USER MOD reduce.3.24.130724 H: found=0, std=0, add=1322, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1322 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 155 HIS :FLIP no HD1:sc= 0.0312 F(o=-0.47,f=0.068) USER MOD Set 1.2: A 158 HIS : no HD1:sc= 0.0366 X(o=0.068,f=-0.0039) USER MOD Set 2.1: A 42 ASN : amide:sc= -2.78 K(o=-2.8,f=-11!) USER MOD Set 2.2: A 143 THR OG1 : rot -160:sc= 0 USER MOD Set 3.1: A 24 CYS SG : rot 108:sc= -0.312 USER MOD Set 3.2: A 26 SER OG : rot 83:sc= 0.929 USER MOD Set 3.3: A 80 SER OG : rot 153:sc= -0.695! USER MOD Set 3.4: A 114 LYS NZ :NH3+ -124:sc= 0.615 (180deg=0.365!) USER MOD Set 4.1: A 34 MET CE :methyl 149:sc= -0.15 (180deg=-1.41) USER MOD Set 4.2: A 113 TYR OH : rot 66:sc= -0.223 USER MOD Set 5.1: A 65 SER OG : rot 70:sc= 1.7 USER MOD Set 5.2: A 94 LYS NZ :NH3+ -163:sc= 0.949 (180deg=0) USER MOD Set 6.1: A 22 CYS SG : rot -107:sc= -4.26! USER MOD Set 6.2: A 83 TYR OH : rot -111:sc= 0.011 USER MOD Set 6.3: A 92 GLN : amide:sc= -2.98! K(o=-7.2!,f=-8.1) USER MOD Set 7.1: A 48 CYS SG : rot 110:sc= -5.66! USER MOD Set 7.2: A 72 CYS SG : rot -121:sc= -0.365! USER MOD Single : A 1 MET CE :methyl 160:sc= -0.179 (180deg=-0.794) USER MOD Single : A 1 MET N :NH3+ -127:sc= 0.00716 (180deg=-0.159) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -0.0563 X(o=-0.056,f=0) USER MOD Single : A 13 MET CE :methyl -131:sc= 0 (180deg=-0.701) USER MOD Single : A 23 TYR OH : rot 71:sc= 0.48 USER MOD Single : A 29 GLN : amide:sc= -0.343 X(o=-0.34,f=-0.13) USER MOD Single : A 32 GLN : amide:sc= 0.0554 K(o=0.055,f=-0.53) USER MOD Single : A 37 GLN : amide:sc= -3.65! C(o=-3.6!,f=-7!) USER MOD Single : A 40 GLN : amide:sc=-0.00643 K(o=-0.0064,f=-0.92) USER MOD Single : A 41 THR OG1 : rot -37:sc= 0.973 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot -80:sc= -1.41 USER MOD Single : A 59 CYS SG : rot -22:sc= -2.08! USER MOD Single : A 62 SER OG : rot -166:sc= 0.407 USER MOD Single : A 70 LYS NZ :NH3+ -173:sc= 0.625 (180deg=0.6) USER MOD Single : A 75 MET CE :methyl -170:sc= -0.325 (180deg=-0.612) USER MOD Single : A 85 GLN : amide:sc= -1.38 K(o=-1.4,f=-6.2!) USER MOD Single : A 86 SER OG : rot 53:sc= 0.85 USER MOD Single : A 87 LYS NZ :NH3+ -174:sc= 1.26 (180deg=1.09) USER MOD Single : A 89 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 69:sc= 1.13 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 HIS : no HE2:sc= -0.166 K(o=-0.17,f=-2.4) USER MOD Single : A 105 GLN : amide:sc= -0.151 K(o=-0.15,f=-1.8!) USER MOD Single : A 106 LYS NZ :NH3+ -168:sc=-0.00226 (180deg=-0.162) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 MET CE :methyl 154:sc= -1.99 (180deg=-3.73!) USER MOD Single : A 117 LYS NZ :NH3+ -166:sc= -0.0131 (180deg=-0.238) USER MOD Single : A 118 LYS NZ :NH3+ -167:sc= -0.0303 (180deg=-0.244) USER MOD Single : A 122 SER OG : rot 171:sc= 1.17 USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.299 USER MOD Single : A 130 CYS SG : rot -100:sc= -0.49! USER MOD Single : A 132 TYR OH : rot 52:sc= 0.809 USER MOD Single : A 133 THR OG1 : rot 180:sc=-0.00103 USER MOD Single : A 134 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 136 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot -119:sc= 0.948 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 64:sc= 0.698 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 72:sc= 0.107 USER MOD Single : A 156 HIS : no HE2:sc= 0.408 K(o=0.41,f=-1.9!) USER MOD Single : A 157 HIS : no HE2:sc= 0.222 K(o=0.22,f=-2.8!) USER MOD Single : A 159 HIS : no HD1:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 160 HIS : no HE2:sc= -0.07 K(o=-0.07,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.941 9.572 -25.026 1.00 0.00 N ATOM 2 CA MET A 1 19.220 10.154 -23.685 1.00 0.00 C ATOM 3 C MET A 1 18.506 9.368 -22.577 1.00 0.00 C ATOM 4 O MET A 1 17.447 8.781 -22.804 1.00 0.00 O ATOM 5 CB MET A 1 18.783 11.624 -23.640 1.00 0.00 C ATOM 6 CG MET A 1 19.541 12.517 -24.613 1.00 0.00 C ATOM 7 SD MET A 1 19.022 14.244 -24.527 1.00 0.00 S ATOM 8 CE MET A 1 19.396 14.635 -22.817 1.00 0.00 C ATOM 0 H1 MET A 1 19.839 9.384 -25.517 1.00 0.00 H new ATOM 0 H2 MET A 1 18.414 8.682 -24.915 1.00 0.00 H new ATOM 0 H3 MET A 1 18.375 10.242 -25.584 1.00 0.00 H new ATOM 0 HA MET A 1 20.295 10.091 -23.513 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.717 11.684 -23.860 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.921 12.004 -22.628 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.608 12.452 -24.402 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.393 12.148 -25.628 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.472 15.716 -22.699 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.602 14.255 -22.175 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.342 14.172 -22.536 1.00 0.00 H new ATOM 20 N GLY A 2 19.092 9.358 -21.382 1.00 0.00 N ATOM 21 CA GLY A 2 18.491 8.653 -20.255 1.00 0.00 C ATOM 22 C GLY A 2 17.280 9.378 -19.675 1.00 0.00 C ATOM 23 O GLY A 2 17.099 10.578 -19.890 1.00 0.00 O ATOM 0 H GLY A 2 19.974 9.825 -21.171 1.00 0.00 H new ATOM 0 HA2 GLY A 2 18.191 7.655 -20.576 1.00 0.00 H new ATOM 0 HA3 GLY A 2 19.239 8.525 -19.473 1.00 0.00 H new ATOM 27 N ILE A 3 16.451 8.651 -18.928 1.00 0.00 N ATOM 28 CA ILE A 3 15.240 9.231 -18.326 1.00 0.00 C ATOM 29 C ILE A 3 15.564 10.143 -17.127 1.00 0.00 C ATOM 30 O ILE A 3 14.698 10.881 -16.648 1.00 0.00 O ATOM 31 CB ILE A 3 14.255 8.125 -17.868 1.00 0.00 C ATOM 32 CG1 ILE A 3 14.910 7.227 -16.802 1.00 0.00 C ATOM 33 CG2 ILE A 3 13.784 7.300 -19.066 1.00 0.00 C ATOM 34 CD1 ILE A 3 14.011 6.120 -16.294 1.00 0.00 C ATOM 0 H ILE A 3 16.590 7.662 -18.722 1.00 0.00 H new ATOM 0 HA ILE A 3 14.774 9.835 -19.104 1.00 0.00 H new ATOM 0 HB ILE A 3 13.382 8.600 -17.419 1.00 0.00 H new ATOM 0 HG12 ILE A 3 15.814 6.784 -17.220 1.00 0.00 H new ATOM 0 HG13 ILE A 3 15.219 7.846 -15.960 1.00 0.00 H new ATOM 0 HG21 ILE A 3 13.093 6.528 -18.727 1.00 0.00 H new ATOM 0 HG22 ILE A 3 13.279 7.951 -19.780 1.00 0.00 H new ATOM 0 HG23 ILE A 3 14.644 6.832 -19.546 1.00 0.00 H new ATOM 0 HD11 ILE A 3 14.544 5.532 -15.547 1.00 0.00 H new ATOM 0 HD12 ILE A 3 13.118 6.554 -15.844 1.00 0.00 H new ATOM 0 HD13 ILE A 3 13.723 5.476 -17.124 1.00 0.00 H new ATOM 46 N THR A 4 16.808 10.082 -16.647 1.00 0.00 N ATOM 47 CA THR A 4 17.246 10.893 -15.499 1.00 0.00 C ATOM 48 C THR A 4 16.963 12.392 -15.689 1.00 0.00 C ATOM 49 O THR A 4 17.164 12.952 -16.771 1.00 0.00 O ATOM 50 CB THR A 4 18.757 10.711 -15.210 1.00 0.00 C ATOM 51 OG1 THR A 4 19.157 11.550 -14.112 1.00 0.00 O ATOM 52 CG2 THR A 4 19.602 11.034 -16.441 1.00 0.00 C ATOM 0 H THR A 4 17.534 9.479 -17.034 1.00 0.00 H new ATOM 0 HA THR A 4 16.663 10.531 -14.652 1.00 0.00 H new ATOM 0 HB THR A 4 18.922 9.666 -14.948 1.00 0.00 H new ATOM 0 HG1 THR A 4 20.113 11.426 -13.937 1.00 0.00 H new ATOM 0 HG21 THR A 4 20.657 10.896 -16.204 1.00 0.00 H new ATOM 0 HG22 THR A 4 19.324 10.369 -17.258 1.00 0.00 H new ATOM 0 HG23 THR A 4 19.429 12.068 -16.740 1.00 0.00 H new ATOM 60 N THR A 5 16.493 13.035 -14.627 1.00 0.00 N ATOM 61 CA THR A 5 16.199 14.474 -14.645 1.00 0.00 C ATOM 62 C THR A 5 16.680 15.136 -13.350 1.00 0.00 C ATOM 63 O THR A 5 16.276 14.738 -12.254 1.00 0.00 O ATOM 64 CB THR A 5 14.680 14.745 -14.812 1.00 0.00 C ATOM 65 OG1 THR A 5 14.184 14.111 -16.004 1.00 0.00 O ATOM 66 CG2 THR A 5 14.390 16.244 -14.879 1.00 0.00 C ATOM 0 H THR A 5 16.304 12.583 -13.732 1.00 0.00 H new ATOM 0 HA THR A 5 16.728 14.898 -15.499 1.00 0.00 H new ATOM 0 HB THR A 5 14.174 14.329 -13.941 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.225 14.290 -16.095 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.318 16.402 -14.996 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.729 16.722 -13.960 1.00 0.00 H new ATOM 0 HG23 THR A 5 14.916 16.679 -15.729 1.00 0.00 H new ATOM 74 N LEU A 6 17.551 16.138 -13.470 1.00 0.00 N ATOM 75 CA LEU A 6 18.074 16.837 -12.294 1.00 0.00 C ATOM 76 C LEU A 6 16.982 17.723 -11.674 1.00 0.00 C ATOM 77 O LEU A 6 16.821 18.893 -12.036 1.00 0.00 O ATOM 78 CB LEU A 6 19.324 17.665 -12.663 1.00 0.00 C ATOM 79 CG LEU A 6 20.324 17.937 -11.512 1.00 0.00 C ATOM 80 CD1 LEU A 6 21.596 18.588 -12.048 1.00 0.00 C ATOM 81 CD2 LEU A 6 19.705 18.810 -10.420 1.00 0.00 C ATOM 0 H LEU A 6 17.908 16.482 -14.361 1.00 0.00 H new ATOM 0 HA LEU A 6 18.374 16.098 -11.551 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.854 17.148 -13.463 1.00 0.00 H new ATOM 0 HB3 LEU A 6 18.995 18.623 -13.065 1.00 0.00 H new ATOM 0 HG LEU A 6 20.578 16.975 -11.067 1.00 0.00 H new ATOM 0 HD11 LEU A 6 22.286 18.771 -11.224 1.00 0.00 H new ATOM 0 HD12 LEU A 6 22.066 17.925 -12.774 1.00 0.00 H new ATOM 0 HD13 LEU A 6 21.346 19.534 -12.529 1.00 0.00 H new ATOM 0 HD21 LEU A 6 20.437 18.979 -9.630 1.00 0.00 H new ATOM 0 HD22 LEU A 6 19.404 19.767 -10.846 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.832 18.308 -10.004 1.00 0.00 H new ATOM 93 N ASP A 7 16.204 17.135 -10.772 1.00 0.00 N ATOM 94 CA ASP A 7 15.147 17.858 -10.057 1.00 0.00 C ATOM 95 C ASP A 7 15.529 18.063 -8.583 1.00 0.00 C ATOM 96 O ASP A 7 14.866 18.790 -7.837 1.00 0.00 O ATOM 97 CB ASP A 7 13.826 17.083 -10.180 1.00 0.00 C ATOM 98 CG ASP A 7 12.644 17.816 -9.568 1.00 0.00 C ATOM 99 OD1 ASP A 7 12.252 18.872 -10.107 1.00 0.00 O ATOM 100 OD2 ASP A 7 12.101 17.344 -8.545 1.00 0.00 O ATOM 0 H ASP A 7 16.283 16.151 -10.514 1.00 0.00 H new ATOM 0 HA ASP A 7 15.022 18.844 -10.504 1.00 0.00 H new ATOM 0 HB2 ASP A 7 13.621 16.892 -11.233 1.00 0.00 H new ATOM 0 HB3 ASP A 7 13.935 16.113 -9.695 1.00 0.00 H new ATOM 105 N ASP A 8 16.630 17.440 -8.195 1.00 0.00 N ATOM 106 CA ASP A 8 17.125 17.488 -6.817 1.00 0.00 C ATOM 107 C ASP A 8 18.587 17.979 -6.787 1.00 0.00 C ATOM 108 O ASP A 8 19.493 17.269 -7.232 1.00 0.00 O ATOM 109 CB ASP A 8 17.022 16.090 -6.189 1.00 0.00 C ATOM 110 CG ASP A 8 17.155 16.102 -4.675 1.00 0.00 C ATOM 111 OD1 ASP A 8 18.023 16.824 -4.144 1.00 0.00 O ATOM 112 OD2 ASP A 8 16.400 15.374 -4.008 1.00 0.00 O ATOM 0 H ASP A 8 17.211 16.884 -8.823 1.00 0.00 H new ATOM 0 HA ASP A 8 16.517 18.187 -6.243 1.00 0.00 H new ATOM 0 HB2 ASP A 8 16.063 15.647 -6.459 1.00 0.00 H new ATOM 0 HB3 ASP A 8 17.798 15.451 -6.610 1.00 0.00 H new ATOM 117 N PRO A 9 18.838 19.201 -6.271 1.00 0.00 N ATOM 118 CA PRO A 9 20.199 19.771 -6.194 1.00 0.00 C ATOM 119 C PRO A 9 21.209 18.859 -5.469 1.00 0.00 C ATOM 120 O PRO A 9 22.358 18.730 -5.893 1.00 0.00 O ATOM 121 CB PRO A 9 19.992 21.076 -5.409 1.00 0.00 C ATOM 122 CG PRO A 9 18.564 21.437 -5.647 1.00 0.00 C ATOM 123 CD PRO A 9 17.821 20.130 -5.738 1.00 0.00 C ATOM 0 HA PRO A 9 20.627 19.908 -7.187 1.00 0.00 H new ATOM 0 HB2 PRO A 9 20.194 20.936 -4.347 1.00 0.00 H new ATOM 0 HB3 PRO A 9 20.663 21.860 -5.760 1.00 0.00 H new ATOM 0 HG2 PRO A 9 18.176 22.052 -4.835 1.00 0.00 H new ATOM 0 HG3 PRO A 9 18.454 22.014 -6.565 1.00 0.00 H new ATOM 0 HD2 PRO A 9 17.452 19.808 -4.764 1.00 0.00 H new ATOM 0 HD3 PRO A 9 16.957 20.203 -6.398 1.00 0.00 H new ATOM 131 N LEU A 10 20.772 18.221 -4.384 1.00 0.00 N ATOM 132 CA LEU A 10 21.662 17.380 -3.567 1.00 0.00 C ATOM 133 C LEU A 10 21.537 15.885 -3.920 1.00 0.00 C ATOM 134 O LEU A 10 22.468 15.107 -3.710 1.00 0.00 O ATOM 135 CB LEU A 10 21.351 17.589 -2.077 1.00 0.00 C ATOM 136 CG LEU A 10 21.470 19.041 -1.578 1.00 0.00 C ATOM 137 CD1 LEU A 10 21.145 19.128 -0.088 1.00 0.00 C ATOM 138 CD2 LEU A 10 22.863 19.600 -1.862 1.00 0.00 C ATOM 0 H LEU A 10 19.811 18.267 -4.047 1.00 0.00 H new ATOM 0 HA LEU A 10 22.687 17.683 -3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 10 20.338 17.237 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 10 22.025 16.964 -1.491 1.00 0.00 H new ATOM 0 HG LEU A 10 20.745 19.647 -2.121 1.00 0.00 H new ATOM 0 HD11 LEU A 10 21.235 20.162 0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 10 20.127 18.779 0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 10 21.841 18.505 0.473 1.00 0.00 H new ATOM 0 HD21 LEU A 10 22.924 20.627 -1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 10 23.610 18.991 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 10 23.051 19.581 -2.936 1.00 0.00 H new ATOM 150 N GLY A 11 20.390 15.496 -4.463 1.00 0.00 N ATOM 151 CA GLY A 11 20.120 14.088 -4.749 1.00 0.00 C ATOM 152 C GLY A 11 19.517 13.347 -3.556 1.00 0.00 C ATOM 153 O GLY A 11 19.593 12.120 -3.471 1.00 0.00 O ATOM 0 H GLY A 11 19.633 16.131 -4.714 1.00 0.00 H new ATOM 0 HA2 GLY A 11 19.438 14.018 -5.597 1.00 0.00 H new ATOM 0 HA3 GLY A 11 21.047 13.598 -5.045 1.00 0.00 H new ATOM 157 N HIS A 12 18.906 14.096 -2.635 1.00 0.00 N ATOM 158 CA HIS A 12 18.329 13.522 -1.411 1.00 0.00 C ATOM 159 C HIS A 12 16.935 14.097 -1.116 1.00 0.00 C ATOM 160 O HIS A 12 16.806 15.126 -0.451 1.00 0.00 O ATOM 161 CB HIS A 12 19.254 13.773 -0.207 1.00 0.00 C ATOM 162 CG HIS A 12 20.537 12.997 -0.247 1.00 0.00 C ATOM 163 ND1 HIS A 12 20.780 11.913 0.565 1.00 0.00 N ATOM 164 CD2 HIS A 12 21.652 13.156 -0.999 1.00 0.00 C ATOM 165 CE1 HIS A 12 21.983 11.440 0.317 1.00 0.00 C ATOM 166 NE2 HIS A 12 22.534 12.172 -0.626 1.00 0.00 N ATOM 0 H HIS A 12 18.796 15.107 -2.712 1.00 0.00 H new ATOM 0 HA HIS A 12 18.229 12.449 -1.575 1.00 0.00 H new ATOM 0 HB2 HIS A 12 19.487 14.837 -0.157 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.718 13.521 0.708 1.00 0.00 H new ATOM 0 HD2 HIS A 12 21.816 13.914 -1.751 1.00 0.00 H new ATOM 0 HE1 HIS A 12 22.441 10.593 0.806 1.00 0.00 H new ATOM 0 HE2 HIS A 12 23.466 12.032 -1.017 1.00 0.00 H new ATOM 175 N MET A 13 15.897 13.441 -1.630 1.00 0.00 N ATOM 176 CA MET A 13 14.512 13.836 -1.340 1.00 0.00 C ATOM 177 C MET A 13 14.101 13.435 0.087 1.00 0.00 C ATOM 178 O MET A 13 14.322 12.296 0.511 1.00 0.00 O ATOM 179 CB MET A 13 13.542 13.205 -2.355 1.00 0.00 C ATOM 180 CG MET A 13 13.561 13.860 -3.730 1.00 0.00 C ATOM 181 SD MET A 13 12.868 15.528 -3.715 1.00 0.00 S ATOM 182 CE MET A 13 13.162 16.035 -5.410 1.00 0.00 C ATOM 0 H MET A 13 15.984 12.635 -2.249 1.00 0.00 H new ATOM 0 HA MET A 13 14.460 14.922 -1.422 1.00 0.00 H new ATOM 0 HB2 MET A 13 13.786 12.148 -2.465 1.00 0.00 H new ATOM 0 HB3 MET A 13 12.530 13.258 -1.954 1.00 0.00 H new ATOM 0 HG2 MET A 13 14.587 13.900 -4.095 1.00 0.00 H new ATOM 0 HG3 MET A 13 12.998 13.243 -4.430 1.00 0.00 H new ATOM 0 HE1 MET A 13 13.628 17.020 -5.419 1.00 0.00 H new ATOM 0 HE2 MET A 13 13.822 15.316 -5.895 1.00 0.00 H new ATOM 0 HE3 MET A 13 12.214 16.077 -5.947 1.00 0.00 H new ATOM 192 N PRO A 14 13.525 14.377 0.859 1.00 0.00 N ATOM 193 CA PRO A 14 12.954 14.077 2.182 1.00 0.00 C ATOM 194 C PRO A 14 11.549 13.446 2.078 1.00 0.00 C ATOM 195 O PRO A 14 11.190 12.881 1.042 1.00 0.00 O ATOM 196 CB PRO A 14 12.896 15.461 2.839 1.00 0.00 C ATOM 197 CG PRO A 14 12.683 16.405 1.702 1.00 0.00 C ATOM 198 CD PRO A 14 13.410 15.812 0.520 1.00 0.00 C ATOM 0 HA PRO A 14 13.539 13.348 2.743 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.084 15.523 3.564 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.819 15.686 3.374 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.621 16.522 1.487 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.071 17.395 1.941 1.00 0.00 H new ATOM 0 HD2 PRO A 14 12.855 15.961 -0.406 1.00 0.00 H new ATOM 0 HD3 PRO A 14 14.389 16.270 0.382 1.00 0.00 H new ATOM 206 N GLU A 15 10.756 13.554 3.145 1.00 0.00 N ATOM 207 CA GLU A 15 9.402 12.971 3.181 1.00 0.00 C ATOM 208 C GLU A 15 8.390 13.793 2.353 1.00 0.00 C ATOM 209 O GLU A 15 7.299 14.119 2.828 1.00 0.00 O ATOM 210 CB GLU A 15 8.925 12.863 4.638 1.00 0.00 C ATOM 211 CG GLU A 15 9.770 11.927 5.496 1.00 0.00 C ATOM 212 CD GLU A 15 9.369 11.952 6.963 1.00 0.00 C ATOM 213 OE1 GLU A 15 8.332 11.355 7.316 1.00 0.00 O ATOM 214 OE2 GLU A 15 10.081 12.585 7.773 1.00 0.00 O ATOM 0 H GLU A 15 11.024 14.040 4.001 1.00 0.00 H new ATOM 0 HA GLU A 15 9.457 11.979 2.733 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.931 13.856 5.087 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.892 12.515 4.647 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.677 10.910 5.116 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.820 12.207 5.406 1.00 0.00 H new ATOM 221 N ARG A 16 8.745 14.104 1.106 1.00 0.00 N ATOM 222 CA ARG A 16 7.860 14.860 0.209 1.00 0.00 C ATOM 223 C ARG A 16 6.733 13.973 -0.340 1.00 0.00 C ATOM 224 O ARG A 16 5.716 14.471 -0.835 1.00 0.00 O ATOM 225 CB ARG A 16 8.663 15.468 -0.951 1.00 0.00 C ATOM 226 CG ARG A 16 9.684 16.513 -0.512 1.00 0.00 C ATOM 227 CD ARG A 16 10.412 17.140 -1.698 1.00 0.00 C ATOM 228 NE ARG A 16 11.357 18.178 -1.279 1.00 0.00 N ATOM 229 CZ ARG A 16 12.223 18.751 -2.075 1.00 0.00 C ATOM 230 NH1 ARG A 16 12.260 18.460 -3.336 1.00 0.00 N ATOM 231 NH2 ARG A 16 13.040 19.633 -1.603 1.00 0.00 N ATOM 0 H ARG A 16 9.640 13.845 0.690 1.00 0.00 H new ATOM 0 HA ARG A 16 7.408 15.665 0.789 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.180 14.668 -1.481 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.972 15.924 -1.659 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.180 17.294 0.057 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.411 16.050 0.155 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.946 16.364 -2.246 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.683 17.570 -2.384 1.00 0.00 H new ATOM 0 HE ARG A 16 11.339 18.473 -0.303 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.609 17.776 -3.721 1.00 0.00 H new ATOM 0 HH12 ARG A 16 12.941 18.915 -3.945 1.00 0.00 H new ATOM 0 HH21 ARG A 16 13.008 19.880 -0.614 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.717 20.083 -2.219 1.00 0.00 H new ATOM 245 N PHE A 17 6.923 12.660 -0.255 1.00 0.00 N ATOM 246 CA PHE A 17 5.905 11.696 -0.671 1.00 0.00 C ATOM 247 C PHE A 17 5.077 11.234 0.534 1.00 0.00 C ATOM 248 O PHE A 17 5.605 11.049 1.634 1.00 0.00 O ATOM 249 CB PHE A 17 6.555 10.483 -1.349 1.00 0.00 C ATOM 250 CG PHE A 17 7.355 10.818 -2.585 1.00 0.00 C ATOM 251 CD1 PHE A 17 8.634 11.346 -2.482 1.00 0.00 C ATOM 252 CD2 PHE A 17 6.831 10.593 -3.850 1.00 0.00 C ATOM 253 CE1 PHE A 17 9.371 11.642 -3.612 1.00 0.00 C ATOM 254 CE2 PHE A 17 7.566 10.885 -4.983 1.00 0.00 C ATOM 255 CZ PHE A 17 8.837 11.409 -4.864 1.00 0.00 C ATOM 0 H PHE A 17 7.779 12.235 0.101 1.00 0.00 H new ATOM 0 HA PHE A 17 5.246 12.188 -1.386 1.00 0.00 H new ATOM 0 HB2 PHE A 17 7.208 9.987 -0.631 1.00 0.00 H new ATOM 0 HB3 PHE A 17 5.775 9.770 -1.617 1.00 0.00 H new ATOM 0 HD1 PHE A 17 9.059 11.528 -1.506 1.00 0.00 H new ATOM 0 HD2 PHE A 17 5.836 10.185 -3.950 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.364 12.055 -3.516 1.00 0.00 H new ATOM 0 HE2 PHE A 17 7.146 10.703 -5.961 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.413 11.637 -5.749 1.00 0.00 H new ATOM 265 N ASP A 18 3.778 11.051 0.331 1.00 0.00 N ATOM 266 CA ASP A 18 2.886 10.625 1.409 1.00 0.00 C ATOM 267 C ASP A 18 2.988 9.111 1.662 1.00 0.00 C ATOM 268 O ASP A 18 3.017 8.662 2.811 1.00 0.00 O ATOM 269 CB ASP A 18 1.445 11.019 1.076 1.00 0.00 C ATOM 270 CG ASP A 18 1.313 12.514 0.851 1.00 0.00 C ATOM 271 OD1 ASP A 18 1.108 13.258 1.834 1.00 0.00 O ATOM 272 OD2 ASP A 18 1.434 12.957 -0.309 1.00 0.00 O ATOM 0 H ASP A 18 3.317 11.190 -0.568 1.00 0.00 H new ATOM 0 HA ASP A 18 3.194 11.130 2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.118 10.486 0.183 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.786 10.713 1.889 1.00 0.00 H new ATOM 277 N ALA A 19 3.061 8.324 0.588 1.00 0.00 N ATOM 278 CA ALA A 19 3.136 6.866 0.719 1.00 0.00 C ATOM 279 C ALA A 19 3.680 6.174 -0.542 1.00 0.00 C ATOM 280 O ALA A 19 3.684 6.738 -1.635 1.00 0.00 O ATOM 281 CB ALA A 19 1.762 6.302 1.063 1.00 0.00 C ATOM 0 H ALA A 19 3.070 8.665 -0.373 1.00 0.00 H new ATOM 0 HA ALA A 19 3.841 6.660 1.524 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.827 5.218 1.158 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.419 6.729 2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.056 6.555 0.272 1.00 0.00 H new ATOM 287 N PHE A 20 4.155 4.945 -0.362 1.00 0.00 N ATOM 