USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1213 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 56 ASNHD21 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 56 ASNHD22 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD Set 1.1: A 32 MET CE :methyl 165:sc= -0.345 (180deg=-1.15) USER MOD Set 1.2: B 18 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 140 MET CE :methyl 179:sc= -0.401 (180deg=-0.403) USER MOD Set 2.2: A 141 MET CE :methyl 180:sc= -0.211 (180deg=-0.211) USER MOD Set 3.1: A 105 MET CE :methyl 166:sc= 0 (180deg=-0.0115) USER MOD Set 3.2: B 7 THR OG1 : rot -81:sc= 0.877 USER MOD Set 4.1: A 71 LYS NZ :NH3+ -174:sc= 1.47 (180deg=1.34) USER MOD Set 4.2: A 77 SER OG : rot 76:sc= 0.864 USER MOD Set 5.1: A 1 THR N :NH3+ -152:sc= 1.17 (180deg=-0.808) USER MOD Set 5.2: A 1 THR OG1 : rot 180:sc= 0 USER MOD Set 5.3: A 4 GLN : amide:sc= 0.989 K(o=2.2,f=-11!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -134:sc= 0.368 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -96:sc= 1.26 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0829 USER MOD Single : A 25 THR OG1 : rot 180:sc=0.000761 USER MOD Single : A 26 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0136) USER MOD Single : A 30 THR OG1 : rot 67:sc= 0.764 USER MOD Single : A 34 SER OG : rot 69:sc= 0.804 USER MOD Single : A 37 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.21) USER MOD Single : A 38 ASN : amide:sc= -0.0133 X(o=-0.013,f=-0.24) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 47 MET CE :methyl -172:sc= -0.759 (180deg=-1.37) USER MOD Single : A 49 ASN : amide:sc= -0.61 X(o=-0.61,f=-1.1) USER MOD Single : A 58 THR OG1 : rot -170:sc= 0.493 USER MOD Single : A 66 THR OG1 : rot 82:sc= 1.23 USER MOD Single : A 67 MET CE :methyl -145:sc= -0.0163 (180deg=-0.73) USER MOD Single : A 68 MET CE :methyl -170:sc=-0.00852 (180deg=-0.122) USER MOD Single : A 72 MET CE :methyl 176:sc= -0.498 (180deg=-0.575) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0383 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.68 K(o=0.68,f=-4.8!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -87:sc= 1.25 USER MOD Single : A 103 HIS : no HE2:sc= 0.683 K(o=0.68,f=-2.1!) USER MOD Single : A 106 THR OG1 : rot 84:sc= 1.11 USER MOD Single : A 107 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 120 MET CE :methyl 173:sc= -0.0624 (180deg=-0.221) USER MOD Single : A 131 GLN : amide:sc= -0.219 K(o=-0.22,f=-0.76) USER MOD Single : A 133 ASN : amide:sc= 0.73 K(o=0.73,f=-5.5!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.176 X(o=-0.18,f=-0.22) USER MOD Single : A 142 THR OG1 : rot 39:sc= 0.248 USER MOD Single : B 1 ARG N :NH3+ -149:sc= 1.25 (180deg=0.559) USER MOD Single : B 3 LYS NZ :NH3+ -166:sc= 1.2 (180deg=0.706) USER MOD Single : B 5 GLN : amide:sc= -0.0229 K(o=-0.023,f=-2.9!) USER MOD Single : B 6 LYS NZ :NH3+ -142:sc= 0.677 (180deg=0.446) USER MOD Single : B 9 HIS : no HD1:sc= 0.279 K(o=0.28,f=-2.5!) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.388 6.942 14.213 1.00 0.00 N ATOM 2 CA THR A 1 3.983 6.306 15.486 1.00 0.00 C ATOM 3 C THR A 1 4.278 4.849 15.575 1.00 0.00 C ATOM 4 O THR A 1 4.632 4.227 14.574 1.00 0.00 O ATOM 5 CB THR A 1 2.534 6.536 15.798 1.00 0.00 C ATOM 6 OG1 THR A 1 1.614 5.837 14.973 1.00 0.00 O ATOM 7 CG2 THR A 1 2.200 8.036 15.724 1.00 0.00 C ATOM 0 H1 THR A 1 4.599 7.947 14.379 1.00 0.00 H new ATOM 0 H2 THR A 1 5.235 6.467 13.842 1.00 0.00 H new ATOM 0 H3 THR A 1 3.615 6.860 13.522 1.00 0.00 H new ATOM 0 HA THR A 1 4.604 6.803 16.231 1.00 0.00 H new ATOM 0 HB THR A 1 2.412 6.140 16.806 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.699 6.048 15.252 1.00 0.00 H new ATOM 0 HG21 THR A 1 1.145 8.186 15.953 1.00 0.00 H new ATOM 0 HG22 THR A 1 2.809 8.580 16.446 1.00 0.00 H new ATOM 0 HG23 THR A 1 2.409 8.406 14.720 1.00 0.00 H new ATOM 14 N GLU A 2 4.272 4.221 16.765 1.00 0.00 N ATOM 15 CA GLU A 2 4.704 2.885 17.035 1.00 0.00 C ATOM 16 C GLU A 2 3.873 1.889 16.301 1.00 0.00 C ATOM 17 O GLU A 2 4.350 0.986 15.616 1.00 0.00 O ATOM 18 CB GLU A 2 4.683 2.568 18.540 1.00 0.00 C ATOM 19 CG GLU A 2 5.121 1.121 18.771 1.00 0.00 C ATOM 20 CD GLU A 2 5.385 0.735 20.219 1.00 0.00 C ATOM 21 OE1 GLU A 2 4.437 0.678 21.048 1.00 0.00 O ATOM 22 OE2 GLU A 2 6.551 0.338 20.483 1.00 0.00 O ATOM 0 H GLU A 2 3.937 4.689 17.607 1.00 0.00 H new ATOM 0 HA GLU A 2 5.734 2.814 16.685 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.347 3.248 19.073 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.681 2.722 18.940 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.352 0.460 18.372 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.028 0.939 18.194 1.00 0.00 H new ATOM 29 N GLU A 3 2.547 2.111 16.310 1.00 0.00 N ATOM 30 CA GLU A 3 1.552 1.454 15.519 1.00 0.00 C ATOM 31 C GLU A 3 1.968 1.292 14.098 1.00 0.00 C ATOM 32 O GLU A 3 1.988 0.178 13.577 1.00 0.00 O ATOM 33 CB GLU A 3 0.197 2.177 15.598 1.00 0.00 C ATOM 34 CG GLU A 3 -0.890 1.481 14.776 1.00 0.00 C ATOM 35 CD GLU A 3 -2.027 2.454 14.498 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.520 3.064 15.485 