 0.00 N ATOM 0 H HIS B 113 8.153 6.232 9.144 1.00 0.00 H new ATOM 0 HA HIS B 113 6.179 4.171 8.353 1.00 0.00 H new ATOM 0 HB2 HIS B 113 6.815 6.877 7.114 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.470 5.828 6.711 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.730 5.427 10.121 1.00 0.00 H new ATOM 0 HE1 HIS B 113 3.782 9.524 9.682 1.00 0.00 H new ATOM 0 HE2 HIS B 113 3.479 7.468 11.122 1.00 0.00 H new ATOM 3524 N ARG B 114 7.294 4.167 5.769 1.00 0.00 N ATOM 3525 CA ARG B 114 7.997 3.538 4.647 1.00 0.00 C ATOM 3526 C ARG B 114 7.473 4.173 3.344 1.00 0.00 C ATOM 3527 O ARG B 114 6.418 3.796 2.819 1.00 0.00 O ATOM 3528 CB ARG B 114 7.792 1.993 4.711 1.00 0.00 C ATOM 3529 CG ARG B 114 8.273 1.201 3.478 1.00 0.00 C ATOM 3530 CD ARG B 114 9.748 1.437 3.114 1.00 0.00 C ATOM 3531 NE ARG B 114 10.699 0.844 4.077 1.00 0.00 N ATOM 3532 CZ ARG B 114 11.709 0.004 3.758 1.00 0.00 C ATOM 3533 NH1 ARG B 114 11.837 -0.481 2.520 1.00 0.00 N ATOM 3534 NH2 ARG B 114 12.557 -0.382 4.701 1.00 0.00 N ATOM 0 H ARG B 114 6.346 4.464 5.537 1.00 0.00 H new ATOM 0 HA ARG B 114 9.073 3.707 4.691 1.00 0.00 H new ATOM 0 HB2 ARG B 114 8.313 1.612 5.590 1.00 0.00 H new ATOM 0 HB3 ARG B 114 6.731 1.792 4.857 1.00 0.00 H new ATOM 0 HG2 ARG B 114 8.121 0.137 3.661 1.00 0.00 H new ATOM 0 HG3 ARG B 114 7.652 1.469 2.623 1.00 0.00 H new ATOM 0 HD2 ARG B 114 9.940 1.022 2.125 1.00 0.00 H new ATOM 0 HD3 ARG B 114 9.930 2.510 3.050 1.00 0.00 H new ATOM 0 HE ARG B 114 10.584 1.088 5.061 1.00 0.00 H new ATOM 0 HH11 ARG B 114 11.166 -0.219 1.798 1.00 0.00 H new ATOM 0 HH12 ARG B 114 12.605 -1.114 2.297 1.00 0.00 H new ATOM 0 HH21 ARG B 114 12.444 -0.045 5.657 1.00 0.00 H new ATOM 0 HH22 ARG B 114 13.322 -1.016 4.470 1.00 0.00 H new ATOM 3548 N LEU B 115 8.209 5.192 2.877 1.00 0.00 N ATOM 3549 CA LEU B 115 7.800 6.060 1.766 1.00 0.00 C ATOM 3550 C LEU B 115 8.799 5.897 0.609 1.00 0.00 C ATOM 3551 O LEU B 115 9.894 6.459 0.644 1.00 0.00 O ATOM 3552 CB LEU B 115 7.767 7.524 2.286 1.00 0.00 C ATOM 3553 CG LEU B 115 6.913 7.780 3.573 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.034 9.242 4.056 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.437 7.377 3.352 1.00 0.00 C ATOM 0 H LEU B 115 9.118 5.439 3.267 1.00 0.00 H new ATOM 0 HA LEU B 115 6.810 5.793 1.396 1.00 0.00 H new ATOM 0 HB2 LEU B 115 8.791 7.840 2.485 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.386 8.162 1.489 1.00 0.00 H new ATOM 0 HG LEU B 115 7.314 7.146 4.364 1.00 0.00 H new ATOM 0 HD11 LEU B 115 6.427 9.381 4.951 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.076 9.464 4.286 1.00 0.00 H new ATOM 0 HD13 LEU B 115 6.684 9.914 3.273 1.00 0.00 H new ATOM 0 HD21 LEU B 115 4.868 7.566 4.262 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.018 7.963 2.534 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.383 6.317 3.103 1.00 0.00 H new ATOM 3567 N ARG B 116 8.406 5.121 -0.418 1.00 0.00 N ATOM 3568 CA ARG B 116 9.315 4.685 -1.493 1.00 0.00 C ATOM 3569 C ARG B 116 9.153 5.538 -2.773 1.00 0.00 C ATOM 3570 O ARG B 116 8.259 5.276 -3.565 1.00 0.00 O ATOM 3571 CB ARG B 116 9.112 3.158 -1.746 1.00 0.00 C ATOM 3572 CG ARG B 116 10.146 2.478 -2.693 1.00 0.00 C ATOM 3573 CD ARG B 116 9.740 2.479 -4.185 1.00 0.00 C ATOM 3574 NE ARG B 116 10.789 1.877 -5.027 1.00 0.00 N ATOM 3575 CZ ARG B 116 10.594 1.238 -6.192 1.00 0.00 C ATOM 3576 NH1 ARG B 116 9.371 1.090 -6.702 1.00 0.00 N ATOM 3577 NH2 ARG B 116 11.639 0.737 -6.837 1.00 0.00 N ATOM 0 H ARG B 116 7.451 4.779 -0.525 1.00 0.00 H new ATOM 0 HA ARG B 116 10.346 4.843 -1.178 1.00 0.00 H new ATOM 0 HB2 ARG B 116 9.137 2.644 -0.785 1.00 0.00 H new ATOM 0 HB3 ARG B 116 8.115 3.008 -2.162 1.00 0.00 H new ATOM 0 HG2 ARG B 116 11.105 2.986 -2.589 1.00 0.00 H new ATOM 0 HG3 ARG B 116 10.294 1.448 -2.370 1.00 0.00 H new ATOM 0 HD2 ARG B 116 8.809 1.927 -4.311 1.00 0.00 H new ATOM 0 HD3 ARG B 116 9.551 3.502 -4.512 1.00 0.00 H new ATOM 0 HE ARG B 116 11.750 1.953 -4.695 1.00 0.00 H new ATOM 0 HH11 ARG B 116 8.563 1.465 -6.206 1.00 0.00 H new ATOM 0 HH12 ARG B 116 9.244 0.601 -7.588 1.00 0.00 H new ATOM 0 HH21 ARG B 116 12.576 0.839 -6.447 1.00 0.00 H new ATOM 0 HH22 ARG B 116 11.506 0.249 -7.723 1.00 0.00 H new ATOM 3591 N VAL B 117 10.008 6.525 -2.983 1.00 0.00 N ATOM 3592 CA VAL B 117 9.965 7.388 -4.188 1.00 0.00 C ATOM 3593 C VAL B 117 10.701 6.682 -5.339 1.00 0.00 C ATOM 3594 O VAL B 117 11.695 6.009 -5.090 1.00 0.00 O ATOM 3595 CB VAL B 117 10.645 8.784 -3.911 1.00 0.00 C ATOM 3596 CG1 VAL B 117 10.398 9.793 -5.068 1.00 0.00 C ATOM 3597 CG2 VAL B 117 10.183 9.359 -2.554 1.00 0.00 C ATOM 0 H VAL B 117 10.757 6.764 -2.333 1.00 0.00 H new ATOM 0 HA VAL B 117 8.922 7.561 -4.454 1.00 0.00 H new ATOM 0 HB VAL B 117 11.721 8.619 -3.861 1.00 0.00 H new ATOM 0 HG11 VAL B 117 10.884 10.740 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.810 9.392 -5.994 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.327 9.955 -5.187 1.00 0.00 H new ATOM 0 HG21 VAL B 117 10.665 10.322 -2.384 1.00 0.00 H new ATOM 0 HG22 VAL B 117 9.101 9.491 -2.564 1.00 0.00 H new ATOM 0 HG23 VAL B 117 10.457 8.670 -1.755 1.00 0.00 H new ATOM 3607 N TYR B 118 10.191 6.771 -6.587 1.00 0.00 N ATOM 3608 CA TYR B 118 10.979 6.351 -7.769 1.00 0.00 C ATOM 3609 C TYR B 118 10.730 7.251 -8.987 1.00 0.00 C ATOM 3610 O TYR B 118 9.696 7.928 -9.068 1.00 0.00 O ATOM 3611 CB TYR B 118 10.805 4.839 -8.116 1.00 0.00 C ATOM 3612 CG TYR B 118 9.504 4.439 -8.828 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.311 4.279 -8.125 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.484 4.190 -10.210 1.00 0.00 C ATOM 3615 CE1 TYR B 118 7.155 3.887 -8.767 1.00 0.00 C ATOM 3616 CE2 TYR B 118 8.327 3.805 -10.854 1.00 0.00 C ATOM 3617 CZ TYR B 118 7.165 3.651 -10.131 1.00 0.00 C ATOM 3618 OH TYR B 118 6.009 3.248 -10.774 1.00 0.00 O ATOM 0 H TYR B 118 9.258 7.122 -6.801 1.00 0.00 H new ATOM 0 HA TYR B 118 12.024 6.479 -7.486 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.643 4.535 -8.743 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.876 4.267 -7.191 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.292 4.465 -7.061 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.394 4.302 -10.781 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.241 3.764 -8.205 1.00 0.00 H new ATOM 0 HE2 TYR B 118 8.332 3.625 -11.919 1.00 0.00 H new ATOM 0 HH TYR B 118 5.410 2.816 -10.130 1.00 0.00 H new ATOM 3628 N ALA B 119 11.656 7.193 -9.946 1.00 0.00 N ATOM 3629 CA ALA B 119 11.504 7.777 -11.281 1.00 0.00 C ATOM 3630 C ALA B 119 11.389 6.631 -12.273 1.00 0.00 C ATOM 3631 O ALA B 119 12.215 5.715 -12.229 1.00 0.00 O ATOM 3632 CB ALA B 119 12.716 8.640 -11.633 1.00 0.00 C ATOM 0 H ALA B 119 12.554 6.728 -9.813 1.00 0.00 H new ATOM 0 HA ALA B 119 10.618 8.412 -11.312 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.584 9.065 -12.628 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.813 9.445 -10.905 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.617 8.026 -11.617 1.00 0.00 H new ATOM 3638 N PHE B 120 10.382 6.668 -13.156 1.00 0.00 N ATOM 3639 CA PHE B 120 10.110 5.559 -14.082 1.00 0.00 C ATOM 3640 C PHE B 120 11.229 5.444 -15.137 1.00 0.00 C ATOM 3641 O PHE B 120 11.537 6.423 -15.822 1.00 0.00 O ATOM 3642 CB PHE B 120 8.734 5.747 -14.768 1.00 0.00 C ATOM 3643 CG PHE B 120 8.291 4.531 -15.586 1.00 0.00 C ATOM 3644 CD1 PHE B 120 7.815 3.385 -14.946 1.00 0.00 C ATOM 3645 CD2 PHE B 120 8.355 4.527 -16.984 1.00 0.00 C ATOM 3646 CE1 PHE B 120 7.419 2.281 -15.673 1.00 0.00 C ATOM 3647 CE2 PHE B 120 7.956 3.421 -17.705 1.00 0.00 C ATOM 3648 CZ PHE B 120 7.488 2.300 -17.051 1.00 0.00 C ATOM 0 H PHE B 120 9.741 7.456 -13.249 1.00 0.00 H new ATOM 0 HA PHE B 120 10.084 4.633 -13.507 1.00 0.00 H new ATOM 0 HB2 PHE B 120 7.983 5.957 -14.007 1.00 0.00 H new ATOM 0 HB3 PHE B 120 8.778 6.618 -15.421 1.00 0.00 H new ATOM 0 HD1 PHE B 120 7.756 3.362 -13.868 1.00 0.00 H new ATOM 0 HD2 PHE B 120 8.721 5.400 -17.504 1.00 0.00 H new ATOM 0 HE1 PHE B 120 7.055 1.401 -15.163 1.00 0.00 H new ATOM 0 HE2 PHE B 120 8.010 3.433 -18.784 1.00 0.00 H new ATOM 0 HZ PHE B 120 7.175 1.436 -17.618 1.00 0.00 H new ATOM 3658 N ALA B 121 11.854 4.256 -15.217 1.00 0.00 N ATOM 3659 CA ALA B 121 12.811 3.915 -16.277 1.00 0.00 C ATOM 3660 C ALA B 121 12.127 2.985 -17.284 1.00 0.00 C ATOM 3661 O ALA B 121 11.865 1.819 -16.982 1.00 0.00 O ATOM 3662 CB ALA B 121 14.072 3.265 -15.685 1.00 0.00 C ATOM 0 H ALA B 121 11.707 3.504 -14.544 1.00 0.00 H new ATOM 0 HA ALA B 121 13.128 4.824 -16.789 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.767 3.021 -16.488 1.00 0.00 H new ATOM 0 HB2 ALA B 121 14.548 3.959 -14.992 1.00 0.00 H new ATOM 0 HB3 ALA B 121 13.797 2.354 -15.154 1.00 0.00 H new ATOM 3668 N GLY B 122 11.805 3.523 -18.463 1.00 0.00 N ATOM 3669 CA GLY B 122 11.134 2.763 -19.505 1.00 0.00 C ATOM 3670 C GLY B 122 10.864 3.633 -20.732 1.00 0.00 C ATOM 3671 O GLY B 122 9.789 4.255 -20.805 1.00 0.00 O ATOM 3672 OXT GLY B 122 11.740 3.719 -21.615 1.00 0.00 O ATOM 0 H GLY B 122 12.003 4.491 -18.715 1.00 0.00 H new ATOM 0 HA2 GLY B 122 11.748 1.908 -19.789 1.00 0.00 H new ATOM 0 HA3 GLY B 122 10.194 2.367 -19.122 1.00 0.00 H new TER 3676 GLY B 122