288 CA PHE A 20 4.549 4.078 -1.477 1.00 0.00 C ATOM 289 C PHE A 20 3.486 2.986 -1.681 1.00 0.00 C ATOM 290 O PHE A 20 2.938 2.468 -0.715 1.00 0.00 O ATOM 291 CB PHE A 20 5.919 3.436 -1.186 1.00 0.00 C ATOM 292 CG PHE A 20 6.475 2.617 -2.331 1.00 0.00 C ATOM 293 CD1 PHE A 20 6.066 1.305 -2.536 1.00 0.00 C ATOM 294 CD2 PHE A 20 7.406 3.162 -3.204 1.00 0.00 C ATOM 295 CE1 PHE A 20 6.570 0.560 -3.584 1.00 0.00 C ATOM 296 CE2 PHE A 20 7.914 2.420 -4.253 1.00 0.00 C ATOM 297 CZ PHE A 20 7.496 1.118 -4.443 1.00 0.00 C ATOM 0 H PHE A 20 4.279 4.519 0.557 1.00 0.00 H new ATOM 0 HA PHE A 20 4.628 4.674 -2.386 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.631 4.223 -0.937 1.00 0.00 H new ATOM 0 HB3 PHE A 20 5.829 2.798 -0.307 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.344 0.862 -1.866 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.738 4.180 -3.062 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.240 -0.458 -3.732 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.638 2.858 -4.924 1.00 0.00 H new ATOM 0 HZ PHE A 20 7.893 0.537 -5.262 1.00 0.00 H new ATOM 307 N ILE A 21 3.193 2.638 -2.926 1.00 0.00 N ATOM 308 CA ILE A 21 2.176 1.621 -3.221 1.00 0.00 C ATOM 309 C ILE A 21 2.812 0.264 -3.563 1.00 0.00 C ATOM 310 O ILE A 21 3.315 0.057 -4.669 1.00 0.00 O ATOM 311 CB ILE A 21 1.253 2.069 -4.382 1.00 0.00 C ATOM 312 CG1 ILE A 21 0.609 3.428 -4.055 1.00 0.00 C ATOM 313 CG2 ILE A 21 0.178 1.011 -4.659 1.00 0.00 C ATOM 314 CD1 ILE A 21 -0.279 3.968 -5.156 1.00 0.00 C ATOM 0 H ILE A 21 3.640 3.040 -3.750 1.00 0.00 H new ATOM 0 HA ILE A 21 1.577 1.505 -2.317 1.00 0.00 H new ATOM 0 HB ILE A 21 1.857 2.180 -5.283 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.021 3.330 -3.143 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.397 4.152 -3.850 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.459 1.345 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.655 0.070 -4.932 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.427 0.865 -3.764 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.695 4.928 -4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.308 4.100 -6.065 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.090 3.265 -5.347 1.00 0.00 H new ATOM 326 N CYS A 22 2.798 -0.650 -2.597 1.00 0.00 N ATOM 327 CA CYS A 22 3.299 -2.014 -2.805 1.00 0.00 C ATOM 328 C CYS A 22 2.165 -2.930 -3.278 1.00 0.00 C ATOM 329 O CYS A 22 1.257 -3.254 -2.509 1.00 0.00 O ATOM 330 CB CYS A 22 3.908 -2.567 -1.509 1.00 0.00 C ATOM 331 SG CYS A 22 4.462 -4.286 -1.624 1.00 0.00 S ATOM 0 H CYS A 22 2.444 -0.474 -1.657 1.00 0.00 H new ATOM 0 HA CYS A 22 4.073 -1.981 -3.571 1.00 0.00 H new ATOM 0 HB2 CYS A 22 4.755 -1.943 -1.223 1.00 0.00 H new ATOM 0 HB3 CYS A 22 3.170 -2.488 -0.711 1.00 0.00 H new ATOM 0 HG CYS A 22 3.645 -5.050 -0.962 1.00 0.00 H new ATOM 337 N TYR A 23 2.208 -3.338 -4.545 1.00 0.00 N ATOM 338 CA TYR A 23 1.116 -4.125 -5.129 1.00 0.00 C ATOM 339 C TYR A 23 1.626 -5.264 -6.019 1.00 0.00 C ATOM 340 O TYR A 23 2.772 -5.258 -6.467 1.00 0.00 O ATOM 341 CB TYR A 23 0.194 -3.210 -5.949 1.00 0.00 C ATOM 342 CG TYR A 23 0.802 -2.702 -7.249 1.00 0.00 C ATOM 343 CD1 TYR A 23 1.593 -1.555 -7.280 1.00 0.00 C ATOM 344 CD2 TYR A 23 0.573 -3.370 -8.448 1.00 0.00 C ATOM 345 CE1 TYR A 23 2.133 -1.094 -8.469 1.00 0.00 C ATOM 346 CE2 TYR A 23 1.112 -2.918 -9.632 1.00 0.00 C ATOM 347 CZ TYR A 23 1.890 -1.781 -9.641 1.00 0.00 C ATOM 348 OH TYR A 23 2.414 -1.327 -10.832 1.00 0.00 O ATOM 0 H TYR A 23 2.978 -3.141 -5.184 1.00 0.00 H new ATOM 0 HA TYR A 23 0.566 -4.574 -4.302 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.723 -3.752 -6.179 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.087 -2.354 -5.335 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.788 -1.018 -6.363 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.039 -4.260 -8.450 1.00 0.00 H new ATOM 0 HE1 TYR A 23 2.741 -0.202 -8.479 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.925 -3.453 -10.551 1.00 0.00 H new ATOM 0 HH TYR A 23 3.383 -1.472 -10.839 1.00 0.00 H new ATOM 358 N CYS A 24 0.754 -6.235 -6.276 1.00 0.00 N ATOM 359 CA CYS A 24 1.039 -7.312 -7.229 1.00 0.00 C ATOM 360 C CYS A 24 0.447 -6.976 -8.608 1.00 0.00 C ATOM 361 O CYS A 24 -0.732 -6.630 -8.716 1.00 0.00 O ATOM 362 CB CYS A 24 0.463 -8.640 -6.719 1.00 0.00 C ATOM 363 SG CYS A 24 -1.302 -8.579 -6.324 1.00 0.00 S ATOM 0 H CYS A 24 -0.164 -6.301 -5.835 1.00 0.00 H new ATOM 0 HA CYS A 24 2.120 -7.411 -7.326 1.00 0.00 H new ATOM 0 HB2 CYS A 24 0.629 -9.409 -7.474 1.00 0.00 H new ATOM 0 HB3 CYS A 24 1.013 -8.944 -5.828 1.00 0.00 H new ATOM 0 HG CYS A 24 -1.972 -9.230 -7.228 1.00 0.00 H new ATOM 369 N PRO A 25 1.252 -7.075 -9.688 1.00 0.00 N ATOM 370 CA PRO A 25 0.810 -6.729 -11.057 1.00 0.00 C ATOM 371 C PRO A 25 -0.436 -7.512 -11.517 1.00 0.00 C ATOM 372 O PRO A 25 -1.111 -7.119 -12.471 1.00 0.00 O ATOM 373 CB PRO A 25 2.028 -7.079 -11.933 1.00 0.00 C ATOM 374 CG PRO A 25 2.884 -7.964 -11.085 1.00 0.00 C ATOM 375 CD PRO A 25 2.657 -7.520 -9.668 1.00 0.00 C ATOM 0 HA PRO A 25 0.507 -5.684 -11.120 1.00 0.00 H new ATOM 0 HB2 PRO A 25 1.722 -7.587 -12.847 1.00 0.00 H new ATOM 0 HB3 PRO A 25 2.567 -6.181 -12.233 1.00 0.00 H new ATOM 0 HG2 PRO A 25 2.612 -9.011 -11.215 1.00 0.00 H new ATOM 0 HG3 PRO A 25 3.935 -7.871 -11.360 1.00 0.00 H new ATOM 0 HD2 PRO A 25 2.814 -8.333 -8.959 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.333 -6.714 -9.383 1.00 0.00 H new ATOM 383 N SER A 26 -0.738 -8.613 -10.834 1.00 0.00 N ATOM 384 CA SER A 26 -1.924 -9.430 -11.139 1.00 0.00 C ATOM 385 C SER A 26 -3.226 -8.639 -10.941 1.00 0.00 C ATOM 386 O SER A 26 -4.218 -8.856 -11.640 1.00 0.00 O ATOM 387 CB SER A 26 -1.949 -10.669 -10.240 1.00 0.00 C ATOM 388 OG SER A 26 -2.014 -10.294 -8.871 1.00 0.00 O ATOM 0 H SER A 26 -0.177 -8.967 -10.059 1.00 0.00 H new ATOM 0 HA SER A 26 -1.858 -9.726 -12.186 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.808 -11.291 -10.493 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.057 -11.270 -10.416 1.00 0.00 H new ATOM 0 HG SER A 26 -2.945 -10.109 -8.626 1.00 0.00 H new ATOM 394 N ASP A 27 -3.217 -7.726 -9.974 1.00 0.00 N ATOM 395 CA ASP A 27 -4.390 -6.901 -9.669 1.00 0.00 C ATOM 396 C ASP A 27 -4.129 -5.417 -9.988 1.00 0.00 C ATOM 397 O ASP A 27 -4.711 -4.518 -9.373 1.00 0.00 O ATOM 398 CB ASP A 27 -4.778 -7.093 -8.196 1.00 0.00 C ATOM 399 CG ASP A 27 -5.191 -8.527 -7.907 1.00 0.00 C ATOM 400 OD1 ASP A 27 -6.365 -8.877 -8.158 1.00 0.00 O ATOM 401 OD2 ASP A 27 -4.343 -9.324 -7.451 1.00 0.00 O ATOM 0 H ASP A 27 -2.408 -7.536 -9.383 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.220 -7.220 -10.299 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.936 -6.821 -7.559 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.598 -6.420 -7.945 1.00 0.00 H new ATOM 406 N ILE A 28 -3.280 -5.175 -10.993 1.00 0.00 N ATOM 407 CA ILE A 28 -2.933 -3.812 -11.418 1.00 0.00 C ATOM 408 C ILE A 28 -4.177 -2.997 -11.825 1.00 0.00 C ATOM 409 O ILE A 28 -4.228 -1.786 -11.610 1.00 0.00 O ATOM 410 CB ILE A 28 -1.919 -3.826 -12.599 1.00 0.00 C ATOM 411 CG1 ILE A 28 -1.566 -2.394 -13.045 1.00 0.00 C ATOM 412 CG2 ILE A 28 -2.469 -4.630 -13.777 1.00 0.00 C ATOM 413 CD1 ILE A 28 -0.974 -1.530 -11.951 1.00 0.00 C ATOM 0 H ILE A 28 -2.818 -5.909 -11.530 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.472 -3.332 -10.555 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.006 -4.307 -12.247 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.859 -2.447 -13.873 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -2.466 -1.912 -13.426 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.744 -4.626 -14.591 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.655 -5.657 -13.462 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.401 -4.181 -14.120 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -0.754 -0.539 -12.349 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.687 -1.442 -11.131 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.054 -1.986 -11.585 1.00 0.00 H new ATOM 425 N GLN A 29 -5.179 -3.666 -12.397 1.00 0.00 N ATOM 426 CA GLN A 29 -6.416 -2.995 -12.827 1.00 0.00 C ATOM 427 C GLN A 29 -7.030 -2.153 -11.697 1.00 0.00 C ATOM 428 O GLN A 29 -7.440 -1.010 -11.910 1.00 0.00 O ATOM 429 CB GLN A 29 -7.436 -4.026 -13.328 1.00 0.00 C ATOM 430 CG GLN A 29 -7.025 -4.733 -14.615 1.00 0.00 C ATOM 431 CD GLN A 29 -6.869 -3.780 -15.789 1.00 0.00 C ATOM 432 OE1 GLN A 29 -7.821 -3.496 -16.507 1.00 0.00 O ATOM 433 NE2 GLN A 29 -5.669 -3.278 -15.999 1.00 0.00 N ATOM 0 H GLN A 29 -5.163 -4.670 -12.575 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.156 -2.320 -13.642 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.594 -4.773 -12.550 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.392 -3.527 -13.489 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.083 -5.257 -14.451 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.771 -5.488 -14.863 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.895 -3.532 -15.385 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.514 -2.635 -16.776 1.00 0.00 H new ATOM 442 N PHE A 30 -7.074 -2.722 -10.493 1.00 0.00 N ATOM 443 CA PHE A 30 -7.613 -2.021 -9.323 1.00 0.00 C ATOM 444 C PHE A 30 -6.697 -0.862 -8.900 1.00 0.00 C ATOM 445 O PHE A 30 -7.165 0.225 -8.560 1.00 0.00 O ATOM 446 CB PHE A 30 -7.788 -2.998 -8.154 1.00 0.00 C ATOM 447 CG PHE A 30 -8.675 -4.178 -8.472 1.00 0.00 C ATOM 448 CD1 PHE A 30 -10.055 -4.039 -8.507 1.00 0.00 C ATOM 449 CD2 PHE A 30 -8.125 -5.425 -8.739 1.00 0.00 C ATOM 450 CE1 PHE A 30 -10.868 -5.117 -8.801 1.00 0.00 C ATOM 451 CE2 PHE A 30 -8.934 -6.506 -9.033 1.00 0.00 C ATOM 452 CZ PHE A 30 -10.306 -6.352 -9.064 1.00 0.00 C ATOM 0 H PHE A 30 -6.743 -3.667 -10.300 1.00 0.00 H new ATOM 0 HA PHE A 30 -8.584 -1.609 -9.597 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -6.808 -3.364 -7.849 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -8.206 -2.460 -7.303 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -10.499 -3.076 -8.302 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -7.053 -5.551 -8.717 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -11.941 -4.995 -8.825 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.494 -7.471 -9.238 1.00 0.00 H new ATOM 0 HZ PHE A 30 -10.939 -7.196 -9.294 1.00 0.00 H new ATOM 462 N VAL A 31 -5.387 -1.106 -8.933 1.00 0.00 N ATOM 463 CA VAL A 31 -4.393 -0.091 -8.561 1.00 0.00 C ATOM 464 C VAL A 31 -4.476 1.145 -9.477 1.00 0.00 C ATOM 465 O VAL A 31 -4.415 2.284 -9.009 1.00 0.00 O ATOM 466 CB VAL A 31 -2.958 -0.676 -8.610 1.00 0.00 C ATOM 467 CG1 VAL A 31 -1.922 0.358 -8.168 1.00 0.00 C ATOM 468 CG2 VAL A 31 -2.866 -1.940 -7.756 1.00 0.00 C ATOM 0 H VAL A 31 -4.985 -2.000 -9.214 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.619 0.218 -7.540 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.737 -0.942 -9.644 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.926 -0.083 -8.213 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.966 1.223 -8.829 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.134 0.671 -7.146 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.852 -2.337 -7.802 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.115 -1.700 -6.722 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.565 -2.686 -8.134 1.00 0.00 H new ATOM 478 N GLN A 32 -4.622 0.907 -10.782 1.00 0.00 N ATOM 479 CA GLN A 32 -4.767 1.992 -11.762 1.00 0.00 C ATOM 480 C GLN A 32 -5.994 2.861 -11.448 1.00 0.00 C ATOM 481 O GLN A 32 -5.939 4.091 -11.527 1.00 0.00 O ATOM 482 CB GLN A 32 -4.885 1.416 -13.182 1.00 0.00 C ATOM 483 CG GLN A 32 -3.652 0.638 -13.632 1.00 0.00 C ATOM 484 CD GLN A 32 -3.787 0.050 -15.028 1.00 0.00 C ATOM 485 OE1 GLN A 32 -4.879 -0.278 -15.477 1.00 0.00 O ATOM 486 NE2 GLN A 32 -2.677 -0.082 -15.724 1.00 0.00 N ATOM 0 H GLN A 32 -4.643 -0.029 -11.188 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.877 2.619 -11.702 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -5.754 0.760 -13.228 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -5.064 2.232 -13.882 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -2.785 1.298 -13.606 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -3.461 -0.168 -12.923 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -1.785 0.201 -15.319 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -2.710 -0.468 -16.668 1.00 0.00 H new ATOM 495 N GLU A 33 -7.099 2.208 -11.088 1.00 0.00 N ATOM 496 CA GLU A 33 -8.326 2.912 -10.713 1.00 0.00 C ATOM 497 C GLU A 33 -8.121 3.717 -9.415 1.00 0.00 C ATOM 498 O GLU A 33 -8.501 4.886 -9.332 1.00 0.00 O ATOM 499 CB GLU A 33 -9.484 1.908 -10.555 1.00 0.00 C ATOM 500 CG GLU A 33 -10.839 2.562 -10.303 1.00 0.00 C ATOM 501 CD GLU A 33 -11.994 1.571 -10.282 1.00 0.00 C ATOM 502 OE1 GLU A 33 -12.443 1.149 -11.372 1.00 0.00 O ATOM 503 OE2 GLU A 33 -12.480 1.221 -9.185 1.00 0.00 O ATOM 0 H GLU A 33 -7.170 1.191 -11.048 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.579 3.615 -11.506 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -9.548 1.298 -11.456 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.257 1.234 -9.729 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -10.807 3.092 -9.351 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -11.024 3.308 -11.076 1.00 0.00 H new ATOM 510 N MET A 34 -7.482 3.092 -8.425 1.00 0.00 N ATOM 511 CA MET A 34 -7.210 3.734 -7.130 1.00 0.00 C ATOM 512 C MET A 34 -6.429 5.051 -7.279 1.00 0.00 C ATOM 513 O MET A 34 -6.915 6.119 -6.899 1.00 0.00 O ATOM 514 CB MET A 34 -6.418 2.774 -6.224 1.00 0.00 C ATOM 515 CG MET A 34 -5.992 3.394 -4.895 1.00 0.00 C ATOM 516 SD MET A 34 -5.052 2.258 -3.854 1.00 0.00 S ATOM 517 CE MET A 34 -3.634 1.923 -4.897 1.00 0.00 C ATOM 0 H MET A 34 -7.139 2.134 -8.493 1.00 0.00 H new ATOM 0 HA MET A 34 -8.175 3.969 -6.682 1.00 0.00 H new ATOM 0 HB2 MET A 34 -7.027 1.892 -6.025 1.00 0.00 H new ATOM 0 HB3 MET A 34 -5.530 2.435 -6.758 1.00 0.00 H new ATOM 0 HG2 MET A 34 -5.390 4.281 -5.091 1.00 0.00 H new ATOM 0 HG3 MET A 34 -6.879 3.724 -4.354 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.761 1.732 -4.273 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.836 1.049 -5.516 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.442 2.784 -5.537 1.00 0.00 H new ATOM 527 N ILE A 35 -5.220 4.966 -7.836 1.00 0.00 N ATOM 528 CA ILE A 35 -4.309 6.120 -7.908 1.00 0.00 C ATOM 529 C ILE A 35 -4.971 7.347 -8.561 1.00 0.00 C ATOM 530 O ILE A 35 -4.907 8.456 -8.026 1.00 0.00 O ATOM 531 CB ILE A 35 -3.013 5.761 -8.682 1.00 0.00 C ATOM 532 CG1 ILE A 35 -2.357 4.511 -8.070 1.00 0.00 C ATOM 533 CG2 ILE A 35 -2.032 6.937 -8.673 1.00 0.00 C ATOM 534 CD1 ILE A 35 -1.108 4.055 -8.796 1.00 0.00 C ATOM 0 H ILE A 35 -4.844 4.111 -8.246 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.058 6.377 -6.879 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.279 5.547 -9.717 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.106 4.717 -7.030 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.082 3.697 -8.068 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.131 6.663 -9.221 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.496 7.802 -9.147 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.770 7.184 -7.644 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.705 3.170 -8.305 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.355 3.815 -9.830 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.364 4.852 -8.776 1.00 0.00 H new ATOM 546 N ARG A 36 -5.623 7.142 -9.705 1.00 0.00 N ATOM 547 CA ARG A 36 -6.271 8.246 -10.425 1.00 0.00 C ATOM 548 C ARG A 36 -7.422 8.856 -9.601 1.00 0.00 C ATOM 549 O ARG A 36 -7.599 10.078 -9.574 1.00 0.00 O ATOM 550 CB ARG A 36 -6.794 7.774 -11.793 1.00 0.00 C ATOM 551 CG ARG A 36 -7.975 6.814 -11.708 1.00 0.00 C ATOM 552 CD ARG A 36 -8.469 6.391 -13.084 1.00 0.00 C ATOM 553 NE ARG A 36 -9.694 5.596 -13.003 1.00 0.00 N ATOM 554 CZ ARG A 36 -9.884 4.470 -13.637 1.00 0.00 C ATOM 555 NH1 ARG A 36 -8.950 3.965 -14.380 1.00 0.00 N ATOM 556 NH2 ARG A 36 -11.006 3.842 -13.514 1.00 0.00 N ATOM 0 H ARG A 36 -5.718 6.231 -10.153 1.00 0.00 H new ATOM 0 HA ARG A 36 -5.519 9.019 -10.583 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -7.089 8.645 -12.378 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -5.982 7.287 -12.333 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -7.683 5.930 -11.141 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -8.789 7.289 -11.161 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -8.651 7.277 -13.693 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.693 5.813 -13.586 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.450 5.944 -12.413 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -8.056 4.447 -14.474 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.109 3.085 -14.871 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -11.743 4.225 -12.922 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -11.155 2.963 -14.009 1.00 0.00 H new ATOM 570 N GLN A 37 -8.187 7.999 -8.917 1.00 0.00 N ATOM 571 CA GLN A 37 -9.337 8.439 -8.118 1.00 0.00 C ATOM 572 C GLN A 37 -8.907 9.283 -6.909 1.00 0.00 C ATOM 573 O GLN A 37 -9.508 10.327 -6.626 1.00 0.00 O ATOM 574 CB GLN A 37 -10.166 7.219 -7.685 1.00 0.00 C ATOM 575 CG GLN A 37 -11.065 6.688 -8.800 1.00 0.00 C ATOM 576 CD GLN A 37 -11.639 5.319 -8.504 1.00 0.00 C ATOM 577 OE1 GLN A 37 -11.017 4.509 -7.837 1.00 0.00 O ATOM 578 NE2 GLN A 37 -12.827 5.043 -9.004 1.00 0.00 N ATOM 0 H GLN A 37 -8.030 6.991 -8.901 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.958 9.084 -8.740 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.493 6.426 -7.358 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.781 7.489 -6.827 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -11.883 7.390 -8.963 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.494 6.642 -9.727 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -13.322 5.742 -9.558 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -13.251 4.131 -8.837 1.00 0.00 H new ATOM 587 N LEU A 38 -7.854 8.847 -6.218 1.00 0.00 N ATOM 588 CA LEU A 38 -7.304 9.601 -5.083 1.00 0.00 C ATOM 589 C LEU A 38 -6.966 11.045 -5.489 1.00 0.00 C ATOM 590 O LEU A 38 -7.255 11.998 -4.761 1.00 0.00 O ATOM 591 CB LEU A 38 -6.048 8.906 -4.533 1.00 0.00 C ATOM 592 CG LEU A 38 -6.249 7.460 -4.045 1.00 0.00 C ATOM 593 CD1 LEU A 38 -4.943 6.885 -3.499 1.00 0.00 C ATOM 594 CD2 LEU A 38 -7.355 7.388 -2.994 1.00 0.00 C ATOM 0 H LEU A 38 -7.362 7.977 -6.421 1.00 0.00 H new ATOM 0 HA LEU A 38 -8.065 9.631 -4.303 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.285 8.905 -5.311 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.659 9.499 -3.705 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.555 6.855 -4.899 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.109 5.862 -3.160 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.187 6.889 -4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.599 7.493 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.478 6.356 -2.665 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.087 8.011 -2.141 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.290 7.745 -3.425 1.00 0.00 H new ATOM 606 N GLU A 39 -6.363 11.195 -6.667 1.00 0.00 N ATOM 607 CA GLU A 39 -5.997 12.514 -7.194 1.00 0.00 C ATOM 608 C GLU A 39 -7.229 13.332 -7.622 1.00 0.00 C ATOM 609 O GLU A 39 -7.381 14.497 -7.247 1.00 0.00 O ATOM 610 CB GLU A 39 -5.064 12.362 -8.404 1.00 0.00 C ATOM 611 CG GLU A 39 -3.737 11.676 -8.103 1.00 0.00 C ATOM 612 CD GLU A 39 -2.842 11.599 -9.332 1.00 0.00 C ATOM 613 OE1 GLU A 39 -2.414 12.666 -9.825 1.00 0.00 O ATOM 614 OE2 GLU A 39 -2.561 10.480 -9.815 1.00 0.00 O ATOM 0 H GLU A 39 -6.116 10.417 -7.279 1.00 0.00 H new ATOM 0 HA GLU A 39 -5.493 13.047 -6.388 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -5.583 11.795 -9.177 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.861 13.351 -8.816 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.220 12.219 -7.312 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.926 10.670 -7.729 1.00 0.00 H new ATOM 621 N GLN A 40 -8.111 12.715 -8.406 1.00 0.00 N ATOM 622 CA GLN A 40 -9.190 13.451 -9.083 1.00 0.00 C ATOM 623 C GLN A 40 -10.337 13.854 -8.139 1.00 0.00 C ATOM 624 O GLN A 40 -10.820 14.986 -8.198 1.00 0.00 O ATOM 625 CB GLN A 40 -9.742 12.633 -10.266 1.00 0.00 C ATOM 626 CG GLN A 40 -10.450 11.347 -9.859 1.00 0.00 C ATOM 627 CD GLN A 40 -10.849 10.484 -11.045 1.00 0.00 C ATOM 628 OE1 GLN A 40 -10.099 9.620 -11.486 1.00 0.00 O ATOM 629 NE2 GLN A 40 -12.034 10.707 -11.571 1.00 0.00 N ATOM 0 H GLN A 40 -8.105 11.712 -8.591 1.00 0.00 H new ATOM 0 HA GLN A 40 -8.745 14.376 -9.450 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.437 13.255 -10.830 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -8.920 12.385 -10.937 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -9.797 10.772 -9.203 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -11.341 11.597 -9.283 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -12.636 11.433 -11.182 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -12.351 10.154 -12.367 1.00 0.00 H new ATOM 638 N THR A 41 -10.771 12.950 -7.260 1.00 0.00 N ATOM 639 CA THR A 41 -11.996 13.187 -6.472 1.00 0.00 C ATOM 640 C THR A 41 -11.766 13.141 -4.951 1.00 0.00 C ATOM 641 O THR A 41 -12.722 13.161 -4.177 1.00 0.00 O ATOM 642 CB THR A 41 -13.102 12.165 -6.851 1.00 0.00 C ATOM 643 OG1 THR A 41 -14.336 12.491 -6.192 1.00 0.00 O ATOM 644 CG2 THR A 41 -12.690 10.740 -6.488 1.00 0.00 C ATOM 0 H THR A 41 -10.308 12.061 -7.073 1.00 0.00 H new ATOM 0 HA THR A 41 -12.315 14.199 -6.723 1.00 0.00 H new ATOM 0 HB THR A 41 -13.243 12.220 -7.930 1.00 0.00 H new ATOM 0 HG1 THR A 41 -14.147 12.822 -5.289 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.486 10.049 -6.766 1.00 0.00 H new ATOM 0 HG22 THR A 41 -11.778 10.477 -7.024 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.512 10.675 -5.415 1.00 0.00 H new ATOM 652 N ASN A 42 -10.508 13.099 -4.512 1.00 0.00 N ATOM 653 CA ASN A 42 -10.212 13.032 -3.070 1.00 0.00 C ATOM 654 C ASN A 42 -9.288 14.170 -2.597 1.00 0.00 C ATOM 655 O ASN A 42 -9.761 15.232 -2.187 1.00 0.00 O ATOM 656 CB ASN A 42 -9.607 11.672 -2.711 1.00 0.00 C ATOM 657 CG ASN A 42 -10.545 10.514 -3.003 1.00 0.00 C ATOM 658 OD1 ASN A 42 -10.114 9.443 -3.398 1.00 0.00 O ATOM 659 ND2 ASN A 42 -11.832 10.709 -2.789 1.00 0.00 N ATOM 0 H ASN A 42 -9.687 13.110 -5.117 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.161 13.156 -2.548 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.681 11.533 -3.269 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.346 11.664 -1.653 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -12.497 9.953 -2.954 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -12.162 11.616 -2.459 1.00 0.00 H new ATOM 666 N TYR A 43 -7.972 13.956 -2.663 1.00 0.00 N ATOM 667 CA TYR A 43 -7.003 14.911 -2.094 1.00 0.00 C ATOM 668 C TYR A 43 -5.737 15.039 -2.955 1.00 0.00 C ATOM 669 O TYR A 43 -5.618 14.432 -4.019 1.00 0.00 O ATOM 670 CB TYR A 43 -6.600 14.475 -0.673 1.00 0.00 C ATOM 671 CG TYR A 43 -7.698 14.613 0.367 1.00 0.00 C ATOM 672 CD1 TYR A 43 -8.010 15.855 0.908 1.00 0.00 C ATOM 673 CD2 TYR A 43 -8.411 13.506 0.816 1.00 0.00 C ATOM 674 CE1 TYR A 43 -8.999 15.990 1.861 1.00 0.00 C ATOM 675 CE2 TYR A 43 -9.402 13.634 1.772 1.00 0.00 C ATOM 676 CZ TYR A 43 -9.692 14.878 2.291 1.00 0.00 C ATOM 677 OH TYR A 43 -10.675 15.013 3.249 1.00 0.00 O ATOM 0 H TYR A 43 -7.549 13.137 -3.101 1.00 0.00 H new ATOM 0 HA TYR A 43 -7.495 15.883 -2.067 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -6.277 13.435 -0.705 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -5.741 15.066 -0.356 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -7.469 16.729 0.577 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -8.187 12.530 0.411 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -9.229 16.963 2.269 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -9.946 12.764 2.110 1.00 0.00 H new ATOM 0 HH TYR A 43 -11.068 14.136 3.441 1.00 0.00 H new ATOM 687 N ARG A 44 -4.795 15.854 -2.482 1.00 0.00 N ATOM 688 CA ARG A 44 -3.476 15.976 -3.112 1.00 0.00 C ATOM 689 C ARG A 44 -2.469 15.036 -2.431 1.00 0.00 C ATOM 690 O ARG A 44 -2.087 15.246 -1.276 1.00 0.00 O ATOM 691 CB ARG A 44 -2.983 17.430 -3.040 1.00 0.00 C ATOM 692 CG ARG A 44 -3.877 18.412 -3.793 1.00 0.00 C ATOM 693 CD ARG A 44 -3.347 19.842 -3.731 1.00 0.00 C ATOM 694 NE ARG A 44 -4.174 20.757 -4.519 1.00 0.00 N ATOM 695 CZ ARG A 44 -3.805 21.955 -4.888 1.00 0.00 C ATOM 696 NH1 ARG A 44 -2.664 22.443 -4.516 1.00 0.00 N ATOM 697 NH2 ARG A 44 -4.595 22.676 -5.613 1.00 0.00 N ATOM 0 H ARG A 44 -4.920 16.444 -1.659 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.564 15.690 -4.160 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.922 17.734 -1.995 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -1.973 17.484 -3.447 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.957 18.101 -4.835 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.882 18.381 -3.373 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.320 20.176 -2.694 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -2.322 19.867 -4.101 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.101 20.438 -4.799 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -2.041 21.890 -3.927 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.389 23.380 -4.812 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.504 22.310 -5.896 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.310 23.612 -5.903 1.00 0.00 H new ATOM 711 N LEU A 45 -2.060 13.990 -3.143 1.00 0.00 N ATOM 712 CA LEU A 45 -1.139 12.984 -2.600 1.00 0.00 C ATOM 713 C LEU A 45 -0.022 12.656 -3.598 1.00 0.00 C ATOM 714 O LEU A 45 -0.289 12.294 -4.745 1.00 0.00 O ATOM 715 CB LEU A 45 -1.906 11.698 -2.253 1.00 0.00 C ATOM 716 CG LEU A 45 -2.997 11.840 -1.179 1.00 0.00 C ATOM 717 CD1 LEU A 45 -3.777 10.538 -1.037 1.00 0.00 C ATOM 718 CD2 LEU A 45 -2.390 12.254 0.160 1.00 0.00 C ATOM 0 H LEU A 45 -2.352 13.812 -4.104 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.688 13.398 -1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.367 11.315 -3.164 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.189 10.948 -1.919 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.687 12.623 -1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -4.545 10.656 -0.273 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -4.247 10.290 -1.989 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -3.097 9.736 -0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.181 12.348 0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.675 11.498 0.484 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.881 13.211 0.048 1.00 0.00 H new ATOM 730 N LYS A 46 1.227 12.787 -3.162 1.00 0.00 N ATOM 731 CA LYS A 46 2.371 12.405 -3.992 1.00 0.00 C ATOM 732 C LYS A 46 2.899 11.034 -3.551 1.00 0.00 C ATOM 733 O LYS A 46 3.501 10.901 -2.485 1.00 0.00 O ATOM 734 CB LYS A 46 3.484 13.461 -3.910 1.00 0.00 C ATOM 735 CG LYS A 46 4.588 13.254 -4.942 1.00 0.00 C ATOM 736 CD LYS A 46 5.669 14.328 -4.853 1.00 0.00 C ATOM 737 CE LYS A 46 6.697 14.175 -5.969 1.00 0.00 C ATOM 738 NZ LYS A 46 7.788 15.178 -5.871 1.00 0.00 N ATOM 0 H LYS A 46 1.475 13.153 -2.243 1.00 0.00 H new ATOM 0 HA LYS A 46 2.043 12.343 -5.030 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.048 14.450 -4.048 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.921 13.442 -2.912 1.00 0.00 H new ATOM 0 HG2 LYS A 46 5.040 12.273 -4.796 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.154 13.260 -5.942 1.00 0.00 H new ATOM 0 HD2 LYS A 46 5.210 15.315 -4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 46 6.168 14.266 -3.886 1.00 0.00 H new ATOM 0 HE2 LYS A 46 7.124 13.173 -5.932 1.00 0.00 H new ATOM 0 HE3 LYS A 46 6.200 14.275 -6.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 8.462 15.035 -6.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 7.386 16.135 -5.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.281 15.067 -4.962 1.00 0.00 H new ATOM 752 N LEU A 47 2.652 10.015 -4.366 1.00 0.00 N ATOM 753 CA LEU A 47 2.984 8.633 -3.998 1.00 0.00 C ATOM 754 C LEU A 47 4.110 8.063 -4.880 1.00 0.00 C ATOM 755 O LEU A 47 4.612 8.734 -5.783 1.00 0.00 O ATOM 756 CB LEU A 47 1.729 7.752 -4.116 1.00 0.00 C ATOM 757 CG LEU A 47 0.483 8.269 -3.372 1.00 0.00 C ATOM 758 CD1 LEU A 47 -0.702 7.328 -3.583 1.00 0.00 C ATOM 759 CD2 LEU A 47 0.771 8.451 -1.882 1.00 0.00 C ATOM 0 H LEU A 47 2.224 10.114 -5.286 1.00 0.00 H new ATOM 0 HA LEU A 47 3.340 8.635 -2.968 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.481 7.643 -5.172 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.968 6.757 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 47 0.224 9.243 -3.786 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.571 7.712 -3.049 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.930 7.262 -4.647 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -0.452 6.337 -3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.125 8.817 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.065 7.495 -1.449 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.579 9.171 -1.753 1.00 0.00 H new ATOM 771 N CYS A 48 4.501 6.817 -4.615 1.00 0.00 N ATOM 772 CA CYS A 48 5.518 6.132 -5.428 1.00 0.00 C ATOM 773 C CYS A 48 5.129 4.677 -5.711 1.00 0.00 C ATOM 774 O CYS A 48 4.337 4.084 -4.982 1.00 0.00 O ATOM 775 CB CYS A 48 6.885 6.159 -4.740 1.00 0.00 C ATOM 776 SG CYS A 48 7.531 7.811 -4.408 1.00 0.00 S ATOM 0 H CYS A 48 4.132 6.258 -3.846 1.00 0.00 H new ATOM 0 HA CYS A 48 5.578 6.671 -6.373 1.00 0.00 H new ATOM 0 HB2 CYS A 48 6.813 5.616 -3.798 1.00 0.00 H new ATOM 0 HB3 CYS A 48 7.601 5.623 -5.363 1.00 0.00 H new ATOM 0 HG CYS A 48 7.510 8.036 -3.128 1.00 0.00 H new ATOM 782 N VAL A 49 5.699 4.109 -6.771 1.00 0.00 N ATOM 783 CA VAL A 49 5.458 2.706 -7.143 1.00 0.00 C ATOM 784 C VAL A 49 6.744 2.038 -7.658 1.00 0.00 C ATOM 785 O VAL A 49 7.817 2.647 -7.662 1.00 0.00 O ATOM 786 CB VAL A 49 4.357 2.573 -8.228 1.00 0.00 C ATOM 787 CG1 VAL A 49 2.994 3.018 -7.696 1.00 0.00 C ATOM 788 CG2 VAL A 49 4.743 3.362 -9.474 1.00 0.00 C ATOM 0 H VAL A 49 6.338 4.600 -7.397 1.00 0.00 H new ATOM 0 HA VAL A 49 5.121 2.203 -6.237 1.00 0.00 H new ATOM 0 HB VAL A 49 4.273 1.520 -8.499 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.245 2.912 -8.481 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.716 2.398 -6.843 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.048 4.061 -7.384 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.961 3.259 -10.226 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.862 4.414 -9.216 1.00 0.00 H new ATOM 0 HG23 VAL A 49 5.682 2.977 -9.872 1.00 0.00 H new ATOM 798 N SER A 50 6.631 0.785 -8.089 1.00 0.00 N ATOM 799 CA SER A 50 7.785 0.029 -8.596 1.00 0.00 C ATOM 800 C SER A 50 8.172 0.438 -10.028 1.00 0.00 C ATOM 801 O SER A 50 9.290 0.893 -10.271 1.00 0.00 O ATOM 802 CB SER A 50 7.494 -1.480 -8.544 1.00 0.00 C ATOM 803 OG SER A 50 7.276 -1.911 -7.207 1.00 0.00 O ATOM 0 H SER A 50 5.753 0.266 -8.100 1.00 0.00 H new ATOM 0 HA SER A 50 8.631 0.264 -7.950 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.617 -1.706 -9.150 1.00 0.00 H new ATOM 0 HB3 SER A 50 8.330 -2.030 -8.976 1.00 0.00 H new ATOM 0 HG SER A 50 7.091 -2.873 -7.200 1.00 0.00 H new ATOM 809 N ASP A 51 7.251 0.267 -10.975 1.00 0.00 N ATOM 810 CA ASP A 51 7.539 0.533 -12.394 1.00 0.00 C ATOM 811 C ASP A 51 7.012 1.904 -12.868 1.00 0.00 C ATOM 812 O ASP A 51 7.725 2.646 -13.545 1.00 0.00 O ATOM 813 CB ASP A 51 6.934 -0.581 -13.253 1.00 0.00 C ATOM 814 CG ASP A 51 5.433 -0.682 -13.068 1.00 0.00 C ATOM 815 OD1 ASP A 51 4.998 -1.194 -12.013 1.00 0.00 O ATOM 816 OD2 ASP A 51 4.689 -0.218 -13.954 1.00 0.00 O ATOM 0 H ASP A 51 6.300 -0.053 -10.792 1.00 0.00 H new ATOM 0 HA ASP A 51 8.623 0.556 -12.505 1.00 0.00 H new ATOM 0 HB2 ASP A 51 7.159 -0.393 -14.303 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.397 -1.533 -12.993 1.00 0.00 H new ATOM 821 N ARG A 52 5.749 2.211 -12.535 1.00 0.00 N ATOM 822 CA ARG A 52 5.076 3.452 -12.977 1.00 0.00 C ATOM 823 C ARG A 52 4.781 3.434 -14.491 1.00 0.00 C ATOM 824 O ARG A 52 4.142 4.343 -15.024 1.00 0.00 O ATOM 825 CB ARG A 52 5.915 4.697 -12.625 1.00 0.00 C ATOM 826 CG ARG A 52 5.191 6.026 -12.846 1.00 0.00 C ATOM 827 CD ARG A 52 6.156 7.205 -12.840 1.00 0.00 C ATOM 828 NE ARG A 52 7.099 7.139 -13.955 1.00 0.00 N ATOM 829 CZ ARG A 52 8.194 7.839 -14.039 1.00 0.00 C ATOM 830 NH1 ARG A 52 8.512 8.691 -13.116 1.00 0.00 N ATOM 831 NH2 ARG A 52 8.962 7.700 -15.066 1.00 0.00 N ATOM 0 H ARG A 52 5.163 1.611 -11.954 1.00 0.00 H new ATOM 0 HA ARG A 52 4.127 3.503 -12.443 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.220 4.632 -11.581 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.826 4.689 -13.224 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.660 5.996 -13.797 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.442 6.166 -12.067 1.00 0.00 H new ATOM 0 HD2 ARG A 52 5.593 8.136 -12.895 1.00 0.00 H new ATOM 0 HD3 ARG A 52 6.706 7.220 -11.899 1.00 0.00 H new ATOM 0 HE ARG A 52 6.884 6.500 -14.721 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.901 8.821 -12.309 1.00 0.00 H new ATOM 0 HH12 ARG A 52 9.373 9.232 -13.196 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.710 7.045 -15.806 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.821 8.245 -15.138 1.00 0.00 H new ATOM 845 N ASP A 53 5.229 2.388 -15.178 1.00 0.00 N ATOM 846 CA ASP A 53 5.090 2.300 -16.629 1.00 0.00 C ATOM 847 C ASP A 53 3.654 1.927 -17.021 1.00 0.00 C ATOM 848 O ASP A 53 3.059 2.545 -17.904 1.00 0.00 O ATOM 849 CB ASP A 53 6.084 1.278 -17.187 1.00 0.00 C ATOM 850 CG ASP A 53 6.123 1.282 -18.703 1.00 0.00 C ATOM 851 OD1 ASP A 53 6.872 2.101 -19.280 1.00 0.00 O ATOM 852 OD2 ASP A 53 5.407 0.476 -19.326 1.00 0.00 O ATOM 0 H ASP A 53 5.693 1.586 -14.752 1.00 0.00 H new ATOM 0 HA ASP A 53 5.310 3.277 -17.059 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.080 1.494 -16.800 1.00 0.00 H new ATOM 0 HB3 ASP A 53 5.814 0.282 -16.835 1.00 0.00 H new ATOM 857 N VAL A 54 3.098 0.928 -16.343 1.00 0.00 N ATOM 858 CA VAL A 54 1.718 0.496 -16.595 1.00 0.00 C ATOM 859 C VAL A 54 0.701 1.532 -16.080 1.00 0.00 C ATOM 860 O VAL A 54 -0.491 1.462 -16.387 1.00 0.00 O ATOM 861 CB VAL A 54 1.428 -0.874 -15.932 1.00 0.00 C ATOM 862 CG1 VAL A 54 2.397 -1.939 -16.445 1.00 0.00 C ATOM 863 CG2 VAL A 54 1.496 -0.765 -14.410 1.00 0.00 C ATOM 0 H VAL A 54 3.577 0.399 -15.614 1.00 0.00 H new ATOM 0 HA VAL A 54 1.611 0.400 -17.675 1.00 0.00 H new ATOM 0 HB VAL A 54 0.417 -1.176 -16.204 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.176 -2.893 -15.967 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.288 -2.041 -17.525 1.00 0.00 H new ATOM 0 HG13 VAL A 54 3.420 -1.644 -16.210 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.289 -1.739 -13.966 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.491 -0.435 -14.113 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.756 -0.044 -14.063 1.00 0.00 H new ATOM 873 N LEU A 55 1.189 2.491 -15.296 1.00 0.00 N ATOM 874 CA LEU A 55 0.345 3.532 -14.697 1.00 0.00 C ATOM 875 C LEU A 55 0.418 4.844 -15.505 1.00 0.00 C ATOM 876 O LEU A 55 1.425 5.550 -15.462 1.00 0.00 O ATOM 877 CB LEU A 55 0.799 3.768 -13.252 1.00 0.00 C ATOM 878 CG LEU A 55 0.673 2.544 -12.330 1.00 0.00 C ATOM 879 CD1 LEU A 55 1.411 2.773 -11.016 1.00 0.00 C ATOM 880 CD2 LEU A 55 -0.794 2.222 -12.069 1.00 0.00 C ATOM 0 H LEU A 55 2.177 2.572 -15.056 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.693 3.198 -14.709 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.839 4.093 -13.261 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.213 4.585 -12.831 1.00 0.00 H new ATOM 0 HG LEU A 55 1.132 1.692 -12.832 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.306 1.893 -10.382 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.467 2.951 -11.218 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.988 3.639 -10.507 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.865 1.353 -11.415 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.275 3.076 -11.592 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -1.293 2.006 -13.014 1.00 0.00 H new ATOM 892 N PRO A 56 -0.649 5.185 -16.256 1.00 0.00 N ATOM 893 CA PRO A 56 -0.661 6.364 -17.136 1.00 0.00 C ATOM 894 C PRO A 56 -1.078 7.671 -16.428 1.00 0.00 C ATOM 895 O PRO A 56 -2.137 7.744 -15.799 1.00 0.00 O ATOM 896 CB PRO A 56 -1.695 5.961 -18.190 1.00 0.00 C ATOM 897 CG PRO A 56 -2.685 5.122 -17.445 1.00 0.00 C ATOM 898 CD PRO A 56 -1.927 4.444 -16.322 1.00 0.00 C ATOM 0 HA PRO A 56 0.331 6.595 -17.525 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.171 6.836 -18.634 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -1.234 5.402 -19.004 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -3.493 5.737 -17.050 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.140 4.384 -18.105 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.472 4.503 -15.380 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -1.765 3.387 -16.531 1.00 0.00 H new ATOM 906 N GLY A 57 -0.232 8.700 -16.540 1.00 0.00 N ATOM 907 CA GLY A 57 -0.551 10.024 -15.995 1.00 0.00 C ATOM 908 C GLY A 57 -0.741 10.050 -14.478 1.00 0.00 C ATOM 909 O GLY A 57 -1.363 10.968 -13.938 1.00 0.00 O ATOM 0 H GLY A 57 0.676 8.642 -17.001 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.248 10.716 -16.261 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.461 10.390 -16.470 1.00 0.00 H new ATOM 913 N THR A 58 -0.192 9.056 -13.788 1.00 0.00 N ATOM 914 CA THR A 58 -0.358 8.930 -12.333 1.00 0.00 C ATOM 915 C THR A 58 0.700 9.732 -11.560 1.00 0.00 C ATOM 916 O THR A 58 1.852 9.828 -11.985 1.00 0.00 O ATOM 917 CB THR A 58 -0.283 7.451 -11.897 1.00 0.00 C ATOM 918 OG1 THR A 58 0.963 6.872 -12.321 1.00 0.00 O ATOM 919 CG2 THR A 58 -1.446 6.648 -12.477 1.00 0.00 C ATOM 0 H THR A 58 0.375 8.320 -14.209 1.00 0.00 H new ATOM 0 HA THR A 58 -1.342 9.335 -12.097 1.00 0.00 H new ATOM 0 HB THR A 58 -0.347 7.417 -10.809 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.905 6.628 -13.268 1.00 0.00 H new ATOM 0 HG21 THR A 58 -1.368 5.610 -12.154 1.00 0.00 H new ATOM 0 HG22 THR A 58 -2.389 7.068 -12.126 1.00 0.00 H new ATOM 0 HG23 THR A 58 -1.412 6.693 -13.566 1.00 0.00 H new ATOM 927 N CYS A 59 0.303 10.289 -10.412 1.00 0.00 N ATOM 928 CA CYS A 59 1.204 11.111 -9.575 1.00 0.00 C ATOM 929 C CYS A 59 2.346 10.300 -8.948 1.00 0.00 C ATOM 930 O CYS A 59 3.273 10.869 -8.373 1.00 0.00 O ATOM 931 CB CYS A 59 0.417 11.796 -8.453 1.00 0.00 C ATOM 932 SG CYS A 59 1.432 12.788 -7.331 1.00 0.00 S ATOM 0 H CYS A 59 -0.639 10.189 -10.034 1.00 0.00 H new ATOM 0 HA CYS A 59 1.644 11.851 -10.243 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -0.344 12.437 -8.898 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -0.106 11.034 -7.874 1.00 0.00 H new ATOM 0 HG CYS A 59 2.665 12.380 -7.386 1.00 0.00 H new ATOM 938 N VAL A 60 2.273 8.978 -9.046 1.00 0.00 N ATOM 939 CA VAL A 60 3.297 8.106 -8.462 1.00 0.00 C ATOM 940 C VAL A 60 4.632 8.190 -9.222 1.00 0.00 C ATOM 941 O VAL A 60 4.661 8.409 -10.434 1.00 0.00 O ATOM 942 CB VAL A 60 2.827 6.635 -8.427 1.00 0.00 C ATOM 943 CG1 VAL A 60 1.583 6.483 -7.554 1.00 0.00 C ATOM 944 CG2 VAL A 60 2.568 6.122 -9.839 1.00 0.00 C ATOM 0 H VAL A 60 1.519 8.483 -9.522 1.00 0.00 H new ATOM 0 HA VAL A 60 3.455 8.461 -7.444 1.00 0.00 H new ATOM 0 HB VAL A 60 3.621 6.032 -7.986 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.270 5.439 -7.545 1.00 0.00 H new ATOM 0 HG12 VAL A 60 1.811 6.803 -6.537 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.779 7.099 -7.956 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.238 5.084 -9.794 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.795 6.729 -10.310 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.486 6.186 -10.423 1.00 0.00 H new ATOM 954 N TRP A 61 5.736 8.035 -8.496 1.00 0.00 N ATOM 955 CA TRP A 61 7.073 8.009 -9.103 1.00 0.00 C ATOM 956 C TRP A 61 7.828 6.719 -8.752 1.00 0.00 C ATOM 957 O TRP A 61 7.547 6.072 -7.746 1.00 0.00 O ATOM 958 CB TRP A 61 7.879 9.239 -8.661 1.00 0.00 C ATOM 959 CG TRP A 61 7.270 10.532 -9.123 1.00 0.00 C ATOM 960 CD1 TRP A 61 6.232 11.201 -8.543 1.00 0.00 C ATOM 961 CD2 TRP A 61 7.653 11.301 -10.270 1.00 0.00 C ATOM 962 NE1 TRP A 61 5.945 12.338 -9.258 1.00 0.00 N ATOM 963 CE2 TRP A 61 6.805 12.423 -10.320 1.00 0.00 C ATOM 964 CE3 TRP A 61 8.633 11.152 -11.255 1.00 0.00 C ATOM 965 CZ2 TRP A 61 6.906 13.387 -11.320 1.00 0.00 C ATOM 966 CZ3 TRP A 61 8.732 12.109 -12.247 1.00 0.00 C ATOM 967 CH2 TRP A 61 7.874 13.215 -12.272 1.00 0.00 C ATOM 0 H TRP A 61 5.735 7.925 -7.482 1.00 0.00 H new ATOM 0 HA TRP A 61 6.949 8.034 -10.186 1.00 0.00 H new ATOM 0 HB2 TRP A 61 7.954 9.246 -7.574 1.00 0.00 H new ATOM 0 HB3 TRP A 61 8.894 9.161 -9.050 1.00 0.00 H new ATOM 0 HD1 TRP A 61 5.712 10.883 -7.652 1.00 0.00 H new ATOM 0 HE1 TRP A 61 5.211 13.010 -9.034 1.00 0.00 H new ATOM 0 HE3 TRP A 61 9.301 10.304 -11.241 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 6.244 14.240 -11.