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.347 2.626 13.292 1.00 0.00 O ATOM 0 H GLU A 3 2.136 2.813 16.926 1.00 0.00 H new ATOM 0 HA GLU A 3 1.438 0.457 15.944 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.120 2.234 16.639 1.00 0.00 H new ATOM 0 HB3 GLU A 3 0.315 3.201 15.245 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.472 1.117 13.837 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.266 0.612 15.315 1.00 0.00 H new ATOM 44 N GLN A 4 2.437 2.367 13.439 1.00 0.00 N ATOM 45 CA GLN A 4 2.704 2.382 12.035 1.00 0.00 C ATOM 46 C GLN A 4 3.901 1.539 11.754 1.00 0.00 C ATOM 47 O GLN A 4 4.048 0.801 10.781 1.00 0.00 O ATOM 48 CB GLN A 4 2.921 3.857 11.657 1.00 0.00 C ATOM 49 CG GLN A 4 1.714 4.784 11.507 1.00 0.00 C ATOM 50 CD GLN A 4 2.118 6.225 11.227 1.00 0.00 C ATOM 51 OE1 GLN A 4 2.862 6.817 12.007 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.679 6.775 10.064 1.00 0.00 N ATOM 0 H GLN A 4 2.637 3.255 13.899 1.00 0.00 H new ATOM 0 HA GLN A 4 1.887 1.969 11.444 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.576 4.294 12.411 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.465 3.875 10.713 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.081 4.423 10.696 1.00 0.00 H new ATOM 0 HG3 GLN A 4 1.116 4.748 12.418 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.062 6.244 9.449 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.966 7.719 9.806 1.00 0.00 H new ATOM 61 N ILE A 5 4.929 1.581 12.619 1.00 0.00 N ATOM 62 CA ILE A 5 6.096 0.755 12.602 1.00 0.00 C ATOM 63 C ILE A 5 5.844 -0.710 12.712 1.00 0.00 C ATOM 64 O ILE A 5 6.409 -1.473 11.930 1.00 0.00 O ATOM 65 CB ILE A 5 7.213 1.148 13.523 1.00 0.00 C ATOM 66 CG1 ILE A 5 7.520 2.646 13.356 1.00 0.00 C ATOM 67 CG2 ILE A 5 8.470 0.282 13.338 1.00 0.00 C ATOM 68 CD1 ILE A 5 8.073 3.171 12.033 1.00 0.00 C ATOM 0 H ILE A 5 4.944 2.246 13.392 1.00 0.00 H new ATOM 0 HA ILE A 5 6.444 0.962 11.590 1.00 0.00 H new ATOM 0 HB ILE A 5 6.882 0.968 14.546 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.598 3.190 13.560 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.231 2.920 14.136 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.244 0.612 14.030 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.226 -0.761 13.538 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.832 0.380 12.315 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.226 4.248 12.104 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.023 2.683 11.817 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.365 2.958 11.232 1.00 0.00 H new ATOM 80 N ALA A 6 4.947 -1.090 13.640 1.00 0.00 N ATOM 81 CA ALA A 6 4.410 -2.402 13.829 1.00 0.00 C ATOM 82 C ALA A 6 3.625 -2.902 12.666 1.00 0.00 C ATOM 83 O ALA A 6 3.700 -4.064 12.270 1.00 0.00 O ATOM 84 CB ALA A 6 3.526 -2.402 15.087 1.00 0.00 C ATOM 0 H ALA A 6 4.567 -0.423 14.312 1.00 0.00 H new ATOM 0 HA ALA A 6 5.256 -3.080 13.939 1.00 0.00 H new ATOM 0 HB1 ALA A 6 3.111 -3.398 15.240 1.00 0.00 H new ATOM 0 HB2 ALA A 6 4.126 -2.121 15.953 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.714 -1.686 14.961 1.00 0.00 H new ATOM 90 N GLU A 7 2.928 -2.064 11.877 1.00 0.00 N ATOM 91 CA GLU A 7 2.249 -2.394 10.663 1.00 0.00 C ATOM 92 C GLU A 7 3.131 -2.605 9.482 1.00 0.00 C ATOM 93 O GLU A 7 2.962 -3.508 8.663 1.00 0.00 O ATOM 94 CB GLU A 7 1.167 -1.422 10.162 1.00 0.00 C ATOM 95 CG GLU A 7 0.040 -1.111 11.148 1.00 0.00 C ATOM 96 CD GLU A 7 -1.034 -2.188 11.188 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.523 -2.620 10.110 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.479 -2.516 12.320 1.00 0.00 O ATOM 0 H GLU A 7 2.833 -1.075 12.109 1.00 0.00 H new ATOM 0 HA GLU A 7 1.783 -3.317 11.008 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.649 -0.485 9.883 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.726 -1.836 9.255 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.462 -0.990 12.146 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.418 -0.160 10.878 1.00 0.00 H new ATOM 105 N PHE A 8 4.198 -1.791 9.394 1.00 0.00 N ATOM 106 CA PHE A 8 5.327 -1.994 8.540 1.00 0.00 C ATOM 107 C PHE A 8 6.100 -3.219 8.889 1.00 0.00 C ATOM 108 O PHE A 8 6.481 -3.873 7.920 1.00 0.00 O ATOM 109 CB PHE A 8 6.330 -0.831 8.460 1.00 0.00 C ATOM 110 CG PHE A 8 5.771 0.373 7.783 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.301 0.269 6.496 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.958 1.562 8.450 1.00 0.00 C ATOM 113 CE1 PHE A 8 4.800 1.410 5.915 1.00 0.00 C ATOM 114 CE2 PHE A 8 5.517 2.675 7.774 1.00 0.00 C ATOM 115 CZ PHE A 8 4.906 2.629 6.543 1.00 0.00 C ATOM 0 H PHE A 8 4.277 -0.941 9.952 1.00 0.00 H new ATOM 0 HA PHE A 8 4.850 -2.089 7.565 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.646 -0.561 9.468 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.220 -1.162 7.925 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.324 -0.670 5.963 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.415 1.617 9.427 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.316 1.348 4.951 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.659 3.641 8.236 1.00 0.00 H new ATOM 0 HZ PHE A 8 4.520 3.526 6.082 1.00 0.00 H new ATOM 125 N LYS A 9 6.283 -3.579 10.172 1.00 0.00 N ATOM 126 CA LYS A 9 6.824 -4.852 10.536 1.00 0.00 C ATOM 127 C LYS A 9 6.104 -6.101 10.159 1.00 0.00 C ATOM 128 O LYS A 9 6.683 -7.070 9.670 1.00 0.00 O ATOM 129 CB LYS A 9 6.850 -4.872 12.074 1.00 0.00 C ATOM 130 CG LYS A 9 7.808 -5.840 12.771 1.00 0.00 C ATOM 131 CD LYS A 9 9.294 -5.478 12.809 1.00 0.00 C ATOM 132 CE LYS A 9 10.206 -6.325 13.699 1.00 0.00 C ATOM 133 NZ LYS A 9 10.255 -7.739 13.266 1.00 0.00 N ATOM 0 H LYS A 9 6.053 -2.981 10.966 1.00 0.00 H new ATOM 0 HA LYS A 9 7.765 -4.895 9.988 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.088 -3.865 12.416 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.841 -5.096 12.421 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.468 -5.964 13.799 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.713 -6.811 12.285 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.678 -5.528 11.790 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.379 -4.440 13.132 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.213 -5.908 13.686 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.854 -6.275 14.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.885 -8.274 13.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.299 -8.147 13.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.616 -7.792 12.292 1.00 0.00 H new ATOM 147 N GLU A 10 4.771 -6.178 10.325 1.00 0.00 N ATOM 148 CA GLU A 10 3.803 -7.149 9.919 1.00 0.00 C ATOM 149 C GLU A 10 3.850 -7.326 8.440 1.00 0.00 C ATOM 150 O GLU A 10 3.831 -8.465 7.976 1.00 0.00 O ATOM 151 CB GLU A 10 2.432 -6.595 10.342 1.00 0.00 C ATOM 152 CG GLU A 10 1.365 -7.687 10.248 1.00 0.00 C ATOM 153 CD GLU A 10 0.112 -7.477 11.086 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.344 -6.304 11.139 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.504 -8.462 11.575 1.00 0.00 O ATOM 0 H GLU A 10 4.302 -5.427 10.831 1.00 0.00 H new ATOM 0 HA GLU A 10 3.996 -8.120 10.376 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.485 -6.216 11.363 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.159 -5.755 9.703 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.066 -7.785 9.204 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.818 -8.634 10.540 1.00 0.00 H new ATOM 162 N ALA A 11 4.007 -6.231 7.675 1.00 0.00 N ATOM 163 CA ALA A 11 4.082 -6.345 6.251 1.00 0.00 C ATOM 164 C ALA A 11 5.361 -7.012 5.878 1.00 0.00 C ATOM 165 O ALA A 11 5.447 -7.904 5.036 1.00 0.00 O ATOM 166 CB ALA A 11 3.874 -4.949 5.641 1.00 0.00 C ATOM 0 H ALA A 11 4.081 -5.280 8.035 1.00 0.00 H new ATOM 0 HA ALA A 11 3.295 -6.979 5.842 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.928 -5.015 4.554 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.896 -4.566 5.933 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.650 -4.275 6.002 1.00 0.00 H new ATOM 172 N PHE A 12 6.507 -6.538 6.399 1.00 0.00 N ATOM 173 CA PHE A 12 7.760 -7.215 6.273 1.00 0.00 C ATOM 174 C PHE A 12 7.704 -8.681 6.531 1.00 0.00 C ATOM 175 O PHE A 12 8.233 -9.503 5.784 1.00 0.00 O ATOM 176 CB PHE A 12 8.805 -6.517 7.160 1.00 0.00 C ATOM 177 CG PHE A 12 10.211 -6.685 6.695 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.736 -5.769 5.814 1.00 0.00 C ATOM 179 CD2 PHE A 12 11.038 -7.640 7.237 1.00 0.00 C ATOM 180 CE1 PHE A 12 12.043 -5.829 5.392 1.00 0.00 C ATOM 181 CE2 PHE A 12 12.317 -7.790 6.753 1.00 0.00 C ATOM 182 CZ PHE A 12 12.838 -6.798 5.957 1.00 0.00 C ATOM 0 H PHE A 12 6.564 -5.663 6.920 1.00 0.00 H new ATOM 0 HA PHE A 12 8.053 -7.144 5.226 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.574 -5.453 7.205 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.721 -6.905 8.175 1.00 0.00 H new ATOM 0 HD1 PHE A 12 10.102 -4.978 5.442 1.00 0.00 H new ATOM 0 HD2 PHE A 12 10.685 -8.270 8.040 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.428 -5.145 4.650 1.00 0.00 H new ATOM 0 HE2 PHE A 12 12.899 -8.668 6.993 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.902 -6.779 5.770 1.00 0.00 H new ATOM 192 N SER A 13 7.088 -9.056 7.666 1.00 0.00 N ATOM 193 CA SER A 13 6.928 -10.398 8.134 1.00 0.00 C ATOM 194 C SER A 13 6.247 -11.302 7.164 1.00 0.00 C ATOM 195 O SER A 13 6.349 -12.527 7.195 1.00 0.00 O ATOM 196 CB SER A 13 6.329 -10.488 9.548 1.00 0.00 C ATOM 197 OG SER A 13 7.316 -10.252 10.541 1.00 0.00 O ATOM 0 H SER A 13 6.673 -8.373 8.300 1.00 0.00 H new ATOM 0 HA SER A 13 7.947 -10.777 8.215 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.524 -9.760 9.652 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.888 -11.474 9.697 1.00 0.00 H new ATOM 0 HG SER A 13 6.907 -10.314 11.430 1.00 0.00 H new ATOM 203 N LEU A 14 5.449 -10.835 6.188 1.00 0.00 N ATOM 204 CA LEU A 14 4.844 -11.618 5.156 1.00 0.00 C ATOM 205 C LEU A 14 5.754 -12.070 4.066 1.00 0.00 C ATOM 206 O LEU A 14 5.565 -13.120 3.454 1.00 0.00 O ATOM 207 CB LEU A 14 3.636 -10.850 4.594 1.00 0.00 C ATOM 208 CG LEU A 14 2.726 -11.588 3.597 1.00 0.00 C ATOM 209 CD1 LEU A 14 2.235 -12.908 4.216 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.499 -10.787 3.129 1.00 0.00 C ATOM 0 H LEU A 14 5.211 -9.846 6.116 1.00 0.00 H new ATOM 0 HA LEU A 14 4.533 -12.551 5.626 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.022 -10.527 5.435 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.008 -9.949 4.107 1.00 0.00 H new ATOM 0 HG LEU A 14 3.346 -11.756 2.716 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.591 -13.426 3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.091 -13.538 4.456 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.674 -12.696 5.126 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.918 -11.387 2.429 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.880 -10.533 3.990 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.828 -9.872 2.636 1.00 0.00 H new ATOM 222 N PHE A 15 6.810 -11.286 3.786 1.00 0.00 N ATOM 223 CA PHE A 15 7.740 -11.410 2.707 1.00 0.00 C ATOM 224 C PHE A 15 8.934 -12.218 3.086 1.00 0.00 C ATOM 225 O PHE A 15 9.400 -13.159 2.446 1.00 0.00 O ATOM 226 CB PHE A 15 8.210 -9.997 2.322 1.00 0.00 C ATOM 227 CG PHE A 15 7.074 -9.067 2.073 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.968 -9.470 1.362 1.00 0.00 C ATOM 229 CD2 PHE A 15 7.238 -7.731 2.356 1.00 0.00 C ATOM 230 CE1 PHE A 15 4.952 -8.601 1.038 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.215 -6.859 2.068 1.00 0.00 C ATOM 232 CZ PHE A 15 5.110 -7.275 1.363 1.00 0.00 C ATOM 0 H PHE A 15 7.033 -10.485 4.377 1.00 0.00 H new ATOM 0 HA PHE A 15 7.242 -11.916 1.879 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.836 -9.596 3.119 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.831 -10.055 1.428 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.895 -10.501 1.048 1.00 0.00 H new ATOM 0 HD2 PHE A 15 8.156 -7.373 2.798 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.058 -8.950 0.543 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.280 -5.833 2.400 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.362 -6.556 1.063 1.00 0.00 H new ATOM 242 N ASP A 16 9.482 -11.787 4.236 1.00 0.00 N ATOM 243 CA ASP A 16 10.469 -12.620 4.852 1.00 0.00 C ATOM 244 C ASP A 16 9.931 -13.919 5.343 1.00 0.00 C ATOM 245 O ASP A 16 8.939 -13.905 6.071 1.00 0.00 O ATOM 246 CB ASP A 16 11.101 -11.831 6.011 1.00 0.00 C ATOM 247 CG ASP A 16 12.389 -12.305 6.668 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.738 -13.504 6.497 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.956 -11.559 7.511 1.00 0.00 O ATOM 0 H ASP A 16 9.261 -10.915 4.717 1.00 0.00 H new ATOM 0 HA ASP A 16 11.210 -12.878 4.096 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.281 -10.819 5.648 1.00 0.00 H new ATOM 0 HB3 ASP A 16 10.349 -11.759 6.797 1.00 0.00 H new ATOM 254 N LYS A 17 10.393 -15.062 4.806 1.00 0.00 N ATOM 255 CA LYS A 17 9.919 -16.382 5.082 1.00 0.00 C ATOM 256 C LYS A 17 10.728 -17.165 6.058 1.00 0.00 C ATOM 257 O LYS A 17 10.223 -18.136 6.620 1.00 0.00 O ATOM 258 CB LYS A 17 9.951 -17.209 3.785 1.00 0.00 C ATOM 259 CG LYS A 17 8.880 -16.650 2.846 1.00 0.00 C ATOM 260 CD LYS A 17 7.445 -16.828 3.344 1.00 0.00 C ATOM 261 CE LYS A 17 6.456 -16.129 2.410 1.00 0.00 C ATOM 262 NZ LYS A 17 5.078 -16.041 2.943 1.00 0.00 N ATOM 0 H LYS A 17 11.155 -15.062 4.128 1.00 0.00 H new ATOM 0 HA LYS A 17 8.926 -16.227 5.505 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.935 -17.151 3.319 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.761 -18.261 3.998 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.069 -15.588 2.692 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.977 -17.135 1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.206 -17.890 3.406 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.351 -16.421 4.351 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.819 -15.122 2.203 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.433 -16.661 1.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.401 -16.317 2.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.980 -16.680 3.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.884 -15.064 3.243 1.00 0.00 H new ATOM 276 N ASP A 18 11.919 -16.645 6.405 1.00 0.00 N ATOM 277 CA ASP A 18 12.658 -16.975 7.584 1.00 0.00 C ATOM 278 C ASP A 18 12.186 -16.259 8.803 1.00 0.00 C ATOM 279 O ASP A 18 12.037 -16.854 9.869 1.00 0.00 O ATOM 280 CB ASP A 18 14.143 -16.595 7.455 1.00 0.00 C ATOM 281 CG ASP A 18 14.769 -16.917 6.106 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.765 -18.126 5.752 1.00 0.00 O ATOM 283 OD2 ASP A 18 15.345 -15.989 5.478 1.00 0.00 O ATOM 0 H ASP A 18 12.394 -15.952 5.827 1.00 0.00 H new ATOM 0 HA ASP A 18 12.510 -18.050 7.685 1.00 0.00 H new ATOM 0 HB2 ASP A 18 14.248 -15.526 7.643 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.705 -17.112 8.233 1.00 0.00 H new ATOM 288 N GLY A 19 12.129 -14.924 8.652 1.00 0.00 N ATOM 289 CA GLY A 19 11.950 -14.073 9.788 1.00 0.00 C ATOM 290 C GLY A 19 13.250 -13.804 10.463 1.00 0.00 C ATOM 291 O GLY A 19 13.512 -14.034 11.643 1.00 0.00 O ATOM 0 H GLY A 19 12.205 -14.439 7.758 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.497 -13.132 9.475 1.00 0.00 H new ATOM 