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 9.483 12.002 -13.015 1.00 0.00 H new ATOM 0 HH2 TRP A 61 7.978 13.948 -13.059 1.00 0.00 H new ATOM 978 N SER A 62 8.779 6.339 -9.599 1.00 0.00 N ATOM 979 CA SER A 62 9.577 5.127 -9.374 1.00 0.00 C ATOM 980 C SER A 62 10.871 5.458 -8.622 1.00 0.00 C ATOM 981 O SER A 62 11.885 5.799 -9.233 1.00 0.00 O ATOM 982 CB SER A 62 9.913 4.445 -10.708 1.00 0.00 C ATOM 983 OG SER A 62 8.737 4.164 -11.449 1.00 0.00 O ATOM 0 H SER A 62 9.020 6.849 -10.449 1.00 0.00 H new ATOM 0 HA SER A 62 8.983 4.444 -8.766 1.00 0.00 H new ATOM 0 HB2 SER A 62 10.570 5.088 -11.293 1.00 0.00 H new ATOM 0 HB3 SER A 62 10.458 3.520 -10.520 1.00 0.00 H new ATOM 0 HG SER A 62 8.951 3.547 -12.180 1.00 0.00 H new ATOM 989 N ILE A 63 10.819 5.394 -7.295 1.00 0.00 N ATOM 990 CA ILE A 63 11.996 5.669 -6.463 1.00 0.00 C ATOM 991 C ILE A 63 12.770 4.382 -6.136 1.00 0.00 C ATOM 992 O ILE A 63 12.229 3.276 -6.215 1.00 0.00 O ATOM 993 CB ILE A 63 11.611 6.380 -5.139 1.00 0.00 C ATOM 994 CG1 ILE A 63 10.617 5.526 -4.334 1.00 0.00 C ATOM 995 CG2 ILE A 63 11.029 7.767 -5.427 1.00 0.00 C ATOM 996 CD1 ILE A 63 10.342 6.057 -2.943 1.00 0.00 C ATOM 0 H ILE A 63 9.978 5.155 -6.769 1.00 0.00 H new ATOM 0 HA ILE A 63 12.635 6.331 -7.047 1.00 0.00 H new ATOM 0 HB ILE A 63 12.512 6.505 -4.539 1.00 0.00 H new ATOM 0 HG12 ILE A 63 9.677 5.466 -4.882 1.00 0.00 H new ATOM 0 HG13 ILE A 63 11.005 4.511 -4.255 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.764 8.253 -4.488 1.00 0.00 H new ATOM 0 HG22 ILE A 63 11.770 8.371 -5.951 1.00 0.00 H new ATOM 0 HG23 ILE A 63 10.138 7.666 -6.047 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.632 5.402 -2.437 1.00 0.00 H new ATOM 0 HD12 ILE A 63 11.272 6.091 -2.376 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.923 7.061 -3.013 1.00 0.00 H new ATOM 1008 N ALA A 64 14.036 4.540 -5.759 1.00 0.00 N ATOM 1009 CA ALA A 64 14.909 3.401 -5.451 1.00 0.00 C ATOM 1010 C ALA A 64 14.429 2.618 -4.215 1.00 0.00 C ATOM 1011 O ALA A 64 13.988 3.206 -3.227 1.00 0.00 O ATOM 1012 CB ALA A 64 16.337 3.888 -5.242 1.00 0.00 C ATOM 0 H ALA A 64 14.486 5.450 -5.658 1.00 0.00 H new ATOM 0 HA ALA A 64 14.873 2.718 -6.300 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.981 3.039 -5.014 1.00 0.00 H new ATOM 0 HB2 ALA A 64 16.691 4.378 -6.149 1.00 0.00 H new ATOM 0 HB3 ALA A 64 16.362 4.596 -4.414 1.00 0.00 H new ATOM 1018 N SER A 65 14.541 1.289 -4.275 1.00 0.00 N ATOM 1019 CA SER A 65 14.128 0.408 -3.165 1.00 0.00 C ATOM 1020 C SER A 65 14.857 0.752 -1.854 1.00 0.00 C ATOM 1021 O SER A 65 14.319 0.571 -0.760 1.00 0.00 O ATOM 1022 CB SER A 65 14.393 -1.058 -3.531 1.00 0.00 C ATOM 1023 OG SER A 65 13.926 -1.946 -2.527 1.00 0.00 O ATOM 0 H SER A 65 14.916 0.791 -5.083 1.00 0.00 H new ATOM 0 HA SER A 65 13.061 0.564 -3.005 1.00 0.00 H new ATOM 0 HB2 SER A 65 13.904 -1.290 -4.477 1.00 0.00 H new ATOM 0 HB3 SER A 65 15.462 -1.208 -3.679 1.00 0.00 H new ATOM 0 HG SER A 65 12.946 -1.941 -2.516 1.00 0.00 H new ATOM 1029 N GLU A 66 16.084 1.250 -1.969 1.00 0.00 N ATOM 1030 CA GLU A 66 16.882 1.651 -0.801 1.00 0.00 C ATOM 1031 C GLU A 66 16.520 3.064 -0.305 1.00 0.00 C ATOM 1032 O GLU A 66 17.018 3.517 0.726 1.00 0.00 O ATOM 1033 CB GLU A 66 18.371 1.597 -1.158 1.00 0.00 C ATOM 1034 CG GLU A 66 18.752 2.530 -2.304 1.00 0.00 C ATOM 1035 CD GLU A 66 20.191 2.352 -2.752 1.00 0.00 C ATOM 1036 OE1 GLU A 66 21.080 3.021 -2.193 1.00 0.00 O ATOM 1037 OE2 GLU A 66 20.438 1.538 -3.663 1.00 0.00 O ATOM 0 H GLU A 66 16.555 1.389 -2.863 1.00 0.00 H new ATOM 0 HA GLU A 66 16.660 0.954 0.007 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.958 1.856 -0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.636 0.575 -1.428 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.088 2.350 -3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 66 18.598 3.563 -1.992 1.00 0.00 H new ATOM 1044 N LEU A 67 15.656 3.756 -1.047 1.00 0.00 N ATOM 1045 CA LEU A 67 15.269 5.137 -0.717 1.00 0.00 C ATOM 1046 C LEU A 67 13.760 5.262 -0.438 1.00 0.00 C ATOM 1047 O LEU A 67 13.221 6.373 -0.396 1.00 0.00 O ATOM 1048 CB LEU A 67 15.666 6.077 -1.868 1.00 0.00 C ATOM 1049 CG LEU A 67 17.174 6.146 -2.174 1.00 0.00 C ATOM 1050 CD1 LEU A 67 17.442 7.053 -3.372 1.00 0.00 C ATOM 1051 CD2 LEU A 67 17.954 6.624 -0.951 1.00 0.00 C ATOM 0 H LEU A 67 15.207 3.386 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 67 15.797 5.420 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 67 15.143 5.760 -2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 67 15.314 7.081 -1.632 1.00 0.00 H new ATOM 0 HG LEU A 67 17.515 5.141 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 67 18.513 7.087 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 67 16.923 6.662 -4.247 1.00 0.00 H new ATOM 0 HD13 LEU A 67 17.081 8.058 -3.155 1.00 0.00 H new ATOM 0 HD21 LEU A 67 19.017 6.665 -1.190 1.00 0.00 H new ATOM 0 HD22 LEU A 67 17.608 7.617 -0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 67 17.795 5.932 -0.124 1.00 0.00 H new ATOM 1063 N ILE A 68 13.088 4.130 -0.224 1.00 0.00 N ATOM 1064 CA ILE A 68 11.639 4.122 0.024 1.00 0.00 C ATOM 1065 C ILE A 68 11.280 4.898 1.300 1.00 0.00 C ATOM 1066 O ILE A 68 10.448 5.802 1.272 1.00 0.00 O ATOM 1067 CB ILE A 68 11.085 2.678 0.147 1.00 0.00 C ATOM 1068 CG1 ILE A 68 11.455 1.846 -1.092 1.00 0.00 C ATOM 1069 CG2 ILE A 68 9.567 2.694 0.348 1.00 0.00 C ATOM 1070 CD1 ILE A 68 10.921 2.406 -2.397 1.00 0.00 C ATOM 0 H ILE A 68 13.520 3.206 -0.217 1.00 0.00 H new ATOM 0 HA ILE A 68 11.181 4.610 -0.836 1.00 0.00 H new ATOM 0 HB ILE A 68 11.541 2.214 1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 68 12.541 1.774 -1.157 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.076 0.832 -0.962 1.00 0.00 H new ATOM 0 HG21 ILE A 68 9.200 1.671 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.326 3.241 1.259 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.092 3.181 -0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 68 11.226 1.761 -3.221 1.00 0.00 H new ATOM 0 HD12 ILE A 68 9.833 2.452 -2.355 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.320 3.408 -2.553 1.00 0.00 H new ATOM 1082 N GLU A 69 11.927 4.544 2.409 1.00 0.00 N ATOM 1083 CA GLU A 69 11.657 5.173 3.708 1.00 0.00 C ATOM 1084 C GLU A 69 12.036 6.664 3.692 1.00 0.00 C ATOM 1085 O GLU A 69 11.387 7.489 4.338 1.00 0.00 O ATOM 1086 CB GLU A 69 12.425 4.412 4.813 1.00 0.00 C ATOM 1087 CG GLU A 69 12.009 4.747 6.252 1.00 0.00 C ATOM 1088 CD GLU A 69 12.846 5.844 6.898 1.00 0.00 C ATOM 1089 OE1 GLU A 69 13.980 5.553 7.335 1.00 0.00 O ATOM 1090 OE2 GLU A 69 12.373 6.995 6.993 1.00 0.00 O ATOM 0 H GLU A 69 12.646 3.821 2.437 1.00 0.00 H new ATOM 0 HA GLU A 69 10.588 5.117 3.916 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.292 3.342 4.654 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.489 4.621 4.702 1.00 0.00 H new ATOM 0 HG2 GLU A 69 10.963 5.053 6.255 1.00 0.00 H new ATOM 0 HG3 GLU A 69 12.080 3.845 6.859 1.00 0.00 H new ATOM 1097 N LYS A 70 13.083 7.005 2.937 1.00 0.00 N ATOM 1098 CA LYS A 70 13.547 8.397 2.836 1.00 0.00 C ATOM 1099 C LYS A 70 12.525 9.291 2.113 1.00 0.00 C ATOM 1100 O LYS A 70 12.207 10.386 2.577 1.00 0.00 O ATOM 1101 CB LYS A 70 14.892 8.470 2.095 1.00 0.00 C ATOM 1102 CG LYS A 70 16.021 7.626 2.696 1.00 0.00 C ATOM 1103 CD LYS A 70 16.356 8.010 4.146 1.00 0.00 C ATOM 1104 CE LYS A 70 15.492 7.263 5.160 1.00 0.00 C ATOM 1105 NZ LYS A 70 15.783 7.660 6.562 1.00 0.00 N ATOM 0 H LYS A 70 13.627 6.340 2.387 1.00 0.00 H new ATOM 0 HA LYS A 70 13.668 8.764 3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 70 14.736 8.156 1.063 1.00 0.00 H new ATOM 0 HB3 LYS A 70 15.215 9.511 2.066 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.738 6.574 2.661 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.915 7.736 2.082 1.00 0.00 H new ATOM 0 HD2 LYS A 70 17.407 7.798 4.342 1.00 0.00 H new ATOM 0 HD3 LYS A 70 16.218 9.083 4.276 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.440 7.451 4.944 1.00 0.00 H new ATOM 0 HE3 LYS A 70 15.653 6.191 5.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 15.258 7.043 7.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 16.803 7.568 6.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.492 8.647 6.711 1.00 0.00 H new ATOM 1119 N ARG A 71 12.029 8.818 0.971 1.00 0.00 N ATOM 1120 CA ARG A 71 11.097 9.597 0.142 1.00 0.00 C ATOM 1121 C ARG A 71 9.640 9.464 0.629 1.00 0.00 C ATOM 1122 O ARG A 71 8.934 10.464 0.789 1.00 0.00 O ATOM 1123 CB ARG A 71 11.207 9.159 -1.333 1.00 0.00 C ATOM 1124 CG ARG A 71 12.392 9.761 -2.095 1.00 0.00 C ATOM 1125 CD ARG A 71 13.745 9.393 -1.486 1.00 0.00 C ATOM 1126 NE ARG A 71 14.861 9.929 -2.271 1.00 0.00 N ATOM 1127 CZ ARG A 71 16.081 10.069 -1.826 1.00 0.00 C ATOM 1128 NH1 ARG A 71 16.389 9.713 -0.623 1.00 0.00 N ATOM 1129 NH2 ARG A 71 16.992 10.572 -2.594 1.00 0.00 N ATOM 0 H ARG A 71 12.255 7.898 0.594 1.00 0.00 H new ATOM 0 HA ARG A 71 11.377 10.647 0.231 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.284 8.072 -1.370 1.00 0.00 H new ATOM 0 HB3 ARG A 71 10.286 9.431 -1.848 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.361 9.421 -3.130 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.291 10.846 -2.113 1.00 0.00 H new ATOM 0 HD2 ARG A 71 13.801 9.776 -0.467 1.00 0.00 H new ATOM 0 HD3 ARG A 71 13.832 8.308 -1.424 1.00 0.00 H new ATOM 0 HE ARG A 71 14.671 10.213 -3.232 1.00 0.00 H new ATOM 0 HH11 ARG A 71 15.676 9.318 -0.010 1.00 0.00 H new ATOM 0 HH12 ARG A 71 17.345 9.827 -0.286 1.00 0.00 H new ATOM 0 HH21 ARG A 71 16.757 10.858 -3.544 1.00 0.00 H new ATOM 0 HH22 ARG A 71 17.946 10.683 -2.249 1.00 0.00 H new ATOM 1143 N CYS A 72 9.197 8.229 0.855 1.00 0.00 N ATOM 1144 CA CYS A 72 7.815 7.952 1.274 1.00 0.00 C ATOM 1145 C CYS A 72 7.743 7.593 2.765 1.00 0.00 C ATOM 1146 O CYS A 72 8.387 6.646 3.217 1.00 0.00 O ATOM 1147 CB CYS A 72 7.226 6.802 0.444 1.00 0.00 C ATOM 1148 SG CYS A 72 7.162 7.125 -1.335 1.00 0.00 S ATOM 0 H CYS A 72 9.776 7.395 0.755 1.00 0.00 H new ATOM 0 HA CYS A 72 7.233 8.859 1.108 1.00 0.00 H new ATOM 0 HB2 CYS A 72 7.819 5.904 0.617 1.00 0.00 H new ATOM 0 HB3 CYS A 72 6.217 6.592 0.800 1.00 0.00 H new ATOM 0 HG CYS A 72 5.932 7.043 -1.747 1.00 0.00 H new ATOM 1154 N ARG A 73 6.947 8.343 3.527 1.00 0.00 N ATOM 1155 CA ARG A 73 6.802 8.083 4.964 1.00 0.00 C ATOM 1156 C ARG A 73 5.914 6.854 5.246 1.00 0.00 C ATOM 1157 O ARG A 73 6.181 6.084 6.172 1.00 0.00 O ATOM 1158 CB ARG A 73 6.237 9.316 5.689 1.00 0.00 C ATOM 1159 CG ARG A 73 4.841 9.722 5.231 1.00 0.00 C ATOM 1160 CD ARG A 73 4.238 10.803 6.122 1.00 0.00 C ATOM 1161 NE ARG A 73 2.868 11.121 5.727 1.00 0.00 N ATOM 1162 CZ ARG A 73 1.811 10.826 6.433 1.00 0.00 C ATOM 1163 NH1 ARG A 73 1.926 10.296 7.607 1.00 0.00 N ATOM 1164 NH2 ARG A 73 0.633 11.087 5.978 1.00 0.00 N ATOM 0 H ARG A 73 6.397 9.129 3.180 1.00 0.00 H new ATOM 0 HA ARG A 73 7.799 7.868 5.348 1.00 0.00 H new ATOM 0 HB2 ARG A 73 6.212 9.115 6.760 1.00 0.00 H new ATOM 0 HB3 ARG A 73 6.916 10.156 5.538 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.888 10.084 4.204 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.191 8.847 5.232 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.250 10.469 7.160 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.851 11.703 6.069 1.00 0.00 H new ATOM 0 HE ARG A 73 2.728 11.606 4.841 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.851 10.104 7.991 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.092 10.070 8.149 1.00 0.00 H new ATOM 0 HH21 ARG A 73 0.525 11.525 5.063 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.191 10.855 6.533 1.00 0.00 H new ATOM 1178 N ARG A 74 4.850 6.672 4.459 1.00 0.00 N ATOM 1179 CA ARG A 74 3.926 5.549 4.664 1.00 0.00 C ATOM 1180 C ARG A 74 3.900 4.620 3.435 1.00 0.00 C ATOM 1181 O ARG A 74 4.575 4.880 2.438 1.00 0.00 O ATOM 1182 CB ARG A 74 2.516 6.088 4.985 1.00 0.00 C ATOM 1183 CG ARG A 74 1.669 5.115 5.797 1.00 0.00 C ATOM 1184 CD ARG A 74 0.432 5.765 6.415 1.00 0.00 C ATOM 1185 NE ARG A 74 -0.135 4.917 7.463 1.00 0.00 N ATOM 1186 CZ ARG A 74 -1.294 5.102 8.033 1.00 0.00 C ATOM 1187 NH1 ARG A 74 -2.067 6.077 7.676 1.00 0.00 N ATOM 1188 NH2 ARG A 74 -1.681 4.300 8.972 1.00 0.00 N ATOM 0 H ARG A 74 4.607 7.282 3.679 1.00 0.00 H new ATOM 0 HA ARG A 74 4.275 4.956 5.510 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.609 7.024 5.535 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.001 6.316 4.052 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.356 4.292 5.155 1.00 0.00 H new ATOM 0 HG3 ARG A 74 2.281 4.686 6.590 1.00 0.00 H new ATOM 0 HD2 ARG A 74 0.697 6.737 6.832 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -0.315 5.943 5.642 1.00 0.00 H new ATOM 0 HE ARG A 74 0.419 4.118 7.773 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -1.773 6.716 6.938 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -2.970 6.206 8.133 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -1.081 3.528 9.263 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -2.586 4.440 9.421 1.00 0.00 H new ATOM 1202 N MET A 75 3.133 3.528 3.504 1.00 0.00 N ATOM 1203 CA MET A 75 3.027 2.593 2.375 1.00 0.00 C ATOM 1204 C MET A 75 1.636 1.939 2.285 1.00 0.00 C ATOM 1205 O MET A 75 1.114 1.410 3.268 1.00 0.00 O ATOM 1206 CB MET A 75 4.106 1.502 2.476 1.00 0.00 C ATOM 1207 CG MET A 75 4.005 0.432 1.391 1.00 0.00 C ATOM 1208 SD MET A 75 5.314 -0.804 1.491 1.00 0.00 S ATOM 1209 CE MET A 75 6.759 0.182 1.102 1.00 0.00 C ATOM 0 H MET A 75 2.580 3.269 4.321 1.00 0.00 H new ATOM 0 HA MET A 75 3.179 3.176 1.467 1.00 0.00 H new ATOM 0 HB2 MET A 75 5.089 1.970 2.421 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.035 1.023 3.453 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.038 -0.065 1.468 1.00 0.00 H new ATOM 0 HG3 MET A 75 4.040 0.911 0.413 1.00 0.00 H new ATOM 0 HE1 MET A 75 7.617 -0.473 0.951 1.00 0.00 H new ATOM 0 HE2 MET A 75 6.575 0.754 0.193 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.965 0.866 1.925 1.00 0.00 H new ATOM 1219 N VAL A 76 1.048 1.989 1.090 1.00 0.00 N ATOM 1220 CA VAL A 76 -0.188 1.267 0.788 1.00 0.00 C ATOM 1221 C VAL A 76 0.136 -0.177 0.378 1.00 0.00 C ATOM 1222 O VAL A 76 0.792 -0.409 -0.637 1.00 0.00 O ATOM 1223 CB VAL A 76 -0.974 1.951 -0.362 1.00 0.00 C ATOM 1224 CG1 VAL A 76 -2.281 1.212 -0.648 1.00 0.00 C ATOM 1225 CG2 VAL A 76 -1.238 3.418 -0.040 1.00 0.00 C ATOM 0 H VAL A 76 1.414 2.529 0.306 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.804 1.274 1.687 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.360 1.907 -1.262 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.812 1.712 -1.458 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.062 0.184 -0.938 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.902 1.212 0.248 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.790 3.877 -0.860 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.824 3.490 0.877 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.289 3.938 0.094 1.00 0.00 H new ATOM 1235 N VAL A 77 -0.308 -1.141 1.173 1.00 0.00 N ATOM 1236 CA VAL A 77 -0.015 -2.552 0.906 1.00 0.00 C ATOM 1237 C VAL A 77 -1.219 -3.263 0.278 1.00 0.00 C ATOM 1238 O VAL A 77 -2.169 -3.626 0.971 1.00 0.00 O ATOM 1239 CB VAL A 77 0.406 -3.292 2.201 1.00 0.00 C ATOM 1240 CG1 VAL A 77 0.679 -4.772 1.928 1.00 0.00 C ATOM 1241 CG2 VAL A 77 1.627 -2.622 2.825 1.00 0.00 C ATOM 0 H VAL A 77 -0.871 -0.978 2.007 1.00 0.00 H new ATOM 0 HA VAL A 77 0.815 -2.577 0.199 1.00 0.00 H new ATOM 0 HB VAL A 77 -0.421 -3.232 2.909 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.972 -5.265 2.855 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.223 -5.242 1.537 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.483 -4.865 1.198 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.909 -3.154 3.733 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.456 -2.646 2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.389 -1.587 3.070 1.00 0.00 H new ATOM 1251 N VAL A 78 -1.180 -3.448 -1.036 1.00 0.00 N ATOM 1252 CA VAL A 78 -2.241 -4.165 -1.744 1.00 0.00 C ATOM 1253 C VAL A 78 -2.203 -5.663 -1.411 1.00 0.00 C ATOM 1254 O VAL A 78 -1.379 -6.414 -1.936 1.00 0.00 O ATOM 1255 CB VAL A 78 -2.134 -3.959 -3.274 1.00 0.00 C ATOM 1256 CG1 VAL A 78 -3.148 -4.823 -4.024 1.00 0.00 C ATOM 1257 CG2 VAL A 78 -2.314 -2.481 -3.624 1.00 0.00 C ATOM 0 H VAL A 78 -0.426 -3.113 -1.636 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.194 -3.755 -1.409 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.139 -4.273 -3.589 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.047 -4.655 -5.096 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.964 -5.874 -3.803 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.157 -4.557 -3.709 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.236 -2.351 -4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.294 -2.144 -3.287 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.540 -1.893 -3.131 1.00 0.00 H new ATOM 1267 N VAL A 79 -3.094 -6.083 -0.522 1.00 0.00 N ATOM 1268 CA VAL A 79 -3.125 -7.466 -0.054 1.00 0.00 C ATOM 1269 C VAL A 79 -3.881 -8.370 -1.042 1.00 0.00 C ATOM 1270 O VAL A 79 -5.062 -8.159 -1.331 1.00 0.00 O ATOM 1271 CB VAL A 79 -3.767 -7.568 1.352 1.00 0.00 C ATOM 1272 CG1 VAL A 79 -3.545 -8.953 1.948 1.00 0.00 C ATOM 1273 CG2 VAL A 79 -3.212 -6.488 2.278 1.00 0.00 C ATOM 0 H VAL A 79 -3.808 -5.484 -0.108 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.092 -7.808 0.010 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.840 -7.410 1.248 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.004 -9.002 2.935 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.996 -9.704 1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.475 -9.144 2.035 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.676 -6.577 3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -2.133 -6.610 2.374 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -3.430 -5.505 1.862 1.00 0.00 H new ATOM 1283 N SER A 80 -3.182 -9.376 -1.554 1.00 0.00 N ATOM 1284 CA SER A 80 -3.726 -10.280 -2.574 1.00 0.00 C ATOM 1285 C SER A 80 -3.112 -11.673 -2.450 1.00 0.00 C ATOM 1286 O SER A 80 -1.960 -11.812 -2.042 1.00 0.00 O ATOM 1287 CB SER A 80 -3.440 -9.727 -3.978 1.00 0.00 C ATOM 1288 OG SER A 80 -3.690 -10.701 -4.980 1.00 0.00 O ATOM 0 H SER A 80 -2.224 -9.592 -1.278 1.00 0.00 H new ATOM 0 HA SER A 80 -4.803 -10.352 -2.419 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.061 -8.850 -4.158 1.00 0.00 H new ATOM 0 HB3 SER A 80 -2.402 -9.400 -4.037 1.00 0.00 H new ATOM 0 HG SER A 80 -3.930 -10.254 -5.818 1.00 0.00 H