0 HA3 GLY A 19 11.260 -14.540 10.492 1.00 0.00 H new ATOM 295 N ASP A 20 14.171 -13.114 9.766 1.00 0.00 N ATOM 296 CA ASP A 20 15.517 -12.738 10.066 1.00 0.00 C ATOM 297 C ASP A 20 15.610 -11.265 10.266 1.00 0.00 C ATOM 298 O ASP A 20 16.193 -10.808 11.248 1.00 0.00 O ATOM 299 CB ASP A 20 16.518 -13.598 9.276 1.00 0.00 C ATOM 300 CG ASP A 20 16.671 -12.934 7.915 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.696 -12.917 7.117 1.00 0.00 O ATOM 302 OD2 ASP A 20 17.833 -12.584 7.578 1.00 0.00 O ATOM 0 H ASP A 20 13.921 -12.767 8.840 1.00 0.00 H new ATOM 0 HA ASP A 20 15.898 -13.016 11.049 1.00 0.00 H new ATOM 0 HB2 ASP A 20 17.476 -13.652 9.792 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.154 -14.620 9.171 1.00 0.00 H new ATOM 307 N GLY A 21 14.946 -10.499 9.382 1.00 0.00 N ATOM 308 CA GLY A 21 14.785 -9.088 9.210 1.00 0.00 C ATOM 309 C GLY A 21 15.402 -8.745 7.898 1.00 0.00 C ATOM 310 O GLY A 21 15.783 -7.610 7.619 1.00 0.00 O ATOM 0 H GLY A 21 14.422 -10.975 8.647 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.730 -8.814 9.225 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.268 -8.541 10.020 1.00 0.00 H new ATOM 314 N THR A 22 15.482 -9.646 6.902 1.00 0.00 N ATOM 315 CA THR A 22 15.895 -9.436 5.549 1.00 0.00 C ATOM 316 C THR A 22 15.016 -10.097 4.543 1.00 0.00 C ATOM 317 O THR A 22 14.668 -11.260 4.741 1.00 0.00 O ATOM 318 CB THR A 22 17.289 -9.898 5.244 1.00 0.00 C ATOM 319 OG1 THR A 22 17.506 -11.300 5.290 1.00 0.00 O ATOM 320 CG2 THR A 22 18.163 -9.242 6.327 1.00 0.00 C ATOM 0 H THR A 22 15.231 -10.621 7.064 1.00 0.00 H new ATOM 0 HA THR A 22 15.834 -8.351 5.467 1.00 0.00 H new ATOM 0 HB THR A 22 17.517 -9.621 4.215 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.868 -11.546 6.167 1.00 0.00 H new ATOM 0 HG21 THR A 22 19.204 -9.529 6.178 1.00 0.00 H new ATOM 0 HG22 THR A 22 18.072 -8.158 6.260 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.833 -9.574 7.311 1.00 0.00 H new ATOM 328 N ILE A 23 14.684 -9.439 3.418 1.00 0.00 N ATOM 329 CA ILE A 23 14.136 -10.198 2.336 1.00 0.00 C ATOM 330 C ILE A 23 15.185 -10.194 1.278 1.00 0.00 C ATOM 331 O ILE A 23 15.771 -9.162 0.954 1.00 0.00 O ATOM 332 CB ILE A 23 12.936 -9.464 1.817 1.00 0.00 C ATOM 333 CG1 ILE A 23 12.255 -8.604 2.895 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.895 -10.418 1.206 1.00 0.00 C ATOM 335 CD1 ILE A 23 11.295 -7.611 2.240 1.00 0.00 C ATOM 0 H ILE A 23 14.786 -8.437 3.259 1.00 0.00 H new ATOM 0 HA ILE A 23 13.853 -11.208 2.632 1.00 0.00 H new ATOM 0 HB ILE A 23 13.318 -8.804 1.038 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.712 -9.242 3.592 1.00 0.00 H new ATOM 0 HG13 ILE A 23 13.007 -8.068 3.474 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.043 -9.843 0.843 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.344 -10.964 0.376 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.559 -11.124 1.965 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.817 -7.006 3.010 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.849 -6.963 1.561 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.534 -8.155 1.681 1.00 0.00 H new ATOM 347 N THR A 24 15.554 -11.357 0.711 1.00 0.00 N ATOM 348 CA THR A 24 16.444 -11.524 -0.396 1.00 0.00 C ATOM 349 C THR A 24 15.715 -11.407 -1.690 1.00 0.00 C ATOM 350 O THR A 24 14.537 -11.069 -1.787 1.00 0.00 O ATOM 351 CB THR A 24 17.155 -12.841 -0.298 1.00 0.00 C ATOM 352 OG1 THR A 24 16.215 -13.899 -0.416 1.00 0.00 O ATOM 353 CG2 THR A 24 17.898 -13.127 1.018 1.00 0.00 C ATOM 0 H THR A 24 15.201 -12.250 1.055 1.00 0.00 H new ATOM 0 HA THR A 24 17.188 -10.728 -0.362 1.00 0.00 H new ATOM 0 HB THR A 24 17.893 -12.781 -1.098 1.00 0.00 H new ATOM 0 HG1 THR A 24 16.681 -14.759 -0.354 1.00 0.00 H new ATOM 0 HG21 THR A 24 18.370 -14.108 0.964 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.661 -12.366 1.178 1.00 0.00 H new ATOM 0 HG23 THR A 24 17.190 -13.110 1.847 1.00 0.00 H new ATOM 361 N THR A 25 16.445 -11.642 -2.795 1.00 0.00 N ATOM 362 CA THR A 25 15.870 -11.921 -4.074 1.00 0.00 C ATOM 363 C THR A 25 14.980 -13.101 -4.261 1.00 0.00 C ATOM 364 O THR A 25 14.008 -13.073 -5.014 1.00 0.00 O ATOM 365 CB THR A 25 16.928 -11.993 -5.135 1.00 0.00 C ATOM 366 OG1 THR A 25 17.984 -12.860 -4.750 1.00 0.00 O ATOM 367 CG2 THR A 25 17.523 -10.597 -5.387 1.00 0.00 C ATOM 0 H THR A 25 17.465 -11.638 -2.799 1.00 0.00 H new ATOM 0 HA THR A 25 15.196 -11.068 -4.156 1.00 0.00 H new ATOM 0 HB THR A 25 16.456 -12.376 -6.040 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.658 -12.889 -5.460 1.00 0.00 H new ATOM 0 HG21 THR A 25 18.290 -10.662 -6.159 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.735 -9.919 -5.715 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.967 -10.219 -4.466 1.00 0.00 H new ATOM 375 N LYS A 26 15.306 -14.207 -3.568 1.00 0.00 N ATOM 376 CA LYS A 26 14.535 -15.411 -3.527 1.00 0.00 C ATOM 377 C LYS A 26 13.263 -15.260 -2.765 1.00 0.00 C ATOM 378 O LYS A 26 12.186 -15.651 -3.213 1.00 0.00 O ATOM 379 CB LYS A 26 15.268 -16.636 -2.955 1.00 0.00 C ATOM 380 CG LYS A 26 16.727 -16.788 -3.389 1.00 0.00 C ATOM 381 CD LYS A 26 17.428 -17.878 -2.577 1.00 0.00 C ATOM 382 CE LYS A 26 18.884 -18.139 -2.969 1.00 0.00 C ATOM 383 NZ LYS A 26 19.713 -16.946 -2.686 1.00 0.00 N ATOM 0 H LYS A 26 16.155 -14.264 -3.005 1.00 0.00 H new ATOM 0 HA LYS A 26 14.335 -15.592 -4.583 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.234 -16.584 -1.867 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.724 -17.534 -3.248 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.771 -17.034 -4.450 1.00 0.00 H new ATOM 0 HG3 LYS A 26 17.249 -15.840 -3.260 1.00 0.00 H new ATOM 0 HD2 LYS A 26 17.395 -17.603 -1.523 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.867 -18.806 -2.682 1.00 0.00 H new ATOM 0 HE2 LYS A 26 19.268 -18.997 -2.417 1.00 0.00 H new ATOM 0 HE3 LYS A 26 18.944 -18.389 -4.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 20.710 -17.159 -2.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 19.397 -16.154 -3.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 19.615 -16.685 -1.684 1.00 0.00 H new ATOM 397 N GLU A 27 13.276 -14.693 -1.546 1.00 0.00 N ATOM 398 CA GLU A 27 12.099 -14.487 -0.761 1.00 0.00 C ATOM 399 C GLU A 27 11.129 -13.522 -1.352 1.00 0.00 C ATOM 400 O GLU A 27 9.915 -13.661 -1.218 1.00 0.00 O ATOM 401 CB GLU A 27 12.420 -14.041 0.676 1.00 0.00 C ATOM 402 CG GLU A 27 13.192 -15.118 1.440 1.00 0.00 C ATOM 403 CD GLU A 27 13.634 -14.641 2.815 1.00 0.00 C ATOM 404 OE1 GLU A 27 14.538 -13.763 2.837 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.191 -15.164 3.872 1.00 0.00 O ATOM 0 H GLU A 27 14.130 -14.368 -1.093 1.00 0.00 H new ATOM 0 HA GLU A 27 11.627 -15.469 -0.747 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.005 -13.122 0.650 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.493 -13.814 1.203 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.566 -16.004 1.548 1.00 0.00 H new ATOM 0 HG3 GLU A 27 14.067 -15.415 0.862 1.00 0.00 H new ATOM 412 N LEU A 28 11.633 -12.501 -2.068 1.00 0.00 N ATOM 413 CA LEU A 28 10.878 -11.516 -2.779 1.00 0.00 C ATOM 414 C LEU A 28 10.256 -12.058 -4.020 1.00 0.00 C ATOM 415 O LEU A 28 9.083 -11.943 -4.370 1.00 0.00 O ATOM 416 CB LEU A 28 11.795 -10.313 -3.061 1.00 0.00 C ATOM 417 CG LEU A 28 11.268 -9.097 -3.841 1.00 0.00 C ATOM 418 CD1 LEU A 28 10.063 -8.393 -3.194 1.00 0.00 C ATOM 419 CD2 LEU A 28 12.439 -8.111 -3.989 1.00 0.00 C ATOM 0 H LEU A 28 12.639 -12.354 -2.156 1.00 0.00 H new ATOM 0 HA LEU A 28 10.039 -11.195 -2.162 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.152 -9.948 -2.098 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.664 -10.690 -3.601 1.00 0.00 H new ATOM 0 HG LEU A 28 10.897 -9.453 -4.802 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.760 -7.548 -3.813 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.234 -9.096 -3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.340 -8.035 -2.202 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.106 -7.231 -4.539 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.789 -7.811 -3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.253 -8.592 -4.532 1.00 0.00 H new ATOM 431 N GLY A 29 11.061 -12.879 -4.719 1.00 0.00 N ATOM 432 CA GLY A 29 10.581 -13.695 -5.791 1.00 0.00 C ATOM 433 C GLY A 29 9.539 -14.710 -5.470 1.00 0.00 C ATOM 434 O GLY A 29 8.551 -14.705 -6.203 1.00 0.00 O ATOM 0 H GLY A 29 12.060 -12.978 -4.537 1.00 0.00 H new ATOM 0 HA2 GLY A 29 10.182 -13.036 -6.563 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.434 -14.215 -6.226 1.00 0.00 H new ATOM 438 N THR A 30 9.712 -15.456 -4.364 1.00 0.00 N ATOM 439 CA THR A 30 8.715 -16.296 -3.776 1.00 0.00 C ATOM 440 C THR A 30 7.373 -15.657 -3.665 1.00 0.00 C ATOM 441 O THR A 30 6.323 -16.110 -4.117 1.00 0.00 O ATOM 442 CB THR A 30 9.094 -16.894 -2.454 1.00 0.00 C ATOM 443 OG1 THR A 30 10.258 -17.696 -2.586 1.00 0.00 O ATOM 444 CG2 THR A 30 8.013 -17.738 -1.757 1.00 0.00 C ATOM 0 H THR A 30 10.595 -15.474 -3.853 1.00 0.00 H new ATOM 0 HA THR A 30 8.650 -17.112 -4.496 1.00 0.00 H new ATOM 0 HB THR A 30 9.259 -16.024 -1.819 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.024 -17.127 -2.807 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.401 -18.117 -0.812 1.00 0.00 H new ATOM 0 HG22 THR A 30 7.135 -17.120 -1.567 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.736 -18.575 -2.398 1.00 0.00 H new ATOM 452 N VAL A 31 7.367 -14.450 -3.072 1.00 0.00 N ATOM 453 CA VAL A 31 6.238 -13.589 -2.903 1.00 0.00 C ATOM 454 C VAL A 31 5.441 -13.359 -4.141 1.00 0.00 C ATOM 455 O VAL A 31 4.261 -13.695 -4.232 1.00 0.00 O ATOM 456 CB VAL A 31 6.526 -12.285 -2.220 1.00 0.00 C ATOM 457 CG1 VAL A 31 5.391 -11.247 -2.188 1.00 0.00 C ATOM 458 CG2 VAL A 31 6.787 -12.618 -0.742 1.00 0.00 C ATOM 0 H VAL A 31 8.218 -14.046 -2.681 1.00 0.00 H new ATOM 0 HA VAL A 31 5.620 -14.172 -2.220 1.00 0.00 H new ATOM 0 HB VAL A 31 7.345 -11.842 -2.787 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.731 -10.352 -1.666 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.107 -10.987 -3.208 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.530 -11.666 -1.667 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.003 -11.700 -0.195 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.905 -13.096 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 31 7.638 -13.295 -0.666 1.00 0.00 H new ATOM 468 N MET A 32 6.150 -12.696 -5.072 1.00 0.00 N ATOM 469 CA MET A 32 5.729 -12.212 -6.350 1.00 0.00 C ATOM 470 C MET A 32 5.325 -13.354 -7.219 1.00 0.00 C ATOM 471 O MET A 32 4.304 -13.339 -7.904 1.00 0.00 O ATOM 472 CB MET A 32 6.874 -11.375 -6.944 1.00 0.00 C ATOM 473 CG MET A 32 6.962 -10.026 -6.227 1.00 0.00 C ATOM 474 SD MET A 32 8.411 -9.107 -6.826 1.00 0.00 S ATOM 475 CE MET A 32 7.948 -8.977 -8.578 1.00 0.00 C ATOM 0 H MET A 32 7.132 -12.476 -4.906 1.00 0.00 H new ATOM 0 HA MET A 32 4.851 -11.572 -6.264 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.818 -11.912 -6.844 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.707 -11.220 -8.010 1.00 0.00 H new ATOM 0 HG2 MET A 32 6.054 -9.449 -6.405 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.036 -10.180 -5.150 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.569 -8.225 -9.064 1.00 0.00 H new ATOM 0 HE2 MET A 32 8.096 -9.940 -9.066 1.00 0.00 H new ATOM 0 HE3 MET A 32 6.900 -8.688 -8.657 1.00 0.00 H new ATOM 485 N ARG A 33 6.123 -14.432 -7.321 1.00 0.00 N ATOM 486 CA ARG A 33 5.710 -15.647 -7.951 1.00 0.00 C ATOM 487 C ARG A 33 4.461 -16.288 -7.453 1.00 0.00 C ATOM 488 O ARG A 33 3.604 -16.697 -8.236 1.00 0.00 O ATOM 489 CB ARG A 33 6.803 -16.721 -7.824 1.00 0.00 C ATOM 490 CG ARG A 33 6.640 -17.956 -8.713 1.00 0.00 C ATOM 491 CD ARG A 33 7.855 -18.883 -8.783 1.00 0.00 C ATOM 492 NE ARG A 33 8.254 -19.283 -7.405 1.00 0.00 N ATOM 493 CZ ARG A 33 9.370 -18.946 -6.694 1.00 0.00 C ATOM 494 NH1 ARG A 33 10.096 -17.844 -7.043 1.00 0.00 N ATOM 495 NH2 ARG A 33 9.591 -19.502 -5.467 1.00 0.00 N ATOM 0 H ARG A 33 7.076 -14.460 -6.958 1.00 0.00 H new ATOM 0 HA ARG A 33 5.518 -15.315 -8.971 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.765 -16.260 -8.050 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.843 -17.049 -6.785 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.787 -18.531 -8.353 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.399 -17.625 -9.723 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.618 -19.767 -9.375 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.683 -18.378 -9.281 1.00 0.00 H new ATOM 0 HE ARG A 33 7.599 -19.898 -6.922 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.805 -17.272 -7.835 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.929 -17.593 -6.511 1.00 0.00 H new ATOM 0 HH21 ARG A 33 8.923 -20.169 -5.081 1.00 0.00 H new ATOM 0 HH22 ARG A 33 10.425 -19.250 -4.936 1.00 0.00 H new ATOM 509 N SER A 34 4.194 -16.179 -6.139 1.00 0.00 N ATOM 510 CA SER A 34 2.997 -16.730 -5.583 1.00 0.00 C ATOM 511 C SER A 34 1.753 -15.996 -5.950 1.00 0.00 C ATOM 512 O SER A 34 0.639 -16.506 -6.060 1.00 0.00 O ATOM 513 CB SER A 34 2.980 -16.862 -4.051 1.00 0.00 C ATOM 514 OG SER A 34 4.009 -17.713 -3.567 1.00 0.00 O ATOM 0 H SER A 34 4.802 -15.713 -5.466 1.00 0.00 H new ATOM 0 HA SER A 34 3.008 -17.722 -6.035 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.089 -15.874 -3.603 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.012 -17.251 -3.734 1.00 0.00 H new ATOM 0 HG SER A 34 4.879 -17.281 -3.696 1.00 0.00 H new ATOM 520 N LEU A 35 2.038 -14.696 -6.139 1.00 0.00 N ATOM 521 CA LEU A 35 1.091 -13.812 -6.746 1.00 0.00 C ATOM 522 C LEU A 35 0.700 -14.009 -8.170 1.00 0.00 C ATOM 523 O LEU A 35 -0.452 -13.888 -8.584 1.00 0.00 O ATOM 524 CB LEU A 35 1.436 -12.317 -6.638 1.00 0.00 C ATOM 525 CG LEU A 35 1.669 -11.791 -5.212 1.00 0.00 C ATOM 526 CD1 LEU A 35 2.177 -10.341 -5.130 1.00 0.00 C ATOM 527 CD2 LEU A 35 0.364 -11.903 -4.406 1.00 0.00 C ATOM 0 H LEU A 35 2.920 -14.258 -5.873 1.00 0.00 H new ATOM 0 HA LEU A 35 0.248 -14.112 -6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.333 -12.126 -7.228 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.628 -11.742 -7.091 1.00 0.00 H new ATOM 0 HG LEU A 35 2.461 -12.415 -4.798 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.311 -10.061 -4.085 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.130 -10.259 -5.653 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.450 -9.674 -5.594 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.528 -11.530 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.414 -11.312 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.052 -12.946 -4.362 1.00 0.00 H new ATOM 539 N GLY A 36 1.721 -14.287 -9.001 1.00 0.00 N ATOM 540 CA GLY A 36 1.434 -14.404 -10.397 1.00 0.00 C ATOM 541 C GLY A 36 2.533 -14.023 -11.328 1.00 0.00 C ATOM 542 O GLY A 36 2.404 -14.377 -12.499 1.00 0.00 O ATOM 0 H GLY A 36 2.694 -14.424 -8.728 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.152 -15.436 -10.604 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.565 -13.785 -10.621 1.00 0.00 H new ATOM 546 N GLN A 37 3.575 -13.271 -10.929 1.00 0.00 N ATOM 547 CA GLN A 37 4.510 -12.626 -11.797 1.00 0.00 C ATOM 548 C GLN A 37 5.634 -13.581 -12.011 1.00 0.00 C ATOM 549 O GLN A 37 5.875 -14.516 -11.250 1.00 0.00 O ATOM 550 CB