new ATOM 1294 N ASP A 81 -3.870 -12.706 -2.814 1.00 0.00 N ATOM 1295 CA ASP A 81 -3.346 -14.075 -2.805 1.00 0.00 C ATOM 1296 C ASP A 81 -2.169 -14.223 -3.789 1.00 0.00 C ATOM 1297 O ASP A 81 -1.324 -15.105 -3.636 1.00 0.00 O ATOM 1298 CB ASP A 81 -4.460 -15.082 -3.119 1.00 0.00 C ATOM 1299 CG ASP A 81 -5.188 -14.771 -4.412 1.00 0.00 C ATOM 1300 OD1 ASP A 81 -6.017 -13.839 -4.414 1.00 0.00 O ATOM 1301 OD2 ASP A 81 -4.946 -15.462 -5.424 1.00 0.00 O ATOM 0 H ASP A 81 -4.841 -12.625 -3.117 1.00 0.00 H new ATOM 0 HA ASP A 81 -2.969 -14.289 -1.805 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -4.032 -16.083 -3.180 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.176 -15.092 -2.298 1.00 0.00 H new ATOM 1306 N ASP A 82 -2.117 -13.340 -4.789 1.00 0.00 N ATOM 1307 CA ASP A 82 -0.976 -13.272 -5.710 1.00 0.00 C ATOM 1308 C ASP A 82 0.195 -12.513 -5.063 1.00 0.00 C ATOM 1309 O ASP A 82 1.358 -12.884 -5.212 1.00 0.00 O ATOM 1310 CB ASP A 82 -1.388 -12.582 -7.010 1.00 0.00 C ATOM 1311 CG ASP A 82 -2.593 -13.239 -7.654 1.00 0.00 C ATOM 1312 OD1 ASP A 82 -2.485 -14.410 -8.068 1.00 0.00 O ATOM 1313 OD2 ASP A 82 -3.654 -12.585 -7.759 1.00 0.00 O ATOM 0 H ASP A 82 -2.852 -12.660 -4.983 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.653 -14.289 -5.933 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.613 -11.535 -6.807 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -0.551 -12.599 -7.708 1.00 0.00 H new ATOM 1318 N TYR A 83 -0.134 -11.442 -4.345 1.00 0.00 N ATOM 1319 CA TYR A 83 0.849 -10.675 -3.563 1.00 0.00 C ATOM 1320 C TYR A 83 1.589 -11.583 -2.564 1.00 0.00 C ATOM 1321 O TYR A 83 2.769 -11.391 -2.278 1.00 0.00 O ATOM 1322 CB TYR A 83 0.119 -9.537 -2.828 1.00 0.00 C ATOM 1323 CG TYR A 83 0.969 -8.734 -1.860 1.00 0.00 C ATOM 1324 CD1 TYR A 83 1.831 -7.742 -2.314 1.00 0.00 C ATOM 1325 CD2 TYR A 83 0.893 -8.955 -0.486 1.00 0.00 C ATOM 1326 CE1 TYR A 83 2.590 -6.998 -1.432 1.00 0.00 C ATOM 1327 CE2 TYR A 83 1.650 -8.215 0.400 1.00 0.00 C ATOM 1328 CZ TYR A 83 2.497 -7.238 -0.077 1.00 0.00 C ATOM 1329 OH TYR A 83 3.248 -6.491 0.803 1.00 0.00 O ATOM 0 H TYR A 83 -1.085 -11.077 -4.285 1.00 0.00 H new ATOM 0 HA TYR A 83 1.597 -10.255 -4.236 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.297 -8.856 -3.571 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.722 -9.962 -2.280 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.908 -7.550 -3.374 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.230 -9.719 -0.108 1.00 0.00 H new ATOM 0 HE1 TYR A 83 3.254 -6.231 -1.802 1.00 0.00 H new ATOM 0 HE2 TYR A 83 1.579 -8.401 1.462 1.00 0.00 H new ATOM 0 HH TYR A 83 3.937 -7.058 1.209 1.00 0.00 H new ATOM 1339 N LEU A 84 0.883 -12.585 -2.052 1.00 0.00 N ATOM 1340 CA LEU A 84 1.462 -13.549 -1.110 1.00 0.00 C ATOM 1341 C LEU A 84 2.473 -14.490 -1.792 1.00 0.00 C ATOM 1342 O LEU A 84 3.206 -15.217 -1.119 1.00 0.00 O ATOM 1343 CB LEU A 84 0.342 -14.374 -0.463 1.00 0.00 C ATOM 1344 CG LEU A 84 -0.753 -13.554 0.238 1.00 0.00 C ATOM 1345 CD1 LEU A 84 -1.853 -14.464 0.770 1.00 0.00 C ATOM 1346 CD2 LEU A 84 -0.163 -12.703 1.360 1.00 0.00 C ATOM 0 H LEU A 84 -0.098 -12.755 -2.273 1.00 0.00 H new ATOM 0 HA LEU A 84 2.000 -12.985 -0.348 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.124 -14.990 -1.232 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.787 -15.053 0.264 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.195 -12.882 -0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.617 -13.862 1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.302 -15.014 -0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.429 -15.168 1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.958 -12.132 1.840 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.314 -13.351 2.096 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.577 -12.018 0.946 1.00 0.00 H new ATOM 1358 N GLN A 85 2.513 -14.473 -3.124 1.00 0.00 N ATOM 1359 CA GLN A 85 3.406 -15.357 -3.891 1.00 0.00 C ATOM 1360 C GLN A 85 4.848 -14.822 -3.979 1.00 0.00 C ATOM 1361 O GLN A 85 5.628 -15.280 -4.815 1.00 0.00 O ATOM 1362 CB GLN A 85 2.845 -15.582 -5.305 1.00 0.00 C ATOM 1363 CG GLN A 85 1.491 -16.291 -5.341 1.00 0.00 C ATOM 1364 CD GLN A 85 1.538 -17.725 -4.828 1.00 0.00 C ATOM 1365 OE1 GLN A 85 2.326 -18.071 -3.950 1.00 0.00 O ATOM 1366 NE2 GLN A 85 0.699 -18.576 -5.378 1.00 0.00 N ATOM 0 H GLN A 85 1.938 -13.858 -3.700 1.00 0.00 H new ATOM 0 HA GLN A 85 3.448 -16.304 -3.353 1.00 0.00 H new ATOM 0 HB2 GLN A 85 2.750 -14.617 -5.803 1.00 0.00 H new ATOM 0 HB3 GLN A 85 3.563 -16.167 -5.879 1.00 0.00 H new ATOM 0 HG2 GLN A 85 0.777 -15.724 -4.743 1.00 0.00 H new ATOM 0 HG3 GLN A 85 1.119 -16.293 -6.365 1.00 0.00 H new ATOM 0 HE21 GLN A 85 0.056 -18.261 -6.105 1.00 0.00 H new ATOM 0 HE22 GLN A 85 0.691 -19.551 -5.078 1.00 0.00 H new ATOM 1375 N SER A 86 5.186 -13.854 -3.121 1.00 0.00 N ATOM 1376 CA SER A 86 6.574 -13.363 -2.975 1.00 0.00 C ATOM 1377 C SER A 86 6.982 -12.381 -4.088 1.00 0.00 C ATOM 1378 O SER A 86 6.271 -12.229 -5.076 1.00 0.00 O ATOM 1379 CB SER A 86 7.573 -14.537 -2.912 1.00 0.00 C ATOM 1380 OG SER A 86 8.913 -14.082 -2.795 1.00 0.00 O ATOM 0 H SER A 86 4.516 -13.387 -2.509 1.00 0.00 H new ATOM 0 HA SER A 86 6.605 -12.815 -2.034 1.00 0.00 H new ATOM 0 HB2 SER A 86 7.330 -15.176 -2.063 1.00 0.00 H new ATOM 0 HB3 SER A 86 7.473 -15.148 -3.809 1.00 0.00 H new ATOM 0 HG SER A 86 8.982 -13.459 -2.042 1.00 0.00 H new ATOM 1386 N LYS A 87 8.153 -11.746 -3.894 1.00 0.00 N ATOM 1387 CA LYS A 87 8.728 -10.707 -4.779 1.00 0.00 C ATOM 1388 C LYS A 87 8.389 -9.306 -4.258 1.00 0.00 C ATOM 1389 O LYS A 87 9.212 -8.659 -3.606 1.00 0.00 O ATOM 1390 CB LYS A 87 8.307 -10.846 -6.253 1.00 0.00 C ATOM 1391 CG LYS A 87 8.725 -12.164 -6.901 1.00 0.00 C ATOM 1392 CD LYS A 87 8.252 -12.252 -8.348 1.00 0.00 C ATOM 1393 CE LYS A 87 6.757 -11.969 -8.476 1.00 0.00 C ATOM 1394 NZ LYS A 87 5.933 -12.903 -7.662 1.00 0.00 N ATOM 0 H LYS A 87 8.748 -11.947 -3.090 1.00 0.00 H new ATOM 0 HA LYS A 87 9.807 -10.856 -4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 87 7.224 -10.748 -6.321 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.738 -10.022 -6.822 1.00 0.00 H new ATOM 0 HG2 LYS A 87 9.810 -12.260 -6.866 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.313 -12.997 -6.331 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.810 -11.540 -8.956 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.469 -13.245 -8.741 1.00 0.00 H new ATOM 0 HE2 LYS A 87 6.556 -10.944 -8.164 1.00 0.00 H new ATOM 0 HE3 LYS A 87 6.463 -12.047 -9.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.925 -12.739 -7.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 6.178 -13.884 -7.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.119 -12.740 -6.652 1.00 0.00 H new ATOM 1408 N GLU A 88 7.170 -8.849 -4.519 1.00 0.00 N ATOM 1409 CA GLU A 88 6.730 -7.539 -4.030 1.00 0.00 C ATOM 1410 C GLU A 88 6.385 -7.603 -2.536 1.00 0.00 C ATOM 1411 O GLU A 88 6.561 -6.627 -1.800 1.00 0.00 O ATOM 1412 CB GLU A 88 5.539 -7.014 -4.845 1.00 0.00 C ATOM 1413 CG GLU A 88 4.261 -7.844 -4.737 1.00 0.00 C ATOM 1414 CD GLU A 88 4.338 -9.159 -5.490 1.00 0.00 C ATOM 1415 OE1 GLU A 88 4.179 -9.150 -6.731 1.00 0.00 O ATOM 1416 OE2 GLU A 88 4.571 -10.199 -4.850 1.00 0.00 O ATOM 0 H GLU A 88 6.471 -9.357 -5.061 1.00 0.00 H new ATOM 0 HA GLU A 88 7.556 -6.839 -4.159 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.320 -5.996 -4.524 1.00 0.00 H new ATOM 0 HB3 GLU A 88 5.832 -6.962 -5.894 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.054 -8.046 -3.686 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.423 -7.261 -5.121 1.00 0.00 H new ATOM 1423 N CYS A 89 5.900 -8.764 -2.092 1.00 0.00 N ATOM 1424 CA CYS A 89 5.680 -9.017 -0.661 1.00 0.00 C ATOM 1425 C CYS A 89 6.989 -8.884 0.127 1.00 0.00 C ATOM 1426 O CYS A 89 7.036 -8.241 1.176 1.00 0.00 O ATOM 1427 CB CYS A 89 5.090 -10.417 -0.443 1.00 0.00 C ATOM 1428 SG CYS A 89 4.887 -10.875 1.296 1.00 0.00 S ATOM 0 H CYS A 89 5.651 -9.545 -2.699 1.00 0.00 H new ATOM 0 HA CYS A 89 4.973 -8.271 -0.298 1.00 0.00 H new ATOM 0 HB2 CYS A 89 4.120 -10.471 -0.937 1.00 0.00 H new ATOM 0 HB3 CYS A 89 5.735 -11.150 -0.927 1.00 0.00 H new ATOM 0 HG CYS A 89 4.382 -12.070 1.374 1.00 0.00 H new ATOM 1434 N ASP A 90 8.054 -9.497 -0.389 1.00 0.00 N ATOM 1435 CA ASP A 90 9.387 -9.405 0.221 1.00 0.00 C ATOM 1436 C ASP A 90 9.901 -7.959 0.217 1.00 0.00 C ATOM 1437 O ASP A 90 10.515 -7.505 1.187 1.00 0.00 O ATOM 1438 CB ASP A 90 10.366 -10.314 -0.526 1.00 0.00 C ATOM 1439 CG ASP A 90 9.933 -11.767 -0.491 1.00 0.00 C ATOM 1440 OD1 ASP A 90 8.832 -12.070 -0.992 1.00 0.00 O ATOM 1441 OD2 ASP A 90 10.679 -12.610 0.050 1.00 0.00 O ATOM 0 H ASP A 90 8.022 -10.067 -1.234 1.00 0.00 H new ATOM 0 HA ASP A 90 9.310 -9.732 1.258 1.00 0.00 H new ATOM 0 HB2 ASP A 90 10.448 -9.985 -1.562 1.00 0.00 H new ATOM 0 HB3 ASP A 90 11.357 -10.221 -0.083 1.00 0.00 H new ATOM 1446 N PHE A 91 9.653 -7.252 -0.888 1.00 0.00 N ATOM 1447 CA PHE A 91 9.980 -5.825 -0.998 1.00 0.00 C ATOM 1448 C PHE A 91 9.385 -5.031 0.176 1.00 0.00 C ATOM 1449 O PHE A 91 10.087 -4.281 0.857 1.00 0.00 O ATOM 1450 CB PHE A 91 9.454 -5.276 -2.333 1.00 0.00 C ATOM 1451 CG PHE A 91 9.592 -3.781 -2.483 1.00 0.00 C ATOM 1452 CD1 PHE A 91 10.747 -3.224 -3.011 1.00 0.00 C ATOM 1453 CD2 PHE A 91 8.564 -2.931 -2.093 1.00 0.00 C ATOM 1454 CE1 PHE A 91 10.872 -1.856 -3.146 1.00 0.00 C ATOM 1455 CE2 PHE A 91 8.687 -1.565 -2.224 1.00 0.00 C ATOM 1456 CZ PHE A 91 9.843 -1.026 -2.752 1.00 0.00 C ATOM 0 H PHE A 91 9.224 -7.646 -1.725 1.00 0.00 H new ATOM 0 HA PHE A 91 11.064 -5.713 -0.964 1.00 0.00 H new ATOM 0 HB2 PHE A 91 9.988 -5.763 -3.149 1.00 0.00 H new ATOM 0 HB3 PHE A 91 8.403 -5.545 -2.435 1.00 0.00 H new ATOM 0 HD1 PHE A 91 11.557 -3.868 -3.320 1.00 0.00 H new ATOM 0 HD2 PHE A 91 7.656 -3.347 -1.682 1.00 0.00 H new ATOM 0 HE1 PHE A 91 11.776 -1.435 -3.560 1.00 0.00 H new ATOM 0 HE2 PHE A 91 7.880 -0.917 -1.914 1.00 0.00 H new ATOM 0 HZ PHE A 91 9.942 0.044 -2.857 1.00 0.00 H new ATOM 1466 N GLN A 92 8.086 -5.201 0.397 1.00 0.00 N ATOM 1467 CA GLN A 92 7.401 -4.566 1.525 1.00 0.00 C ATOM 1468 C GLN A 92 7.963 -5.074 2.858 1.00 0.00 C ATOM 1469 O GLN A 92 8.293 -4.288 3.745 1.00 0.00 O ATOM 1470 CB GLN A 92 5.888 -4.840 1.422 1.00 0.00 C ATOM 1471 CG GLN A 92 5.037 -4.307 2.583 1.00 0.00 C ATOM 1472 CD GLN A 92 4.994 -5.245 3.785 1.00 0.00 C ATOM 1473 OE1 GLN A 92 5.772 -5.127 4.721 1.00 0.00 O ATOM 1474 NE2 GLN A 92 4.095 -6.202 3.753 1.00 0.00 N ATOM 0 H GLN A 92 7.481 -5.775 -0.191 1.00 0.00 H new ATOM 0 HA GLN A 92 7.569 -3.490 1.488 1.00 0.00 H new ATOM 0 HB2 GLN A 92 5.520 -4.402 0.494 1.00 0.00 H new ATOM 0 HB3 GLN A 92 5.736 -5.917 1.348 1.00 0.00 H new ATOM 0 HG2 GLN A 92 5.432 -3.341 2.899 1.00 0.00 H new ATOM 0 HG3 GLN A 92 4.020 -4.135 2.229 1.00 0.00 H new ATOM 0 HE21 GLN A 92 3.458 -6.277 2.960 1.00 0.00 H new ATOM 0 HE22 GLN A 92 4.034 -6.870 4.521 1.00 0.00 H new ATOM 1483 N THR A 93 8.091 -6.396 2.974 1.00 0.00 N ATOM 1484 CA THR A 93 8.548 -7.035 4.217 1.00 0.00 C ATOM 1485 C THR A 93 9.862 -6.432 4.733 1.00 0.00 C ATOM 1486 O THR A 93 9.964 -6.084 5.907 1.00 0.00 O ATOM 1487 CB THR A 93 8.718 -8.570 4.048 1.00 0.00 C ATOM 1488 OG1 THR A 93 7.452 -9.184 3.747 1.00 0.00 O ATOM 1489 CG2 THR A 93 9.297 -9.210 5.307 1.00 0.00 C ATOM 0 H THR A 93 7.884 -7.052 2.220 1.00 0.00 H new ATOM 0 HA THR A 93 7.768 -6.844 4.954 1.00 0.00 H new ATOM 0 HB THR A 93 9.412 -8.732 3.223 1.00 0.00 H new ATOM 0 HG1 THR A 93 7.164 -8.917 2.849 1.00 0.00 H new ATOM 0 HG21 THR A 93 9.402 -10.284 5.154 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.274 -8.776 5.519 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.628 -9.028 6.148 1.00 0.00 H new ATOM 1497 N LYS A 94 10.866 -6.292 3.862 1.00 0.00 N ATOM 1498 CA LYS A 94 12.163 -5.738 4.284 1.00 0.00 C ATOM 1499 C LYS A 94 12.026 -4.276 4.745 1.00 0.00 C ATOM 1500 O LYS A 94 12.685 -3.852 5.699 1.00 0.00 O ATOM 1501 CB LYS A 94 13.211 -5.847 3.166 1.00 0.00 C ATOM 1502 CG LYS A 94 12.912 -5.013 1.924 1.00 0.00 C ATOM 1503 CD LYS A 94 14.063 -5.071 0.922 1.00 0.00 C ATOM 1504 CE LYS A 94 13.794 -4.217 -0.311 1.00 0.00 C ATOM 1505 NZ LYS A 94 14.946 -4.233 -1.252 1.00 0.00 N ATOM 0 H LYS A 94 10.812 -6.549 2.876 1.00 0.00 H new ATOM 0 HA LYS A 94 12.504 -6.333 5.131 1.00 0.00 H new ATOM 0 HB2 LYS A 94 14.179 -5.545 3.565 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.300 -6.893 2.871 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.999 -5.375 1.452 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.732 -3.978 2.214 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.980 -4.732 1.404 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.226 -6.105 0.618 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.903 -4.583 -0.820 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.588 -3.191 -0.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.860 -3.440 -1.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.833 -4.141 -0.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.951 -5.129 -1.779 1.00 0.00 H new ATOM 1519 N PHE A 95 11.167 -3.516 4.066 1.00 0.00 N ATOM 1520 CA PHE A 95 10.855 -2.141 4.471 1.00 0.00 C ATOM 1521 C PHE A 95 10.240 -2.122 5.877 1.00 0.00 C ATOM 1522 O PHE A 95 10.730 -1.439 6.777 1.00 0.00 O ATOM 1523 CB PHE A 95 9.892 -1.506 3.453 1.00 0.00 C ATOM 1524 CG PHE A 95 9.338 -0.163 3.871 1.00 0.00 C ATOM 1525 CD1 PHE A 95 10.084 0.995 3.705 1.00 0.00 C ATOM 1526 CD2 PHE A 95 8.065 -0.059 4.422 1.00 0.00 C ATOM 1527 CE1 PHE A 95 9.574 2.225 4.080 1.00 0.00 C ATOM 1528 CE2 PHE A 95 7.554 1.169 4.799 1.00 0.00 C ATOM 1529 CZ PHE A 95 8.309 2.311 4.627 1.00 0.00 C ATOM 0 H PHE A 95 10.672 -3.828 3.230 1.00 0.00 H new ATOM 0 HA PHE A 95 11.777 -1.561 4.496 1.00 0.00 H new ATOM 0 HB2 PHE A 95 10.412 -1.391 2.502 1.00 0.00 H new ATOM 0 HB3 PHE A 95 9.061 -2.190 3.281 1.00 0.00 H new ATOM 0 HD1 PHE A 95 11.074 0.935 3.278 1.00 0.00 H new ATOM 0 HD2 PHE A 95 7.468 -0.949 4.557 1.00 0.00 H new ATOM 0 HE1 PHE A 95 10.165 3.118 3.945 1.00 0.00 H new ATOM 0 HE2 PHE A 95 6.565 1.234 5.228 1.00 0.00 H new ATOM 0 HZ PHE A 95 7.911 3.271 4.920 1.00 0.00 H new ATOM 1539 N ALA A 96 9.179 -2.902 6.055 1.00 0.00 N ATOM 1540 CA ALA A 96 8.481 -2.998 7.337 1.00 0.00 C ATOM 1541 C ALA A 96 9.413 -3.478 8.464 1.00 0.00 C ATOM 1542 O ALA A 96 9.378 -2.949 9.577 1.00 0.00 O ATOM 1543 CB ALA A 96 7.280 -3.926 7.199 1.00 0.00 C ATOM 0 H ALA A 96 8.778 -3.484 5.320 1.00 0.00 H new ATOM 0 HA ALA A 96 8.137 -2.000 7.611 1.00 0.00 H new ATOM 0 HB1 ALA A 96 6.762 -3.996 8.156 1.00 0.00 H new ATOM 0 HB2 ALA A 96 6.599 -3.530 6.446 1.00 0.00 H new ATOM 0 HB3 ALA A 96 7.619 -4.917 6.897 1.00 0.00 H new ATOM 1549 N LEU A 97 10.247 -4.476 8.168 1.00 0.00 N ATOM 1550 CA LEU A 97 11.220 -4.997 9.141 1.00 0.00 C ATOM 1551 C LEU A 97 12.231 -3.920 9.566 1.00 0.00 C ATOM 1552 O LEU A 97 12.642 -3.866 10.726 1.00 0.00 O ATOM 1553 CB LEU A 97 11.973 -6.205 8.561 1.00 0.00 C ATOM 1554 CG LEU A 97 11.135 -7.480 8.365 1.00 0.00 C ATOM 1555 CD1 LEU A 97 11.963 -8.573 7.694 1.00 0.00 C ATOM 1556 CD2 LEU A 97 10.578 -7.974 9.700 1.00 0.00 C ATOM 0 H LEU A 97 10.271 -4.943 7.262 1.00 0.00 H new ATOM 0 HA LEU A 97 10.658 -5.308 10.022 1.00 0.00 H new ATOM 0 HB2 LEU A 97 12.396 -5.918 7.598 1.00 0.00 H new ATOM 0 HB3 LEU A 97 12.809 -6.439 9.220 1.00 0.00 H new ATOM 0 HG LEU A 97 10.296 -7.236 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.351 -9.466 7.565 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.305 -8.224 6.720 1.00 0.00 H new ATOM 0 HD13 LEU A 97 12.825 -8.811 8.317 1.00 0.00 H new ATOM 0 HD21 LEU A 97 9.989 -8.876 9.537 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.402 -8.196 10.378 1.00 0.00 H new ATOM 0 HD23 LEU A 97 9.945 -7.202 10.138 1.00 0.00 H new ATOM 1568 N SER A 98 12.624 -3.066 8.619 1.00 0.00 N ATOM 1569 CA SER A 98 13.612 -2.006 8.883 1.00 0.00 C ATOM 1570 C SER A 98 13.044 -0.906 9.794 1.00 0.00 C ATOM 1571 O SER A 98 13.794 -0.112 10.367 1.00 0.00 O ATOM 1572 CB SER A 98 14.092 -1.382 7.561 1.00 0.00 C ATOM 1573 OG SER A 98 15.096 -0.397 7.774 1.00 0.00 O ATOM 0 H SER A 98 12.276 -3.084 7.660 1.00 0.00 H new ATOM 0 HA SER A 98 14.453 -2.470 9.398 1.00 0.00 H new ATOM 0 HB2 SER A 98 14.483 -2.165 6.911 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.245 -0.931 7.043 1.00 0.00 H new ATOM 0 HG SER A 98 15.377 -0.025 6.912 1.00 0.00 H new ATOM 1579 N LEU A 99 11.720 -0.870 9.929 1.00 0.00 N ATOM 1580 CA LEU A 99 11.045 0.160 10.725 1.00 0.00 C ATOM 1581 C LEU A 99 11.089 -0.151 12.232 1.00 0.00 C ATOM 1582 O LEU A 99 11.929 0.381 12.964 1.00 0.00 O ATOM 1583 CB LEU A 99 9.588 0.300 10.263 1.00 0.00 C ATOM 1584 CG LEU A 99 9.402 0.660 8.782 1.00 0.00 C ATOM 1585 CD1 LEU A 99 7.922 0.671 8.411 1.00 0.00 C ATOM 1586 CD2 LEU A 99 10.051 2.006 8.474 1.00 0.00 C ATOM 0 H LEU A 99 11.089 -1.544 9.496 1.00 0.00 H new ATOM 0 HA LEU A 99 11.576 1.099 10.569 1.00 0.00 H new ATOM 0 HB2 LEU A 99 9.070 -0.639 10.460 1.00 0.00 H new ATOM 0 HB3 LEU A 99 9.103 1.065 10.870 1.00 0.00 H new ATOM 0 HG LEU A 99 9.895 -0.102 8.178 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.813 0.928 7.357 1.00 0.00 H new ATOM 0 HD12 LEU A 99 7.495 -0.316 8.590 1.00 0.00 H new ATOM 0 HD13 LEU A 99 7.400 1.408 9.021 1.00 0.00 H new ATOM 0 HD21 LEU A 99 9.910 2.245 7.420 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.591 2.781 9.087 1.00 0.00 H new ATOM 0 HD23 LEU A 99 11.117 1.955 8.695 1.00 0.00 H new ATOM 1598 N SER A 100 10.190 -1.029 12.683 1.00 0.00 N ATOM 1599 CA SER A 100 10.034 -1.332 14.116 1.00 0.00 C ATOM 1600 C SER A 100 8.909 -2.354 14.351 1.00 0.00 C ATOM 1601 O SER A 100 7.849 -2.277 13.715 1.00 0.00 O ATOM 1602 CB SER A 100 9.724 -0.047 14.906 1.00 0.00 C ATOM 1603 OG SER A 100 9.531 -0.317 16.286 1.00 0.00 O ATOM 0 H SER A 100 9.554 -1.547 12.077 1.00 0.00 H new ATOM 0 HA SER A 100 10.974 -1.759 14.465 1.00 0.00 H new ATOM 0 HB2 SER A 100 10.543 0.662 14.784 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.830 0.425 14.498 1.00 0.00 H new ATOM 0 HG SER A 100 9.338 0.519 16.759 1.00 0.00 H new ATOM 1609 N PRO A 101 9.125 -3.342 15.247 1.00 0.00 N ATOM 1610 CA PRO A 101 8.088 -4.327 15.614 1.00 0.00 C ATOM 1611 C PRO A 101 6.789 -3.658 16.094 1.00 0.00 C ATOM 1612 O PRO A 101 6.819 -2.745 16.924 1.00 0.00 O ATOM 1613 CB PRO A 101 8.741 -5.127 16.752 1.00 0.00 C ATOM 1614 CG PRO A 101 10.208 -4.978 16.523 1.00 0.00 C ATOM 1615 CD PRO A 101 10.395 -3.593 15.959 1.00 0.00 C ATOM 0 HA PRO A 101 7.789 -4.941 14.765 1.00 0.00 H new ATOM 0 HB2 PRO A 101 8.451 -4.738 17.728 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.440 -6.174 16.724 1.00 0.00 H new ATOM 0 HG2 PRO A 101 10.764 -5.100 17.453 1.00 0.00 H new ATOM 0 HG3 PRO A 101 10.575 -5.735 15.830 1.00 0.00 H new ATOM 0 HD2 PRO A 101 10.567 -2.858 16.745 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.250 -3.545 15.285 1.00 0.00 H new ATOM 1623 N GLY A 102 5.650 -4.112 15.574 1.00 0.00 N ATOM 1624 CA GLY A 102 4.372 -3.479 15.891 1.00 0.00 C ATOM 1625 C GLY A 102 4.120 -2.208 15.078 1.00 0.00 C ATOM 1626 O GLY A 102 3.128 -2.114 14.349 1.00 0.00 O ATOM 0 H GLY A 102 5.586 -4.907 14.938 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.565 -4.188 15.706 1.00 0.00 H new ATOM 0 HA3 GLY A 102 4.346 -3.236 16.953 1.00 0.00 H new ATOM 1630 N ALA A 103 5.030 -1.235 15.190 1.00 0.00 N ATOM 1631 CA ALA A 103 4.908 0.044 14.475 1.00 0.00 C ATOM 1632 C ALA A 103 4.669 -0.155 12.976 1.00 0.00 C ATOM 1633 O ALA A 103 3.776 0.461 12.398 1.00 0.00 O ATOM 1634 CB ALA A 103 6.155 0.895 14.686 1.00 0.00 C ATOM 0 H ALA A 103 5.864 -1.308 15.772 1.00 0.00 H new ATOM 0 HA ALA A 103 4.040 0.558 14.888 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.047 1.838 14.150 1.00 0.00 H new ATOM 0 HB2 ALA A 103 6.283 1.095 15.750 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.028 0.361 14.310 1.00 0.00 H new ATOM 1640 N HIS A 104 5.460 -1.033 12.355 1.00 0.00 N ATOM 1641 CA HIS A 104 5.353 -1.268 10.911 1.00 0.00 C ATOM 1642 C HIS A 104 3.937 -1.721 10.501 1.00 0.00 C ATOM 1643 O HIS A 104 3.527 -1.526 9.365 1.00 0.00 O ATOM 1644 CB HIS A 104 6.412 -2.278 10.433 1.00 0.00 C ATOM 1645 CG HIS A 104 6.251 -3.673 10.964 1.00 0.00 C ATOM 1646 ND1 HIS A 104 7.109 -4.235 11.888 1.00 0.00 N ATOM 1647 CD2 HIS A 104 5.347 -4.637 10.667 1.00 0.00 C ATOM 1648 CE1 HIS A 104 6.739 -5.475 12.134 1.00 0.00 C ATOM 1649 NE2 HIS A 104 5.675 -5.742 11.409 1.00 0.00 N ATOM 0 H HIS A 104 6.176 -1.589 12.823 1.00 0.00 H new ATOM 0 HA HIS A 104 5.543 -0.314 10.418 1.00 0.00 H new ATOM 0 HB2 HIS A 104 6.389 -2.316 9.344 1.00 0.00 H new ATOM 0 HB3 HIS A 104 7.397 -1.909 10.718 1.00 0.00 H new ATOM 0 HD1 HIS A 104 7.906 -3.763 12.314 1.00 0.00 H new ATOM 0 HD2 HIS A 104 4.522 -4.551 9.975 1.00 0.00 H new ATOM 0 HE1 HIS A 104 7.227 -6.157 12.815 1.00 0.00 H new ATOM 1658 N GLN A 105 3.193 -2.313 11.434 1.00 0.00 N ATOM 1659 CA GLN A 105 1.812 -2.737 11.162 1.00 0.00 C ATOM 1660 C GLN A 105 0.857 -1.533 11.115 1.00 0.00 C ATOM 1661 O GLN A 105 -0.071 -1.493 10.306 1.00 0.00 O ATOM 1662 CB GLN A 105 1.339 -3.728 12.225 1.00 0.00 C ATOM 1663 CG GLN A 105 2.046 -5.073 12.192 1.00 0.00 C ATOM 1664 CD GLN A 105 1.650 -5.964 13.355 1.00 0.00 C ATOM 1665 OE1 GLN A 105 2.246 -5.907 14.425 1.00 0.00 O ATOM 1666 NE2 GLN A 105 0.649 -6.794 13.157 1.00 0.00 N ATOM 0 H GLN A 105 3.517 -2.511 12.381 1.00 0.00 H new ATOM 0 HA GLN A 105 1.802 -3.223 10.186 1.00 0.00 H new ATOM 0 HB2 GLN A 105 1.481 -3.281 13.209 1.00 0.00 H new ATOM 0 HB3 GLN A 105 0.269 -3.891 12.101 1.00 0.00 H new ATOM 0 HG2 GLN A 105 1.814 -5.579 11.255 1.00 0.00 H new ATOM 0 HG3 GLN A 105 3.124 -4.914 12.210 1.00 0.00 H new ATOM 0 HE21 GLN A 105 0.175 -6.815 12.254 1.00 0.00 H new ATOM 0 HE22 GLN A 105 0.347 -7.416 13.906 1.00 0.00 H new ATOM 1675 N LYS A 106 1.073 -0.567 12.006 1.00 0.00 N ATOM 1676 CA LYS A 106 0.311 0.692 11.991 1.00 0.00 C ATOM 1677 C LYS A 106 0.765 1.578 10.814 1.00 0.00 C ATOM 1678 O LYS A 106 -0.014 2.352 10.250 1.00 0.00 O ATOM 1679 CB LYS A 106 0.506 1.447 13.317 1.00 0.00 C ATOM 1680 CG LYS A 106 0.242 0.609 14.570 1.00 0.00 C ATOM 1681 CD LYS A 106 -1.166 0.014 14.586 1.00 0.00 C ATOM 1682 CE LYS A 106 -1.483 -0.662 15.920 1.00 0.00 C ATOM 1683 NZ LYS A 106 -0.519 -1.748 16.253 1.00 0.00 N ATOM 0 H LYS A 106 1.768 -0.627 12.750 1.00 0.00 H new ATOM 0 HA LYS A 106 -0.746 0.456 11.869 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.527 1.826 13.358 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -0.156 2.313 13.328 1.00 0.00 H new ATOM 0 HG2 LYS A 106 0.975 -0.196 14.627 1.00 0.00 H new ATOM 0 HG3 LYS A 106 0.382 1.230 15.455 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.895 0.801 14.395 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -1.263 -0.712 13.779 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.472 0.085 16.714 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.491 -1.074 15.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -0.886 -2.305 17.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -0.395 -2.367 15.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 0.397 -1.331 16.514 1.00 0.00 H new ATOM 1697 N ARG A 107 2.045 1.445 10.462 1.00 0.00 N ATOM 1698 CA ARG A 107 2.641 2.153 9.324 1.00 0.00 C ATOM 1699 C ARG A 107 1.941 1.787 8.009 1.00 0.00 C ATOM 1700 O ARG A 107 1.459 2.652 7.284 1.00 0.00 O ATOM 1701 CB ARG A 107 4.132 1.791 9.211 1.00 0.00 C ATOM 1702 CG ARG A 107 4.838 2.391 7.990 1.00 0.00 C ATOM 1703 CD ARG A 107 5.409 3.775 8.273 1.00 0.00 C ATOM 1704 NE ARG A 107 6.516 3.719 9.224 1.00 0.00 N ATOM 1705 CZ ARG A 107 7.596 4.454 9.151 1.00 0.00 C ATOM 1706 NH1 ARG A 107 7.785 5.267 8.159 1.00 0.00 N ATOM 1707 NH2 ARG A 107 8.501 4.359 10.069 1.00 0.00 N ATOM 0 H ARG A 107 2.701 0.842 10.959 1.00 0.00 H new ATOM 0 HA ARG A 107 2.522 3.223 9.497 1.00 0.00 H new ATOM 0 HB2 ARG A 107 4.644 2.126 10.113 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.228 0.706 9.174 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.642 1.726 7.675 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.134 2.454 7.161 1.00 0.00 H new ATOM 0 HD2 ARG A 107 5.752 4.224 7.341 1.00 0.00 H new ATOM 0 HD3 ARG A 107 4.623 4.419 8.667 1.00 0.00 H new ATOM 0 HE ARG A 107 6.442 3.061 10.000 1.00 0.00 H new ATOM 0 HH11 ARG A 107 7.086 5.341 7.420 1.00 0.00 H new ATOM 0 HH12 ARG A 107 8.633 5.833 8.118 1.00 0.00 H new ATOM 0 HH21 ARG A 107 8.372 3.712 10.847 1.00 0.00 H new ATOM 0 HH22 ARG A 107 9.344 4.931 10.015 1.00 0.00 H new ATOM 1721 N LEU A 108 1.905 0.496 7.711 1.00 0.00 N ATOM 1722 CA LEU A 108 1.381 0.004 6.437 1.00 0.00 C ATOM 1723 C LEU A 108 -0.155 0.030 6.401 1.00 0.00 C ATOM 1724 O LEU A 108 -0.815 -0.175 7.418 1.00 0.00 O ATOM 1725 CB LEU A 108 1.882 -1.425 6.201 1.00 0.00 C ATOM 1726 CG LEU A 108 3.399 -1.622 6.361 1.00 0.00 C ATOM 1727 CD1 LEU A 108 3.777 -3.085 6.165 1.00 0.00 C ATOM 1728 CD2 LEU A 108 4.177 -0.723 5.403 1.00 0.00 C ATOM 0 H LEU A 108 2.235 -0.238 8.338 1.00 0.00 H new ATOM 0 HA LEU A 108 1.739 0.664 5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.370 -2.092 6.895 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.596 -1.732 5.195 1.00 0.00 H new ATOM 0 HG LEU A 108 3.669 -1.335 7.377 1.00 0.00 H new ATOM 0 HD11 LEU A 108 4.854 -3.201 6.283 1.00 0.00 H new ATOM 0 HD12 LEU A 108 3.263 -3.696 6.907 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.484 -3.406 5.165 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.246 -0.885 5.540 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.902 -0.962 4.376 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.939 0.321 5.609 1.00 0.00 H new ATOM 1740 N ILE A 109 -0.719 0.293 5.224 1.00 0.00 N ATOM 1741 CA ILE A 109 -2.174 0.261 5.038 1.00 0.00 C ATOM 1742 C ILE A 109 -2.587 -0.918 4.135 1.00 0.00 C ATOM 1743 O ILE A 109 -2.559 -0.811 2.906 1.00 0.00 O ATOM 1744 CB ILE A 109 -2.699 1.590 4.432 1.00 0.00 C ATOM 1745 CG1 ILE A 109 -2.297 2.780 5.324 1.00 0.00 C ATOM 1746 CG2 ILE A 109 -4.219 1.539 4.255 1.00 0.00 C ATOM 1747 CD1 ILE A 109 -2.770 4.123 4.808 1.00 0.00 C ATOM 0 H ILE A 109 -0.193 0.531 4.383 1.00 0.00 H new ATOM 0 HA ILE A 109 -2.621 0.130 6.023 1.00 0.00 H new ATOM 0 HB ILE A 109 -2.246 1.725 3.450 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -2.701 2.624 6.324 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -1.211 2.800 5.418 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -4.567 2.480 3.829 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -4.480 0.719 3.586 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -4.693 1.382 5.224 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -2.448 4.909 5.491 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -2.345 4.303 3.820 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -3.858 4.124 4.741 1.00 0.00 H new ATOM 1759 N PRO A 110 -2.925 -2.076 4.736 1.00 0.00 N ATOM 1760 CA PRO A 110 -3.393 -3.259 3.988 1.00 0.00 C ATOM 1761 C PRO A 110 -4.720 -3.026 3.236 1.00 0.00 C ATOM 1762 O PRO A 110 -5.791 -2.969 3.844 1.00 0.00 O ATOM 1763 CB PRO A 110 -3.574 -4.331 5.082 1.00 0.00 C ATOM 1764 CG PRO A 110 -2.774 -3.843 6.243 1.00 0.00 C ATOM 1765 CD PRO A 110 -2.844 -2.343 6.182 1.00 0.00 C ATOM 0 HA PRO A 110 -2.685 -3.535 3.207 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -4.624 -4.448 5.349 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -3.221 -5.305 4.742 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.180 -4.216 7.183 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.742 -4.190 6.181 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.714 -1.957 6.713 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.965 -1.879 6.630 1.00 0.00 H new ATOM 1773 N ILE A 111 -4.636 -2.884 1.916 1.00 0.00 N ATOM 1774 CA ILE A 111 -5.822 -2.736 1.062 1.00 0.00 C ATOM 1775 C ILE A 111 -6.190 -4.071 0.393 1.00 0.00 C ATOM 1776 O ILE A 111 -5.449 -4.586 -0.445 1.00 0.00 O ATOM 1777 CB ILE A 111 -5.591 -1.655 -0.028 1.00 0.00 C ATOM 1778 CG1 ILE A 111 -5.379 -0.275 0.622 1.00 0.00 C ATOM 1779 CG2 ILE A 111 -6.755 -1.618 -1.019 1.00 0.00 C ATOM 1780 CD1 ILE A 111 -6.548 0.197 1.465 1.00 0.00 C ATOM 0 H ILE A 111 -3.753 -2.868 1.406 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.647 -2.422 1.702 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.690 -1.916 -0.583 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -4.486 -0.312 1.246 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.190 0.459 -0.161 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -6.568 -0.852 -1.772 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -6.850 -2.589 -1.505 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -7.678 -1.386 -0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -6.320 1.176 1.887 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -7.440 0.269 0.843 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -6.725 -0.514 2.272 1.00 0.00 H new ATOM 1792 N LYS A 112 -7.341 -4.623 0.765 1.00 0.00 N ATOM 1793 CA LYS A 112 -7.778 -5.934 0.259 1.00 0.00 C ATOM 1794 C LYS A 112 -8.802 -5.785 -0.884 1.00 0.00 C ATOM 1795 O LYS A 112 -10.001 -5.653 -0.642 1.00 0.00 O ATOM 1796 CB LYS A 112 -8.381 -6.751 1.413 1.00 0.00 C ATOM 1797 CG LYS A 112 -8.820 -8.163 1.029 1.00 0.00 C ATOM 1798 CD LYS A 112 -9.531 -8.871 2.183 1.00 0.00 C ATOM 1799 CE LYS A 112 -9.996 -10.271 1.792 1.00 0.00 C ATOM 1800 NZ LYS A 112 -10.759 -10.936 2.881 1.00 0.00 N ATOM 0 H LYS A 112 -7.994 -4.187 1.416 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.910 -6.455 -0.145 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -7.647 -6.818 2.216 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -9.241 -6.213 1.812 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -9.485 -8.115 0.167 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.949 -8.745 0.727 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.858 -8.938 3.038 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -10.390 -8.278 2.499 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.619 -10.209 0.900 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.130 -10.880 1.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.054 -11.884 2.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.157 -11.021 3.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.600 -10.370 3.111 1.00 0.00 H new ATOM 1814 N TYR A 113 -8.328 -5.798 -2.132 1.00 0.00 N ATOM 1815 CA TYR A 113 -9.219 -5.661 -3.300 1.00 0.00 C ATOM 1816 C TYR A 113 -10.048 -6.932 -3.550 1.00 0.00 C ATOM 1817 O TYR A 113 -11.172 -6.863 -4.046 1.00 0.00 O ATOM 1818 CB TYR A 113 -8.416 -5.345 -4.571 1.00 0.00 C ATOM 1819 CG TYR A 113 -7.765 -3.974 -4.595 1.00 0.00 C ATOM 1820 CD1 TYR A 113 -8.529 -2.811 -4.530 1.00 0.00 C ATOM 1821 CD2 TYR A 113 -6.386 -3.841 -4.709 1.00 0.00 C ATOM 1822 CE1 TYR A 113 -7.936 -1.563 -4.575 1.00 0.00 C ATOM 1823 CE2 TYR A 113 -5.789 -2.598 -4.759 1.00 0.00 C ATOM 1824 CZ TYR A 113 -6.567 -1.464 -4.690 1.00 0.00 C ATOM 1825 OH TYR A 113 -5.969 -0.229 -4.749 1.00 0.00 O ATOM 0 H TYR A 113 -7.340 -5.901 -2.365 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.896 -4.838 -3.071 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -7.640 -6.101 -4.690 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -9.079 -5.431 -5.432 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.603 -2.886 -4.443 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.770 -4.727 -4.759 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -8.542 -0.671 -4.520 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -4.716 -2.515 -4.852 1.00 0.00 H new ATOM 0 HH TYR A 113 -6.087 0.233 -3.893 1.00 0.00 H new ATOM 1835 N LYS A 114 -9.491 -8.087 -3.199 1.00 0.00 N ATOM 1836 CA LYS A 114 -10.092 -9.379 -3.555 1.00 0.00 C ATOM 1837 C LYS A 114 -10.298 -10.264 -2.318 1.00 0.00 C ATOM 1838 O LYS A 114 -9.817 -9.946 -1.234 1.00 0.00 O ATOM 1839 CB LYS A 114 -9.189 -10.081 -4.578 1.00 0.00 C ATOM 1840 CG LYS A 114 -7.801 -10.423 -4.034 1.00 0.00 C ATOM 1841 CD LYS A 114 -6.753 -10.512 -5.139 1.00 0.00 C ATOM 1842 CE LYS A 114 -7.114 -11.529 -6.212 1.00 0.00 C ATOM 1843 NZ LYS A 114 -6.088 -11.578 -7.287 1.00 0.00 N ATOM 0 H LYS A 114 -8.623 -8.160 -2.668 1.00 0.00 H new ATOM 0 HA LYS A 114 -11.076 -9.203 -3.990 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.676 -10.998 -4.912 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.080 -9.441 -5.454 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -7.500 -9.665 -3.311 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.846 -11.373 -3.501 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -6.633 -9.531 -5.600 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.791 -10.778 -4.701 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.215 -12.516 -5.760 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -8.082 -11.275 -6.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -6.540 -11.401 -8.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.366 -10.851 -7.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.640 -12.516 -7.297 1.00 0.00 H new ATOM 1857 N ALA A 115 -10.994 -11.386 -2.488 1.00 0.00 N ATOM 1858 CA ALA A 115 -11.346 -12.250 -1.353 1.00 0.00 C ATOM 1859 C ALA A 115 -10.160 -13.067 -0.838 1.00 0.00 C ATOM 1860 O ALA A 115 -10.204 -13.597 0.269 1.00 0.00 O ATOM 1861 CB ALA A 115 -12.510 -13.163 -1.719 1.00 0.00 C ATOM 0 H ALA A 115 -11.326 -11.721 -3.393 1.00 0.00 H new ATOM 0 HA ALA A 115 -11.649 -11.593 -0.538 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -12.758 -13.796 -0.867 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -13.377 -12.558 -1.986 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -12.229 -13.789 -2.566 1.00 0.00 H new ATOM 1867 N MET A 116 -9.102 -13.122 -1.634 1.00 0.00 N ATOM 1868 CA MET A 116 -7.878 -13.856 -1.303 1.00 0.00 C ATOM 1869 C MET A 116 -8.117 -15.339 -0.950 1.00 0.00 C ATOM 1870 O MET A 116 -7.788 -16.229 -1.737 1.00 0.00 O ATOM 1871 CB MET A 116 -7.151 -13.149 -0.164 1.00 0.00 C ATOM 1872 CG MET A 116 -6.808 -11.700 -0.473 1.00 0.00 C ATOM 1873 SD MET A 116 -5.849 -10.949 0.843 1.00 0.00 S ATOM 1874 CE MET A 116 -4.540 -12.159 0.949 1.00 0.00 C ATOM 0 H MET A 116 -9.064 -12.654 -2.540 1.00 0.00 H new ATOM 0 HA MET A 116 -7.262 -13.860 -2.202 1.00 0.00 H new ATOM 0 HB2 MET A 116 -7.772 -13.185 0.731 1.00 0.00 H new ATOM 0 HB3 MET A 116 -6.233 -13.691 0.063 1.00 0.00 H new ATOM 0 HG2 MET A 116 -6.247 -11.650 -1.406 1.00 0.00 H new ATOM 0 HG3 MET A 116 -7.727 -11.133 -0.623 1.00 0.00 H new ATOM 0 HE1 MET A 116 -3.640 -11.687 1.343 1.00 0.00 H new ATOM 0 HE2 MET A 116 -4.845 -12.968 1.612 1.00 0.00 H new ATOM 0 HE3 MET A 116 -4.335 -12.561 -0.043 1.00 0.00 H new ATOM 1884 N LYS A 117 -8.665 -15.589 0.245 1.00 0.00 N ATOM 1885 CA LYS A 117 -8.953 -16.951 0.728 1.00 0.00 C ATOM 1886 C LYS A 117 -7.663 -17.733 1.030 1.00 0.00 C ATOM 1887 O LYS A 117 -7.632 -18.964 0.945 1.00 0.00 O ATOM 1888 CB LYS A 117 -9.814 -17.712 -0.292 1.00 0.00 C ATOM 1889 CG LYS A 117 -11.159 -17.052 -0.579 1.00 0.00 C ATOM 1890 CD LYS A 117 -11.948 -17.817 -1.636 1.00 0.00 C ATOM 1891 CE LYS A 117 -13.314 -17.194 -1.887 1.00 0.00 C ATOM 1892 NZ LYS A 117 -14.154 -17.176 -0.659 1.00 0.00 N ATOM 0 H LYS A 117 -8.922 -14.856 0.906 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.509 -16.858 1.661 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.259 -17.803 -1.225 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.988 -18.723 0.076 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -11.741 -16.997 0.341 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.997 -16.028 -0.916 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.382 -17.838 -2.567 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.074 -18.852 -1.317 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -13.186 -16.175 -2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.828 -17.752 -2.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.140 -16.970 -0.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.105 -18.103 -0.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.805 -16.442 -0.010 1.00 0.00 H new ATOM 1906 N LYS A 118 -6.604 -17.014 1.404 1.00 0.00 N ATOM 1907 CA LYS A 118 -5.308 -17.636 1.716 1.00 0.00 C ATOM 1908 C LYS A 118 -4.668 -17.013 2.966 1.00 0.00 C ATOM 1909 O LYS A 118 -5.056 -15.925 3.401 1.00 0.00 O ATOM 1910 CB LYS A 118 -4.361 -17.524 0.516 1.00 0.00 C ATOM 1911 CG LYS A 118 -4.912 -18.195 -0.738 1.00 0.00 C ATOM 1912 CD LYS A 118 -3.856 -18.347 -1.819 1.00 0.00 C ATOM 1913 CE LYS A 118 -4.413 -19.059 -3.047 1.00 0.00 C ATOM 1914 NZ LYS A 118 -4.884 -20.436 -2.732 1.00 0.00 N ATOM 0 H LYS A 118 -6.614 -15.999 1.500 1.00 0.00 H new ATOM 0 HA LYS A 118 -5.487 -18.690 1.928 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -4.172 -16.471 0.306 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -3.402 -17.975 0.772 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -5.308 -19.177 -0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.745 -17.608 -1.126 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -3.482 -17.364 -2.105 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -3.008 -18.908 -1.425 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -5.239 -18.479 -3.458 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -3.643 -19.107 -3.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -5.047 -20.958 -3.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -4.163 -20.929 -2.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -5.772 -20.384 -2.192 1.00 0.00 H new ATOM 1928 N GLU A 119 -3.682 -17.710 3.534 1.00 0.00 N ATOM 1929 CA GLU A 119 -3.055 -17.289 4.796 1.00 0.00 C ATOM 1930 C GLU A 119 -2.125 -16.074 4.626 1.00 0.00 C ATOM 1931 O GLU A 119 -1.541 -15.859 3.563 1.00 0.00 O ATOM 1932 CB GLU A 119 -2.282 -18.457 5.422 1.00 0.00 C ATOM 1933 CG GLU A 119 -1.188 -19.040 4.535 1.00 0.00 C ATOM 1934 CD GLU A 119 -0.391 -20.124 5.243 1.00 0.00 C ATOM 1935 OE1 GLU A 119 -0.911 -21.251 5.391 1.00 0.00 O ATOM 1936 OE2 GLU A 119 0.747 -19.846 5.678 1.00 0.00 O ATOM 0 H GLU A 119 -3.298 -18.570 3.142 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.863 -16.983 5.460 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.833 -18.120 6.356 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.987 -19.249 5.675 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.637 -19.453 3.632 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.514 -18.243 4.221 1.00 0.00 H new ATOM 1943 N PHE A 120 -1.983 -15.298 5.703 1.00 0.00 N ATOM 1944 CA PHE A 120 -1.210 -14.049 5.685 1.00 0.00 C ATOM 1945 C PHE A 120 0.170 -14.205 6.351 1.00 0.00 C ATOM 1946 O PHE A 120 0.334 -14.998 7.280 1.00 0.00 O ATOM 1947 CB PHE A 120 -1.997 -12.949 6.410 1.00 0.00 C ATOM 1948 CG PHE A 120 -3.323 -12.628 5.774 1.00 0.00 C ATOM 1949 CD1 PHE A 120 -4.398 -13.499 5.894 1.00 0.00 C ATOM 1950 CD2 PHE A 120 -3.495 -11.455 5.058 1.00 0.00 C ATOM 1951 CE1 PHE A 120 -5.613 -13.205 5.312 1.00 0.00 C ATOM 1952 CE2 PHE A 120 -4.707 -11.157 4.476 1.00 0.00 C ATOM 1953 CZ PHE A 120 -5.769 -12.032 4.601 1.00 0.00 C ATOM 0 H PHE A 120 -2.398 -15.514 6.609 1.00 0.00 H new ATOM 0 HA PHE A 120 -1.047 -13.782 4.641 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.165 -13.256 7.442 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.391 -12.043 6.442 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -4.281 -14.418 6.450 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.669 -10.766 4.955 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -6.441 -13.891 5.412 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -4.828 -10.238 3.921 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.719 -11.799 4.143 1.00 0.00 H new ATOM 1963 N PRO A 121 1.178 -13.436 5.885 1.00 0.00 N ATOM 1964 CA PRO A 121 2.510 -13.412 6.508 1.00 0.00 C ATOM 1965 C PRO A 121 2.539 -12.553 7.787 1.00 0.00 C ATOM 1966 O PRO A 121 1.954 -11.467 7.832 1.00 0.00 O ATOM 1967 CB PRO A 121 3.386 -12.797 5.413 1.00 0.00 C ATOM 1968 CG PRO A 121 2.466 -11.885 4.672 1.00 0.00 C ATOM 1969 CD PRO A 121 1.107 -12.544 4.709 1.00 0.00 C ATOM 0 HA PRO A 121 2.840 -14.399 6.831 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.229 -12.252 5.838 1.00 0.00 H new ATOM 0 HB3 PRO A 121 3.799 -13.563 4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.435 -10.900 5.138 1.00 0.00 H new ATOM 0 HG3 PRO A 121 2.802 -11.742 3.645 1.00 0.00 H new ATOM 0 HD2 PRO A 121 0.309 -11.809 4.812 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.909 -13.103 3.795 1.00 0.00 H new ATOM 1977 N SER A 122 3.246 -13.033 8.809 1.00 0.00 N ATOM 1978 CA SER A 122 3.282 -12.389 10.138 1.00 0.00 C ATOM 1979 C SER A 122 3.677 -10.905 10.080 1.00 0.00 C ATOM 1980 O SER A 122 3.387 -10.147 11.007 1.00 0.00 O ATOM 1981 CB SER A 122 4.259 -13.141 11.051 1.00 0.00 C ATOM 1982 OG SER A 122 4.156 -12.692 12.395 1.00 0.00 O ATOM 0 H SER A 122 3.813 -13.879 8.748 1.00 0.00 H new ATOM 0 HA SER A 122 2.269 -12.435 10.537 1.00 0.00 H new ATOM 0 HB2 SER A 122 4.053 -14.210 11.005 1.00 0.00 H new ATOM 0 HB3 SER A 122 5.279 -12.997 10.694 1.00 0.00 H new ATOM 0 HG SER A 122 4.679 -13.281 12.978 1.00 0.00 H new ATOM 1988 N ILE A 123 4.332 -10.490 8.997 1.00 0.00 N ATOM 1989 CA ILE A 123 4.765 -9.096 8.838 1.00 0.00 C ATOM 1990 C ILE A 123 3.573 -8.114 8.885 1.00 0.00 C ATOM 1991 O ILE A 123 3.686 -7.007 9.415 1.00 0.00 O ATOM 1992 CB ILE A 123 5.560 -8.898 7.516 1.00 0.00 C ATOM 1993 CG1 ILE A 123 6.184 -7.493 7.458 1.00 0.00 C ATOM 1994 CG2 ILE A 123 4.671 -9.145 6.296 1.00 0.00 C ATOM 1995 CD1 ILE A 123 7.189 -7.227 8.562 1.00 0.00 C ATOM 0 H ILE A 123 4.576 -11.097 8.214 1.00 0.00 H new ATOM 0 HA ILE A 123 5.422 -8.875 9.679 1.00 0.00 H new ATOM 0 HB ILE A 123 6.366 -9.631 7.499 1.00 0.00 H new ATOM 0 HG12 ILE A 123 6.674 -7.362 6.493 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.389 -6.749 7.515 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.253 -8.999 5.386 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.290 -10.166 6.324 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.835 -8.446 6.307 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.587 -6.218 8.457 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.699 -7.325 9.531 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.004 -7.947 8.493 1.00 0.00 H new ATOM 2007 N LEU A 124 2.430 -8.539 8.341 1.00 0.00 N ATOM 2008 CA LEU A 124 1.205 -7.724 8.348 1.00 0.00 C ATOM 2009 C LEU A 124 0.011 -8.512 8.920 1.00 0.00 C ATOM 2010 O LEU A 124 -0.857 -7.944 9.581 1.00 0.00 O ATOM 2011 CB LEU A 124 0.907 -7.196 6.926 1.00 0.00 C ATOM 2012 CG LEU A 124 0.827 -8.252 5.796 1.00 0.00 C ATOM 2013 CD1 LEU A 124 -0.551 -8.913 5.733 1.00 0.00 C ATOM 2014 CD2 LEU A 124 1.184 -7.627 4.447 1.00 0.00 C ATOM 0 H LEU A 124 2.324 -9.446 7.887 1.00 0.00 H new ATOM 0 HA LEU A 124 1.365 -6.867 9.003 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -0.039 -6.656 6.955 1.00 0.00 H new ATOM 0 HB3 LEU A 124 1.679 -6.473 6.662 1.00 0.00 H new ATOM 0 HG LEU A 124 1.555 -9.030 6.025 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.566 -9.647 4.928 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.760 -9.410 6.681 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -1.310 -8.154 5.546 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.122 -8.386 3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.487 -6.819 4.224 1.00 0.00 H new ATOM 0 HD23 LEU A 124 2.198 -7.230 4.487 1.00 0.00 H new ATOM 2026 N ARG A 125 -0.013 -9.821 8.641 1.00 0.00 N ATOM 2027 CA ARG A 125 -1.016 -10.775 9.165 1.00 0.00 C ATOM 2028 C ARG A 125 -2.428 -10.180 9.376 1.00 0.00 C ATOM 2029 O ARG A 125 -3.077 -10.456 10.388 1.00 0.00 O ATOM 2030 CB ARG A 125 -0.507 -11.443 10.458 1.00 0.00 C ATOM 2031 CG ARG A 125 -0.025 -10.471 11.533 1.00 0.00 C ATOM 2032 CD ARG A 125 0.235 -11.167 12.868 1.00 0.00 C ATOM 2033 NE ARG A 125 1.261 -12.206 12.787 1.00 0.00 N ATOM 2034 CZ ARG A 125 1.039 -13.481 12.970 1.00 0.00 C ATOM 2035 NH1 ARG A 125 -0.163 -13.932 13.152 1.00 0.00 N ATOM 2036 NH2 ARG A 125 2.031 -14.309 12.968 1.00 0.00 N ATOM 0 H ARG A 125 0.676 -10.263 8.032 1.00 0.00 H new ATOM 0 HA ARG A 125 -1.135 -11.525 8.383 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -1.307 -12.055 10.874 1.00 0.00 H new ATOM 0 HB3 ARG A 125 0.311 -12.117 10.204 1.00 0.00 H new ATOM 0 HG2 ARG A 125 0.890 -9.984 11.195 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -0.770 -9.688 11.673 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.538 -10.423 13.605 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -0.694 -11.610 13.226 1.00 0.00 H new ATOM 0 HE ARG A 125 2.215 -11.916 12.573 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -0.954 -13.288 13.154 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -0.317 -14.930 13.293 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.981 -13.966 12.824 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.864 -15.305 13.110 1.00 0.00 H new ATOM 2050 N PHE A 126 -2.910 -9.398 8.402 1.00 0.00 N ATOM 2051 CA PHE A 126 -4.301 -8.910 8.403 1.00 0.00 C ATOM 2052 C PHE A 126 -4.630 -8.050 9.651 1.00 0.00 C ATOM 2053 O PHE A 126 -5.765 -8.053 10.132 1.00 0.00 O ATOM 2054 CB PHE A 126 -5.243 -10.131 8.316 1.00 0.00 C ATOM 2055 CG PHE A 126 -6.611 -9.855 7.736 1.00 0.00 C ATOM 2056 CD1 PHE A 126 -6.746 -9.447 6.417 1.00 0.00 C ATOM 2057 CD2 PHE A 126 -7.759 -10.034 8.495 1.00 0.00 C ATOM 2058 CE1 PHE A 126 -7.992 -9.220 5.868 1.00 0.00 C ATOM 2059 CE2 PHE A 126 -9.010 -9.811 7.949 1.00 0.00 C ATOM 2060 CZ PHE A 126 -9.127 -9.404 6.634 1.00 0.00 C ATOM 0 H PHE A 126 -2.359 -9.088 7.601 1.00 0.00 H new ATOM 0 HA PHE A 126 -4.441 -8.257 7.542 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -4.759 -10.899 7.712 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -5.368 -10.544 9.317 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -5.863 -9.305 5.811 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -7.675 -10.351 9.524 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -8.080 -8.899 4.841 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -9.895 -9.955 8.551 1.00 0.00 H new ATOM 0 HZ PHE A 126 -10.103 -9.230 6.206 1.00 0.00 H new ATOM 2070 N ILE A 127 -3.642 -7.298 10.161 1.00 0.00 N ATOM 2071 CA ILE A 127 -3.847 -6.457 11.358 1.00 0.00 C ATOM 2072 C ILE A 127 -4.955 -5.397 11.161 1.00 0.00 C ATOM 2073 O ILE A 127 -6.051 -5.531 11.708 1.00 0.00 O ATOM 2074 CB ILE A 127 -2.528 -5.768 11.838 1.00 0.00 C ATOM 2075 CG1 ILE A 127 -2.839 -4.755 12.961 1.00 0.00 C ATOM 2076 CG2 ILE A 127 -1.786 -5.103 10.676 1.00 0.00 C ATOM 2077 CD1 ILE A 127 -1.633 -4.103 13.593 1.00 0.00 C ATOM 0 H ILE A 127 -2.701 -7.253 9.770 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.175 -7.145 12.137 1.00 0.00 H new ATOM 0 HB ILE A 127 -1.866 -6.536 12.238 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -3.483 -3.975 12.556 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -3.407 -5.264 13.740 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.874 -4.634 11.047 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -1.530 -5.855 9.930 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -2.425 -4.345 10.222 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -1.959 -3.410 14.369 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -0.995 -4.869 14.035 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -1.073 -3.559 12.832 1.00 0.00 H new ATOM 2089 N THR A 128 -4.676 -4.350 10.386 1.00 0.00 N ATOM 2090 CA THR A 128 -5.649 -3.274 10.153 1.00 0.00 C ATOM 2091 C THR A 128 -5.924 -3.117 8.658 1.00 0.00 C ATOM 2092 O THR A 128 -5.281 -2.327 7.970 1.00 0.00 O ATOM 2093 CB THR A 128 -5.162 -1.923 10.743 1.00 0.00 C ATOM 2094 OG1 THR A 128 -4.874 -2.079 12.143 1.00 0.00 O ATOM 2095 CG2 THR A 128 -6.211 -0.827 10.565 1.00 0.00 C ATOM 0 H THR A 128 -3.785 -4.220 9.907 1.00 0.00 H new ATOM 0 HA THR A 128 -6.571 -3.553 10.663 1.00 0.00 H new ATOM 0 HB THR A 128 -4.261 -1.629 10.205 1.00 0.00 H new ATOM 0 HG1 THR A 128 -4.565 -1.225 12.511 1.00 0.00 H new ATOM 0 HG21 THR A 128 -5.838 0.106 10.989 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.415 -0.687 9.503 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.130 -1.116 11.076 1.00 0.00 H new ATOM 2103 N VAL A 129 -6.871 -3.897 8.158 1.00 0.00 N ATOM 2104 CA VAL A 129 -7.138 -3.973 6.722 1.00 0.00 C ATOM 2105 C VAL A 129 -8.369 -3.149 6.312 1.00 0.00 C ATOM 2106 O VAL A 129 -9.292 -2.944 7.100 1.00 0.00 O ATOM 2107 CB VAL A 129 -7.353 -5.448 6.298 1.00 0.00 C ATOM 2108 CG1 VAL A 129 -8.577 -6.030 6.999 1.00 0.00 C ATOM 2109 CG2 VAL A 129 -7.474 -5.584 4.778 1.00 0.00 C ATOM 0 H VAL A 129 -7.473 -4.492 8.727 1.00 0.00 H new ATOM 0 HA VAL A 129 -6.268 -3.555 6.215 1.00 0.00 H new ATOM 0 HB VAL A 129 -6.476 -6.017 6.605 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -8.714 -7.066 6.691 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -8.432 -5.989 8.079 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -9.460 -5.451 6.729 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -7.624 -6.632 4.517 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -8.323 -4.998 4.427 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -6.561 -5.220 4.306 1.00 0.00 H new ATOM 2119 N CYS A 130 -8.361 -2.674 5.073 1.00 0.00 N ATOM 2120 CA CYS A 130 -9.525 -2.018 4.475 1.00 0.00 C ATOM 2121 C CYS A 130 -9.825 -2.655 3.113 1.00 0.00 C ATOM 2122 O CYS A 130 -9.040 -2.528 2.172 1.00 0.00 O ATOM 2123 CB CYS A 130 -9.274 -0.513 4.318 1.00 0.00 C ATOM 2124 SG CYS A 130 -10.748 0.440 3.888 1.00 0.00 S ATOM 0 H CYS A 130 -7.553 -2.730 4.453 1.00 0.00 H new ATOM 0 HA CYS A 130 -10.385 -2.151 5.131 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -8.863 -0.125 5.250 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -8.518 -0.360 3.548 1.00 0.00 H new ATOM 0 HG CYS A 130 -10.750 0.684 2.611 1.00 0.00 H new ATOM 2130 N ASP A 131 -10.941 -3.372 3.016 1.00 0.00 N ATOM 2131 CA ASP A 131 -11.258 -4.129 1.801 1.00 0.00 C ATOM 2132 C ASP A 131 -12.086 -3.314 0.793 1.00 0.00 C ATOM 2133 O ASP A 131 -12.801 -2.382 1.154 1.00 0.00 O ATOM 2134 CB ASP A 131 -11.970 -5.441 2.160 1.00 0.00 C ATOM 2135 CG ASP A 131 -13.261 -5.228 2.927 1.00 0.00 C ATOM 2136 OD1 ASP A 131 -13.204 -4.728 4.071 1.00 0.00 O ATOM 2137 OD2 ASP A 131 -14.336 -5.587 2.405 1.00 0.00 O ATOM 0 H ASP A 131 -11.639 -3.447 3.756 1.00 0.00 H new ATOM 0 HA ASP A 131 -10.312 -4.360 1.311 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -12.185 -5.993 1.245 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -11.299 -6.060 2.755 1.00 0.00 H new ATOM 2142 N TYR A 132 -11.959 -3.686 -0.475 1.00 0.00 N ATOM 2143 CA TYR A 132 -12.644 -3.016 -1.590 1.00 0.00 C ATOM 2144 C TYR A 132 -13.681 -3.953 -2.242 1.00 0.00 C ATOM 2145 O TYR A 132 -14.517 -3.524 -3.041 1.00 0.00 O ATOM 2146 CB TYR A 132 -11.576 -2.575 -2.611 1.00 0.00 C ATOM 2147 CG TYR A 132 -12.097 -2.155 -3.979 1.00 0.00 C ATOM 2148 CD1 TYR A 132 -12.490 -0.845 -4.230 1.00 0.00 C ATOM 2149 CD2 TYR A 132 -12.168 -3.071 -5.027 1.00 0.00 C ATOM 2150 CE1 TYR A 132 -12.943 -0.464 -5.480 1.00 0.00 C ATOM 2151 CE2 TYR A 132 -12.622 -2.697 -6.276 1.00 0.00 C ATOM 2152 CZ TYR A 132 -13.007 -1.393 -6.498 1.00 0.00 C ATOM 2153 OH TYR A 132 -13.456 -1.016 -7.746 1.00 0.00 O ATOM 0 H TYR A 132 -11.373 -4.468 -0.768 1.00 0.00 H new ATOM 0 HA TYR A 132 -13.189 -2.145 -1.224 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -11.016 -1.742 -2.185 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -10.872 -3.395 -2.748 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -12.441 -0.114 -3.437 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -11.862 -4.093 -4.859 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -13.246 0.557 -5.659 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -12.675 -3.422 -7.074 1.00 0.00 H new ATOM 0 HH TYR A 132 -12.962 -0.225 -8.046 1.00 0.00 H new ATOM 2163 N THR A 133 -13.635 -5.228 -1.868 1.00 0.00 N ATOM 2164 CA THR A 133 -14.460 -6.271 -2.502 1.00 0.00 C ATOM 2165 C THR A 133 -15.962 -6.153 -2.175 1.00 0.00 C ATOM 2166 O THR A 133 -16.799 -6.732 -2.873 1.00 0.00 O ATOM 2167 CB THR A 133 -13.961 -7.689 -2.116 1.00 0.00 C ATOM 2168 OG1 THR A 133 -14.874 -8.694 -2.590 1.00 0.00 O ATOM 2169 CG2 THR A 133 -13.785 -7.825 -0.605 1.00 0.00 C ATOM 0 H THR A 133 -13.031 -5.574 -1.122 1.00 0.00 H new ATOM 0 HA THR A 133 -14.348 -6.115 -3.575 1.00 0.00 H new ATOM 0 HB THR A 133 -12.990 -7.834 -2.590 1.00 0.00 H new ATOM 0 HG1 THR A 133 -14.543 -9.581 -2.339 1.00 0.00 H new ATOM 0 HG21 THR A 133 -13.435 -8.830 -0.368 1.00 0.00 H new ATOM 0 HG22 THR A 133 -13.055 -7.095 -0.257 1.00 0.00 H new ATOM 0 HG23 THR A 133 -14.740 -7.648 -0.110 1.00 0.00 H new ATOM 2177 N ASN A 134 -16.313 -5.410 -1.123 1.00 0.00 N ATOM 2178 CA ASN A 134 -17.727 -5.232 -0.744 1.00 0.00 C ATOM 2179 C ASN A 134 -18.231 -3.808 -1.052 1.00 0.00 C ATOM 2180 O ASN A 134 -17.531 -2.824 -0.807 1.00 0.00 O ATOM 2181 CB ASN A 134 -17.927 -5.532 0.744 1.00 0.00 C ATOM 2182 CG ASN A 134 -17.540 -6.950 1.115 1.00 0.00 C ATOM 2183 OD1 ASN A 134 -17.628 -7.872 0.309 1.00 0.00 O ATOM 2184 ND2 ASN A 134 -17.120 -7.136 2.344 1.00 0.00 N ATOM 0 H ASN A 134 -15.649 -4.924 -0.520 1.00 0.00 H new ATOM 0 HA ASN A 134 -18.308 -5.935 -1.341 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -17.334 -4.833 1.334 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -18.972 -5.365 1.006 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -16.854 -8.070 2.656 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -17.059 -6.347 2.987 1.00 0.00 H new ATOM 2191 N PRO A 135 -19.466 -3.681 -1.584 1.00 0.00 N ATOM 2192 CA PRO A 135 -20.074 -2.371 -1.904 1.00 0.00 C ATOM 2193 C PRO A 135 -20.073 -1.374 -0.727 1.00 0.00 C ATOM 2194 O PRO A 135 -19.731 -0.200 -0.900 1.00 0.00 O ATOM 2195 CB PRO A 135 -21.515 -2.738 -2.289 1.00 0.00 C ATOM 2196 CG PRO A 135 -21.427 -4.143 -2.779 1.00 0.00 C ATOM 2197 CD PRO A 135 -20.359 -4.802 -1.946 1.00 0.00 C ATOM 0 HA PRO A 135 -19.510 -1.859 -2.684 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -22.186 -2.658 -1.434 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -21.901 -2.072 -3.061 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -22.382 -4.656 -2.668 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -21.171 -4.172 -3.838 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -20.778 -5.283 -1.062 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -19.830 -5.572 -2.507 1.00 0.00 H new ATOM 2205 N CYS A 136 -20.443 -1.839 0.471 1.00 0.00 N ATOM 2206 CA CYS A 136 -20.563 -0.948 1.641 1.00 0.00 C ATOM 2207 C CYS A 136 -19.215 -0.319 2.022 1.00 0.00 C ATOM 2208 O CYS A 136 -19.132 0.883 2.275 1.00 0.00 O ATOM 2209 CB CYS A 136 -21.153 -1.698 2.843 1.00 0.00 C ATOM 2210 SG CYS A 136 -22.864 -2.238 2.610 1.00 0.00 S ATOM 0 H CYS A 136 -20.664 -2.817 0.660 1.00 0.00 H new ATOM 0 HA CYS A 136 -21.241 -0.142 1.360 1.00 0.00 H new ATOM 0 HB2 CYS A 136 -20.534 -2.570 3.053 1.00 0.00 H new ATOM 0 HB3 CYS A 136 -21.103 -1.053 3.720 1.00 0.00 H new ATOM 0 HG CYS A 136 -23.271 -2.862 3.675 1.00 0.00 H new ATOM 2216 N THR A 137 -18.160 -1.128 2.061 1.00 0.00 N ATOM 2217 CA THR A 137 -16.810 -0.625 2.373 1.00 0.00 C ATOM 2218 C THR A 137 -16.215 0.173 1.205 1.00 0.00 C ATOM 2219 O THR A 137 -15.371 1.046 1.406 1.00 0.00 O ATOM 2220 CB THR A 137 -15.837 -1.770 2.738 1.00 0.00 C ATOM 2221 OG1 THR A 137 -14.542 -1.238 3.072 1.00 0.00 O ATOM 2222 CG2 THR A 137 -15.703 -2.759 1.589 1.00 0.00 C ATOM 0 H THR A 137 -18.205 -2.131 1.883 1.00 0.00 H new ATOM 0 HA THR A 137 -16.928 0.032 3.235 1.00 0.00 H new ATOM 0 HB THR A 137 -16.245 -2.294 3.602 1.00 0.00 H new ATOM 0 HG1 THR A 137 -13.873 -1.590 2.448 1.00 0.00 H new ATOM 0 HG21 THR A 137 -15.013 -3.554 1.872 1.00 0.00 H new ATOM 0 HG22 THR A 137 -16.679 -3.189 1.363 1.00 0.00 H new ATOM 0 HG23 THR A 137 -15.321 -2.244 0.708 1.00 0.00 H new ATOM 2230 N LYS A 138 -16.662 -0.126 -0.016 1.00 0.00 N ATOM 2231 CA LYS A 138 -16.180 0.580 -1.209 1.00 0.00 C ATOM 2232 C LYS A 138 -16.749 2.002 -1.259 1.00 0.00 C ATOM 2233 O LYS A 138 -16.159 2.911 -1.848 1.00 0.00 O ATOM 2234 CB LYS A 138 -16.552 -0.200 -2.478 1.00 0.00 C ATOM 2235 CG LYS A 138 -16.125 0.487 -3.774 1.00 0.00 C ATOM 2236 CD LYS A 138 -16.251 -0.439 -4.982 1.00 0.00 C ATOM 2237 CE LYS A 138 -17.679 -0.915 -5.204 1.00 0.00 C ATOM 2238 NZ LYS A 138 -17.753 -1.907 -6.306 1.00 0.00 N ATOM 0 H LYS A 138 -17.355 -0.850 -0.207 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.094 0.651 -1.156 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -16.093 -1.188 -2.433 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -17.631 -0.351 -2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.738 1.375 -3.932 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.093 0.824 -3.682 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -15.902 0.082 -5.873 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -15.601 -1.303 -4.843 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -18.063 -1.359 -4.286 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -18.317 -0.062 -5.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.739 -2.212 -6.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.409 -1.474 -7.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.163 -2.731 -6.072 1.00 0.00 H new ATOM 2252 N SER A 139 -17.894 2.186 -0.618 1.00 0.00 N ATOM 2253 CA SER A 139 -18.515 3.504 -0.502 1.00 0.00 C ATOM 2254 C SER A 139 -17.637 4.451 0.332 1.00 0.00 C ATOM 2255 O SER A 139 -17.419 4.219 1.525 1.00 0.00 O ATOM 2256 CB SER A 139 -19.902 3.368 0.134 1.00 0.00 C ATOM 2257 OG SER A 139 -20.741 2.524 -0.646 1.00 0.00 O ATOM 0 H SER A 139 -18.417 1.436 -0.166 1.00 0.00 H new ATOM 0 HA SER A 139 -18.618 3.930 -1.500 1.00 0.00 H new ATOM 0 HB2 SER A 139 -19.806 2.961 1.141 1.00 0.00 H new ATOM 0 HB3 SER A 139 -20.360 4.353 0.231 1.00 0.00 H new ATOM 0 HG SER A 139 -20.373 1.616 -0.655 1.00 0.00 H new ATOM 2263 N TRP A 140 -17.124 5.505 -0.315 1.00 0.00 N ATOM 2264 CA TRP A 140 -16.220 6.476 0.330 1.00 0.00 C ATOM 2265 C TRP A 140 -14.866 5.839 0.688 1.00 0.00 C ATOM 2266 O TRP A 140 -14.086 6.392 1.468 1.00 0.00 O ATOM 2267 CB TRP A 140 -16.881 7.097 1.573 1.00 0.00 C ATOM 2268 CG TRP A 140 -18.142 7.846 1.253 1.00 0.00 C ATOM 2269 CD1 TRP A 140 -19.411 7.340 1.207 1.00 0.00 C ATOM 2270 CD2 TRP A 140 -18.252 9.234 0.919 1.00 0.00 C ATOM 2271 NE1 TRP A 140 -20.300 8.329 0.866 1.00 0.00 N ATOM 2272 CE2 TRP A 140 -19.614 9.501 0.682 1.00 0.00 C ATOM 2273 CE3 TRP A 140 -17.329 10.277 0.795 1.00 0.00 C ATOM 2274 CZ2 TRP A 140 -20.074 10.767 0.331 1.00 0.00 C ATOM 2275 CZ3 TRP A 140 -17.787 11.533 0.446 1.00 0.00 C ATOM 2276 CH2 TRP A 140 -19.149 11.768 0.218 1.00 0.00 C ATOM 0 H TRP A 140 -17.320 5.711 -1.294 1.00 0.00 H new ATOM 0 HA TRP A 140 -16.027 7.272 -0.389 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -17.106 6.308 2.291 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -16.175 7.774 2.054 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -19.676 6.313 1.409 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -21.308 8.211 0.766 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -16.277 10.104 0.969 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -21.123 10.952 0.154 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -17.084 12.347 0.347 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -19.476 12.761 -0.053 1.00 0.00 H new ATOM 2287 N PHE A 141 -14.585 4.686 0.078 1.00 0.00 N ATOM 2288 CA PHE A 141 -13.328 3.956 0.291 1.00 0.00 C ATOM 2289 C PHE A 141 -12.110 4.824 -0.059 1.00 0.00 C ATOM 2290 O PHE A 141 -11.167 4.948 0.727 1.00 0.00 O ATOM 2291 CB PHE A 141 -13.337 2.685 -0.570 1.00 0.00 C ATOM 2292 CG PHE A 141 -12.145 1.778 -0.383 1.00 0.00 C ATOM 2293 CD1 PHE A 141 -12.044 0.970 0.738 1.00 0.00 C ATOM 2294 CD2 PHE A 141 -11.139 1.721 -1.336 1.00 0.00 C ATOM 2295 CE1 PHE A 141 -10.963 0.126 0.903 1.00 0.00 C ATOM 2296 CE2 PHE A 141 -10.056 0.879 -1.172 1.00 0.00 C ATOM 2297 CZ PHE A 141 -9.970 0.082 -0.051 1.00 0.00 C ATOM 0 H PHE A 141 -15.220 4.230 -0.577 1.00 0.00 H new ATOM 0 HA PHE A 141 -13.251 3.692 1.346 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -14.242 2.120 -0.348 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -13.392 2.976 -1.619 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -12.818 1.000 1.490 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.203 2.342 -2.217 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.896 -0.500 1.781 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.278 0.845 -1.921 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.124 -0.577 0.080 1.00 0.00 H new ATOM 2307 N TRP A 142 -12.150 5.430 -1.243 1.00 0.00 N ATOM 2308 CA TRP A 142 -11.057 6.279 -1.726 1.00 0.00 C ATOM 2309 C TRP A 142 -10.858 7.510 -0.831 1.00 0.00 C ATOM 2310 O TRP A 142 -9.731 7.871 -0.500 1.00 0.00 O ATOM 2311 CB TRP A 142 -11.332 6.719 -3.168 1.00 0.00 C ATOM 2312 CG TRP A 142 -11.653 5.578 -4.085 1.00 0.00 C ATOM 2313 CD1 TRP A 142 -12.737 5.471 -4.909 1.00 0.00 C ATOM 2314 CD2 TRP A 142 -10.894 4.374 -4.261 1.00 0.00 C ATOM 2315 NE1 TRP A 142 -12.692 4.284 -5.589 1.00 0.00 N ATOM 2316 CE2 TRP A 142 -11.573 3.593 -5.210 1.00 0.00 C ATOM 2317 CE3 TRP A 142 -9.706 3.881 -3.712 1.00 0.00 C ATOM 2318 CZ2 TRP A 142 -11.108 2.352 -5.625 1.00 0.00 C ATOM 2319 CZ3 TRP A 142 -9.245 2.645 -4.124 1.00 0.00 C ATOM 2320 CH2 TRP A 142 -9.944 1.893 -5.074 1.00 0.00 C ATOM 0 H TRP A 142 -12.933 5.350 -1.892 1.00 0.00 H new ATOM 0 HA TRP A 142 -10.140 5.691 -1.693 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -12.163 7.425 -3.173 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -10.460 7.250 -3.551 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -13.515 6.213 -5.009 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -13.382 3.965 -6.269 1.00 0.00 H new ATOM 0 HE3 TRP A 142 -9.159 4.456 -2.979 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -11.647 1.770 -6.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 -8.330 2.253 -3.705 1.00 0.00 H new ATOM 0 HH2 TRP A 142 -9.557 0.932 -5.378 1.00 0.00 H new ATOM 2331 N THR A 143 -11.960 8.145 -0.436 1.00 0.00 N ATOM 2332 CA THR A 143 -11.909 9.317 0.450 1.00 0.00 C ATOM 2333 C THR A 143 -11.169 8.998 1.757 1.00 0.00 C ATOM 2334 O THR A 143 -10.252 9.717 2.165 1.00 0.00 O ATOM 2335 CB THR A 143 -13.332 9.822 0.793 1.00 0.00 C ATOM 2336 OG1 THR A 143 -14.037 10.167 -0.409 1.00 0.00 O ATOM 2337 CG2 THR A 143 -13.285 11.032 1.722 1.00 0.00 C ATOM 0 H THR A 143 -12.902 7.871 -0.713 1.00 0.00 H new ATOM 0 HA THR A 143 -11.368 10.095 -0.089 1.00 0.00 H new ATOM 0 HB THR A 143 -13.855 9.015 1.307 1.00 0.00 H new ATOM 0 HG1 THR A 143 -14.782 10.765 -0.191 1.00 0.00 H new ATOM 0 HG21 THR A 143 -14.300 11.361 1.943 1.00 0.00 H new ATOM 0 HG22 THR A 143 -12.782 10.759 2.650 1.00 0.00 H new ATOM 0 HG23 THR A 143 -12.739 11.841 1.238 1.00 0.00 H new ATOM 2345 N ARG A 144 -11.568 7.904 2.399 1.00 0.00 N ATOM 2346 CA ARG A 144 -10.954 7.469 3.659 1.00 0.00 C ATOM 2347 C ARG A 144 -9.475 7.087 3.463 1.00 0.00 C ATOM 2348 O ARG A 144 -8.614 7.488 4.251 1.00 0.00 O ATOM 2349 CB ARG A 144 -11.745 6.289 4.240 1.00 0.00 C ATOM 2350 CG ARG A 144 -13.188 6.645 4.599 1.00 0.00 C ATOM 2351 CD ARG A 144 -14.002 5.416 4.992 1.00 0.00 C ATOM 2352 NE ARG A 144 -13.404 4.681 6.104 1.00 0.00 N ATOM 2353 CZ ARG A 144 -13.922 3.609 6.636 1.00 0.00 C ATOM 2354 NH1 ARG A 144 -15.054 3.137 6.212 1.00 0.00 N ATOM 2355 NH2 ARG A 144 -13.303 3.007 7.598 1.00 0.00 N ATOM 0 H ARG A 144 -12.318 7.296 2.069 1.00 0.00 H new ATOM 0 HA ARG A 144 -10.985 8.302 4.361 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -11.749 5.473 3.518 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -11.236 5.923 5.132 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -13.191 7.359 5.422 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -13.662 7.136 3.749 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -15.011 5.725 5.266 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -14.094 4.754 4.131 1.00 0.00 H new ATOM 0 HE ARG A 144 -12.526 5.028 6.489 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -15.550 3.605 5.454 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -15.448 2.298 6.637 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -12.413 3.371 7.938 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -13.705 2.168 8.017 1.00 0.00 H new ATOM 2369 N LEU A 145 -9.188 6.323 2.408 1.00 0.00 N ATOM 2370 CA LEU A 145 -7.810 5.933 2.077 1.00 0.00 C ATOM 2371 C LEU A 145 -6.919 7.166 1.831 1.00 0.00 C ATOM 2372 O LEU A 145 -5.835 7.290 2.406 1.00 0.00 O ATOM 2373 CB LEU A 145 -7.804 5.023 0.838 1.00 0.00 C ATOM 2374 CG LEU A 145 -6.412 4.602 0.324 1.00 0.00 C ATOM 2375 CD1 LEU A 145 -5.629 3.863 1.406 1.00 0.00 C ATOM 2376 CD2 LEU A 145 -6.540 3.744 -0.933 1.00 0.00 C ATOM 0 H LEU A 145 -9.891 5.960 1.765 1.00 0.00 H new ATOM 0 HA LEU A 145 -7.401 5.389 2.928 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -8.373 4.123 1.069 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -8.329 5.535 0.032 1.00 0.00 H new ATOM 0 HG LEU A 145 -5.859 5.506 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -4.652 3.578 1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -5.500 4.514 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -6.176 2.969 1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -5.547 3.457 -1.280 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -7.118 2.848 -0.705 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -7.046 4.314 -1.712 1.00 0.00 H new ATOM 2388 N ALA A 146 -7.394 8.077 0.984 1.00 0.00 N ATOM 2389 CA ALA A 146 -6.661 9.306 0.668 1.00 0.00 C ATOM 2390 C ALA A 146 -6.366 10.130 1.929 1.00 0.00 C ATOM 2391 O ALA A 146 -5.272 10.682 2.086 1.00 0.00 O ATOM 2392 CB ALA A 146 -7.444 10.140 -0.338 1.00 0.00 C ATOM 0 H ALA A 146 -8.288 7.988 0.501 1.00 0.00 H new ATOM 0 HA ALA A 146 -5.705 9.020 0.230 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -6.890 11.051 -0.565 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -7.589 9.565 -1.253 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -8.415 10.402 0.083 1.00 0.00 H new ATOM 2398 N LYS A 147 -7.343 10.211 2.830 1.00 0.00 N ATOM 2399 CA LYS A 147 -7.155 10.921 4.095 1.00 0.00 C ATOM 2400 C LYS A 147 -6.178 10.162 5.009 1.00 0.00 C ATOM 2401 O LYS A 147 -5.363 10.772 5.700 1.00 0.00 O ATOM 2402 CB LYS A 147 -8.499 11.133 4.806 1.00 0.00 C ATOM 2403 CG LYS A 147 -8.401 12.029 6.039 1.00 0.00 C ATOM 2404 CD LYS A 147 -7.856 13.411 5.680 1.00 0.00 C ATOM 2405 CE LYS A 147 -7.687 14.303 6.904 1.00 0.00 C ATOM 2406 NZ LYS A 147 -7.140 15.636 6.539 1.00 0.00 N ATOM 0 H LYS A 147 -8.267 9.797 2.710 1.00 0.00 H new ATOM 0 HA LYS A 147 -6.726 11.898 3.871 1.00 0.00 H new ATOM 0 HB2 LYS A 147 -9.208 11.572 4.103 1.00 0.00 H new ATOM 0 HB3 LYS A 147 -8.901 10.164 5.102 1.00 0.00 H new ATOM 0 HG2 LYS A 147 -9.385 12.131 6.496 1.00 0.00 H new ATOM 0 HG3 LYS A 147 -7.753 11.561 6.780 1.00 0.00 H new ATOM 0 HD2 LYS A 147 -6.895 13.301 5.178 1.00 0.00 H new ATOM 0 HD3 LYS A 147 -8.531 13.893 4.973 1.00 0.00 H new ATOM 0 HE2 LYS A 147 -8.650 14.428 7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 147 -7.021 13.819 7.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 -7.038 16.216 7.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 -6.210 15.518 6.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 -7.788 16.108 5.877 1.00 0.00 H new ATOM 2420 N ALA A 148 -6.245 8.831 4.984 1.00 0.00 N ATOM 2421 CA ALA A 148 -5.335 7.988 5.775 1.00 0.00 C ATOM 2422 C ALA A 148 -3.871 8.213 5.362 1.00 0.00 C ATOM 2423 O ALA A 148 -2.965 8.199 6.199 1.00 0.00 O ATOM 2424 CB ALA A 148 -5.713 6.517 5.625 1.00 0.00 C ATOM 0 H ALA A 148 -6.919 8.308 4.425 1.00 0.00 H new ATOM 0 HA ALA A 148 -5.434 8.271 6.823 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -5.032 5.904 6.215 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -6.734 6.366 5.976 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -5.644 6.229 4.576 1.00 0.00 H new ATOM 2430 N LEU A 149 -3.650 8.423 4.066 1.00 0.00 N ATOM 2431 CA LEU A 149 -2.317 8.760 3.548 1.00 0.00 C ATOM 2432 C LEU A 149 -1.912 10.189 3.943 1.00 0.00 C ATOM 2433 O LEU A 149 -0.741 10.557 3.874 1.00 0.00 O ATOM 2434 CB LEU A 149 -2.285 8.605 2.020 1.00 0.00 C ATOM 2435 CG LEU A 149 -2.592 7.190 1.504 1.00 0.00 C ATOM 2436 CD1 LEU A 149 -2.516 7.137 -0.020 1.00 0.00 C ATOM 2437 CD2 LEU A 149 -1.642 6.174 2.133 1.00 0.00 C ATOM 0 H LEU A 149 -4.375 8.367 3.351 1.00 0.00 H new ATOM 0 HA LEU A 149 -1.600 8.070 3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.004 9.298 1.584 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.299 8.901 1.660 1.00 0.00 H new ATOM 0 HG LEU A 149 -3.610 6.933 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -2.737 6.125 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.242 7.830 -0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.514 7.418 -0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.874 5.178 1.757 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.614 6.429 1.876 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -1.759 6.189 3.217 1.00 0.00 H new ATOM 2449 N SER A 150 -2.896 10.985 4.354 1.00 0.00 N ATOM 2450 CA SER A 150 -2.655 12.358 4.822 1.00 0.00 C ATOM 2451 C SER A 150 -2.523 12.404 6.356 1.00 0.00 C ATOM 2452 O SER A 150 -2.126 13.421 6.927 1.00 0.00 O ATOM 2453 CB SER A 150 -3.796 13.280 4.368 1.00 0.00 C ATOM 2454 OG SER A 150 -3.960 13.256 2.954 1.00 0.00 O ATOM 0 H SER A 150 -3.877 10.705 4.374 1.00 0.00 H new ATOM 0 HA SER A 150 -1.718 12.704 4.386 1.00 0.00 H new ATOM 0 HB2 SER A 150 -4.725 12.973 4.848 1.00 0.00 H new ATOM 0 HB3 SER A 150 -3.591 14.300 4.694 1.00 0.00 H new ATOM 0 HG SER A 150 -4.356 12.401 2.685 1.00 0.00 H new ATOM 2460 N LEU A 151 -2.870 11.297 7.017 1.00 0.00 N ATOM 2461 CA LEU A 151 -2.765 11.177 8.482 1.00 0.00 C ATOM 2462 C LEU A 151 -1.396 10.598 8.902 1.00 0.00 C ATOM 2463 O LEU A 151 -0.680 10.031 8.075 1.00 0.00 O ATOM 2464 CB LEU A 151 -3.905 10.288 9.011 1.00 0.00 C ATOM 2465 CG LEU A 151 -5.324 10.864 8.843 1.00 0.00 C ATOM 2466 CD1 LEU A 151 -6.373 9.884 9.366 1.00 0.00 C ATOM 2467 CD2 LEU A 151 -5.449 12.217 9.545 1.00 0.00 C ATOM 0 H LEU A 151 -3.230 10.460 6.559 1.00 0.00 H new ATOM 0 HA LEU A 151 -2.850 12.174 8.915 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -3.859 9.326 8.501 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -3.732 10.096 10.070 1.00 0.00 H new ATOM 0 HG LEU A 151 -5.503 11.017 7.779 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -7.367 10.312 9.237 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -6.306 8.949 8.811 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -6.195 9.691 10.424 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -6.459 12.604 9.412 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -5.244 12.095 10.609 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -4.733 12.918 9.115 1.00 0.00 H new ATOM 2479 N PRO A 152 -1.002 10.744 10.192 1.00 0.00 N ATOM 2480 CA PRO A 152 0.292 10.230 10.698 1.00 0.00 C ATOM 2481 C PRO A 152 0.469 8.705 10.536 1.00 0.00 C ATOM 2482 O PRO A 152 -0.483 7.977 10.248 1.00 0.00 O ATOM 2483 CB PRO A 152 0.283 10.621 12.187 1.00 0.00 C ATOM 2484 CG PRO A 152 -1.151 10.878 12.513 1.00 0.00 C ATOM 2485 CD PRO A 152 -1.763 11.427 11.256 1.00 0.00 C ATOM 0 HA PRO A 152 1.123 10.651 10.132 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.691 9.823 12.807 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.893 11.507 12.366 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -1.652 9.961 12.824 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -1.244 11.587 13.336 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -2.829 11.206 11.196 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -1.658 12.510 11.196 1.00 0.00 H new ATOM 2493 N LEU A 153 1.701 8.230 10.739 1.00 0.00 N ATOM 2494 CA LEU A 153 2.042 6.812 10.545 1.00 0.00 C ATOM 2495 C LEU A 153 1.505 5.932 11.690 1.00 0.00 C ATOM 2496 O LEU A 153 0.494 5.246 11.539 1.00 0.00 O ATOM 2497 CB LEU A 153 3.566 6.656 10.435 1.00 0.00 C ATOM 2498 CG LEU A 153 4.248 7.597 9.430 1.00 0.00 C ATOM 2499 CD1 LEU A 153 5.762 7.419 9.458 1.00 0.00 C ATOM 2500 CD2 LEU A 153 3.700 7.376 8.026 1.00 0.00 C ATOM 0 H LEU A 153 2.486 8.808 11.040 1.00 0.00 H new ATOM 0 HA LEU A 153 1.569 6.478 9.622 1.00 0.00 H new ATOM 0 HB2 LEU A 153 4.004 6.822 11.419 1.00 0.00 H new ATOM 0 HB3 LEU A 153 3.791 5.627 10.155 1.00 0.00 H new ATOM 0 HG LEU A 153 4.026 8.623 9.723 1.00 0.00 H new ATOM 0 HD11 LEU A 153 6.221 8.096 8.738 1.00 0.00 H new ATOM 0 HD12 LEU A 153 6.136 7.643 10.457 1.00 0.00 H new ATOM 0 HD13 LEU A 153 6.012 6.390 9.199 1.00 0.00 H new ATOM 0 HD21 LEU A 153 4.197 8.053 7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 153 3.883 6.345 7.722 1.00 0.00 H new ATOM 0 HD23 LEU A 153 2.628 7.572 8.019 1.00 0.00 H new ATOM 2512 N GLU A 154 2.193 5.956 12.829 1.00 0.00 N ATOM 2513 CA GLU A 154 1.768 5.202 14.018 1.00 0.00 C ATOM 2514 C GLU A 154 1.548 6.146 15.210 1.00 0.00 C ATOM 2515 O GLU A 154 1.149 5.719 16.297 1.00 0.00 O ATOM 2516 CB GLU A 154 2.811 4.125 14.382 1.00 0.00 C ATOM 2517 CG GLU A 154 4.119 4.663 14.969 1.00 0.00 C ATOM 2518 CD GLU A 154 4.907 5.531 13.999 1.00 0.00 C ATOM 2519 OE1 GLU A 154 5.741 4.984 13.247 1.00 0.00 O ATOM 2520 OE2 GLU A 154 4.700 6.765 13.988 1.00 0.00 O ATOM 0 H GLU A 154 3.052 6.490 12.959 1.00 0.00 H new ATOM 0 HA GLU A 154 0.824 4.709 13.785 1.00 0.00 H new ATOM 0 HB2 GLU A 154 2.365 3.436 15.099 1.00 0.00 H new ATOM 0 HB3 GLU A 154 3.042 3.548 13.487 1.00 0.00 H new ATOM 0 HG2 GLU A 154 3.895 5.243 15.864 1.00 0.00 H new ATOM 0 HG3 GLU A 154 4.741 3.824 15.281 1.00 0.00 H new ATOM 2527 N HIS A 155 1.819 7.432 14.990 1.00 0.00 N ATOM 2528 CA HIS A 155 1.655 8.461 16.020 1.00 0.00 C ATOM 2529 C HIS A 155 0.229 8.491 16.589 1.00 0.00 C ATOM 2530 O HIS A 155 -0.752 8.355 15.860 1.00 0.00 O ATOM 2531 CB HIS A 155 2.016 9.836 15.440 1.00 0.00 C ATOM 2532 CG HIS A 155 1.675 10.989 16.336 1.00 0.00 C ATOM 2533 ND1 HIS A 155 0.621 11.840 16.323 1.00 0.00 N flip ATOM 2534 CD2 HIS A 155 2.459 11.376 17.399 1.00 0.00 C flip ATOM 2535 CE1 HIS A 155 0.792 12.710 17.367 1.00 0.00 C flip ATOM 2536 NE2 HIS A 155 1.906 12.408 17.999 1.00 0.00 N flip ATOM 0 H HIS A 155 2.157 7.790 14.097 1.00 0.00 H new ATOM 0 HA HIS A 155 2.328 8.215 16.842 1.00 0.00 H new ATOM 0 HB2 HIS A 155 3.085 9.859 15.227 1.00 0.00 H new ATOM 0 HB3 HIS A 155 1.499 9.964 14.489 1.00 0.00 H new ATOM 0 HD2 HIS A 155 3.385 10.905 17.695 1.00 0.00 H new ATOM 0 HE1 HIS A 155 0.121 13.514 17.629 1.00 0.00 H new ATOM 0 HE2 HIS A 155 2.278 12.892 18.816 1.00 0.00 H new ATOM 2545 N HIS A 156 0.135 8.694 17.898 1.00 0.00 N ATOM 2546 CA HIS A 156 -1.151 8.816 18.589 1.00 0.00 C ATOM 2547 C HIS A 156 -1.127 10.016 19.543 1.00 0.00 C ATOM 2548 O HIS A 156 -0.147 10.759 19.592 1.00 0.00 O ATOM 2549 CB HIS A 156 -1.469 7.529 19.367 1.00 0.00 C ATOM 2550 CG HIS A 156 -0.440 7.177 20.403 1.00 0.00 C ATOM 2551 ND1 HIS A 156 -0.523 7.574 21.723 1.00 0.00 N ATOM 2552 CD2 HIS A 156 0.706 6.461 20.304 1.00 0.00 C ATOM 2553 CE1 HIS A 156 0.523 7.121 22.383 1.00 0.00 C ATOM 2554 NE2 HIS A 156 1.283 6.443 21.548 1.00 0.00 N ATOM 0 H HIS A 156 0.944 8.779 18.513 1.00 0.00 H new ATOM 0 HA HIS A 156 -1.931 8.973 17.843 1.00 0.00 H new ATOM 0 HB2 HIS A 156 -2.438 7.640 19.854 1.00 0.00 H new ATOM 0 HB3 HIS A 156 -1.559 6.702 18.662 1.00 0.00 H new ATOM 0 HD1 HIS A 156 -1.277 8.131 22.124 1.00 0.00 H new ATOM 0 HD2 HIS A 156 1.093 5.992 19.412 1.00 0.00 H new ATOM 0 HE1 HIS A 156 0.724 7.279 23.432 1.00 0.00 H new ATOM 2563 N HIS A 157 -2.200 10.203 20.297 1.00 0.00 N ATOM 2564 CA HIS A 157 -2.255 11.273 21.291 1.00 0.00 C ATOM 2565 C HIS A 157 -1.236 11.002 22.409 1.00 0.00 C ATOM 2566 O HIS A 157 -1.254 9.934 23.018 1.00 0.00 O ATOM 2567 CB HIS A 157 -3.675 11.383 21.863 1.00 0.00 C ATOM 2568 CG HIS A 157 -3.892 12.594 22.717 1.00 0.00 C ATOM 2569 ND1 HIS A 157 -4.197 12.527 24.056 1.00 0.00 N ATOM 2570 CD2 HIS A 157 -3.865 13.913 22.409 1.00 0.00 C ATOM 2571 CE1 HIS A 157 -4.350 13.743 24.534 1.00 0.00 C ATOM 2572 NE2 HIS A 157 -4.154 14.603 23.559 1.00 0.00 N ATOM 0 H HIS A 157 -3.043 9.632 20.243 1.00 0.00 H new ATOM 0 HA HIS A 157 -2.001 12.220 20.815 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -4.388 11.399 21.039 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.889 10.491 22.452 1.00 0.00 H new ATOM 0 HD1 HIS A 157 -4.290 11.667 24.596 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -3.655 14.341 21.440 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -4.595 13.993 25.556 1.00 0.00 H new ATOM 2581 N HIS A 158 -0.337 11.957 22.657 1.00 0.00 N ATOM 2582 CA HIS A 158 0.729 11.775 23.653 1.00 0.00 C ATOM 2583 C HIS A 158 0.169 11.373 25.026 1.00 0.00 C ATOM 2584 O HIS A 158 0.527 10.323 25.565 1.00 0.00 O ATOM 2585 CB HIS A 158 1.586 13.040 23.772 1.00 0.00 C ATOM 2586 CG HIS A 158 2.381 13.342 22.537 1.00 0.00 C ATOM 2587 ND1 HIS A 158 3.449 12.572 22.125 1.00 0.00 N ATOM 2588 CD2 HIS A 158 2.261 14.331 21.618 1.00 0.00 C ATOM 2589 CE1 HIS A 158 3.950 13.073 21.015 1.00 0.00 C ATOM 2590 NE2 HIS A 158 3.249 14.137 20.686 1.00 0.00 N ATOM 0 H HIS A 158 -0.323 12.862 22.186 1.00 0.00 H new ATOM 0 HA HIS A 158 1.360 10.958 23.304 1.00 0.00 H new ATOM 0 HB2 HIS A 158 0.939 13.888 23.994 1.00 0.00 H new ATOM 0 HB3 HIS A 158 2.268 12.930 24.615 1.00 0.00 H new ATOM 0 HD2 HIS A 158 1.526 15.123 21.619 1.00 0.00 H new ATOM 0 HE1 HIS A 158 4.793 12.678 20.468 1.00 0.00 H new ATOM 0 HE2 HIS A 158 3.414 14.724 19.868 1.00 0.00 H new ATOM 2599 N HIS A 159 -0.696 12.208 25.597 1.00 0.00 N ATOM 2600 CA HIS A 159 -1.395 11.845 26.833 1.00 0.00 C ATOM 2601 C HIS A 159 -2.385 10.697 26.570 1.00 0.00 C ATOM 2602 O HIS A 159 -3.528 10.934 26.173 1.00 0.00 O ATOM 2603 CB HIS A 159 -2.128 13.058 27.419 1.00 0.00 C ATOM 2604 CG HIS A 159 -2.841 12.764 28.704 1.00 0.00 C ATOM 2605 ND1 HIS A 159 -4.151 12.335 28.755 1.00 0.00 N ATOM 2606 CD2 HIS A 159 -2.423 12.831 29.991 1.00 0.00 C ATOM 2607 CE1 HIS A 159 -4.505 12.153 30.010 1.00 0.00 C ATOM 2608 NE2 HIS A 159 -3.477 12.445 30.778 1.00 0.00 N ATOM 0 H HIS A 159 -0.930 13.131 25.231 1.00 0.00 H new ATOM 0 HA HIS A 159 -0.655 11.509 27.559 1.00 0.00 H new ATOM 0 HB2 HIS A 159 -1.409 13.860 27.587 1.00 0.00 H new ATOM 0 HB3 HIS A 159 -2.849 13.424 26.688 1.00 0.00 H new ATOM 0 HD2 HIS A 159 -1.444 13.132 30.333 1.00 0.00 H new ATOM 0 HE1 HIS A 159 -5.474 11.821 30.351 1.00 0.00 H new ATOM 0 HE2 HIS A 159 -3.466 12.392 31.797 1.00 0.00 H new ATOM 2617 N HIS A 160 -1.918 9.463 26.775 1.00 0.00 N ATOM 2618 CA HIS A 160 -2.707 8.246 26.504 1.00 0.00 C ATOM 2619 C HIS A 160 -2.973 8.064 24.990 1.00 0.00 C ATOM 2620 O HIS A 160 -3.998 8.580 24.485 1.00 0.00 O ATOM 2621 CB HIS A 160 -4.031 8.256 27.293 1.00 0.00 C ATOM 2622 CG HIS A 160 -4.864 7.024 27.086 1.00 0.00 C ATOM 2623 ND1 HIS A 160 -5.702 6.860 26.004 1.00 0.00 N ATOM 2624 CD2 HIS A 160 -4.982 5.892 27.822 1.00 0.00 C ATOM 2625 CE1 HIS A 160 -6.295 5.689 26.080 1.00 0.00 C ATOM 2626 NE2 HIS A 160 -5.879 5.081 27.171 1.00 0.00 N ATOM 2627 OXT HIS A 160 -2.158 7.393 24.316 1.00 0.00 O ATOM 0 H HIS A 160 -0.982 9.273 27.134 1.00 0.00 H new ATOM 0 HA HIS A 160 -2.115 7.395 26.841 1.00 0.00 H new ATOM 0 HB2 HIS A 160 -3.810 8.361 28.355 1.00 0.00 H new ATOM 0 HB3 HIS A 160 -4.612 9.131 27.000 1.00 0.00 H new ATOM 0 HD1 HIS A 160 -5.841 7.542 25.259 1.00 0.00 H new ATOM 0 HD2 HIS A 160 -4.468 5.670 28.745 1.00 0.00 H new ATOM 0 HE1 HIS A 160 -7.004 5.293 25.368 1.00 0.00 H new TER 2636 HIS A 160