GLN A 37 4.963 -11.252 -11.273 1.00 0.00 C ATOM 551 CG GLN A 37 3.992 -10.070 -11.273 1.00 0.00 C ATOM 552 CD GLN A 37 2.699 -10.315 -10.508 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.747 -10.454 -9.287 1.00 0.00 O ATOM 554 NE2 GLN A 37 1.535 -10.305 -11.211 1.00 0.00 N ATOM 0 H GLN A 37 3.775 -13.104 -9.943 1.00 0.00 H new ATOM 0 HA GLN A 37 4.041 -12.390 -12.752 1.00 0.00 H new ATOM 0 HB2 GLN A 37 5.300 -11.393 -10.246 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.834 -10.955 -11.857 1.00 0.00 H new ATOM 0 HG2 GLN A 37 4.495 -9.203 -10.844 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.747 -9.818 -12.305 1.00 0.00 H new ATOM 0 HE21 GLN A 37 1.552 -10.186 -12.224 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.645 -10.416 -10.725 1.00 0.00 H new ATOM 563 N ASN A 38 6.435 -13.306 -13.056 1.00 0.00 N ATOM 564 CA ASN A 38 7.710 -13.897 -13.318 1.00 0.00 C ATOM 565 C ASN A 38 8.685 -12.774 -13.403 1.00 0.00 C ATOM 566 O ASN A 38 9.114 -12.502 -14.523 1.00 0.00 O ATOM 567 CB ASN A 38 7.631 -14.599 -14.684 1.00 0.00 C ATOM 568 CG ASN A 38 6.804 -15.860 -14.479 1.00 0.00 C ATOM 569 OD1 ASN A 38 7.134 -16.683 -13.627 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.647 -16.023 -15.175 1.00 0.00 N ATOM 0 H ASN A 38 6.172 -12.623 -13.766 1.00 0.00 H new ATOM 0 HA ASN A 38 8.001 -14.614 -12.550 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.169 -13.949 -15.427 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.627 -14.845 -15.051 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.050 -16.830 -14.991 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.376 -15.339 -15.881 1.00 0.00 H new ATOM 577 N PRO A 39 9.251 -12.225 -12.369 1.00 0.00 N ATOM 578 CA PRO A 39 10.424 -11.402 -12.428 1.00 0.00 C ATOM 579 C PRO A 39 11.663 -12.164 -12.750 1.00 0.00 C ATOM 580 O PRO A 39 11.702 -13.350 -12.427 1.00 0.00 O ATOM 581 CB PRO A 39 10.472 -10.762 -11.042 1.00 0.00 C ATOM 582 CG PRO A 39 10.025 -11.901 -10.113 1.00 0.00 C ATOM 583 CD PRO A 39 8.906 -12.497 -10.982 1.00 0.00 C ATOM 0 HA PRO A 39 10.374 -10.669 -13.233 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.474 -10.411 -10.795 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.807 -9.901 -10.973 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.823 -12.614 -9.907 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.663 -11.541 -9.150 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.815 -13.570 -10.811 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.944 -12.051 -10.730 1.00 0.00 H new ATOM 591 N THR A 40 12.697 -11.540 -13.342 1.00 0.00 N ATOM 592 CA THR A 40 13.980 -12.152 -13.497 1.00 0.00 C ATOM 593 C THR A 40 14.771 -11.789 -12.287 1.00 0.00 C ATOM 594 O THR A 40 14.593 -10.721 -11.703 1.00 0.00 O ATOM 595 CB THR A 40 14.753 -11.697 -14.699 1.00 0.00 C ATOM 596 OG1 THR A 40 15.002 -10.299 -14.704 1.00 0.00 O ATOM 597 CG2 THR A 40 13.831 -11.951 -15.903 1.00 0.00 C ATOM 0 H THR A 40 12.641 -10.594 -13.720 1.00 0.00 H new ATOM 0 HA THR A 40 13.817 -13.222 -13.627 1.00 0.00 H new ATOM 0 HB THR A 40 15.708 -12.222 -14.714 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.509 -10.060 -15.508 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.334 -11.640 -16.819 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.594 -13.013 -15.962 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.910 -11.380 -15.783 1.00 0.00 H new ATOM 605 N GLU A 41 15.725 -12.670 -11.940 1.00 0.00 N ATOM 606 CA GLU A 41 16.743 -12.427 -10.965 1.00 0.00 C ATOM 607 C GLU A 41 17.454 -11.132 -11.153 1.00 0.00 C ATOM 608 O GLU A 41 17.742 -10.486 -10.147 1.00 0.00 O ATOM 609 CB GLU A 41 17.715 -13.604 -10.777 1.00 0.00 C ATOM 610 CG GLU A 41 17.041 -14.785 -10.075 1.00 0.00 C ATOM 611 CD GLU A 41 16.218 -15.604 -11.059 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.850 -16.034 -12.060 1.00 0.00 O ATOM 613 OE2 GLU A 41 15.058 -15.939 -10.699 1.00 0.00 O ATOM 0 H GLU A 41 15.790 -13.597 -12.360 1.00 0.00 H new ATOM 0 HA GLU A 41 16.198 -12.337 -10.025 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.092 -13.924 -11.748 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.576 -13.276 -10.194 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.798 -15.418 -9.612 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.399 -14.419 -9.274 1.00 0.00 H new ATOM 620 N ALA A 42 17.718 -10.773 -12.423 1.00 0.00 N ATOM 621 CA ALA A 42 18.384 -9.536 -12.690 1.00 0.00 C ATOM 622 C ALA A 42 17.621 -8.314 -12.311 1.00 0.00 C ATOM 623 O ALA A 42 18.174 -7.318 -11.846 1.00 0.00 O ATOM 624 CB ALA A 42 18.729 -9.331 -14.175 1.00 0.00 C ATOM 0 H ALA A 42 17.477 -11.324 -13.247 1.00 0.00 H new ATOM 0 HA ALA A 42 19.275 -9.641 -12.070 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.232 -8.373 -14.303 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.386 -10.133 -14.510 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.813 -9.342 -14.766 1.00 0.00 H new ATOM 630 N GLU A 43 16.279 -8.349 -12.397 1.00 0.00 N ATOM 631 CA GLU A 43 15.400 -7.289 -12.009 1.00 0.00 C ATOM 632 C GLU A 43 15.270 -7.318 -10.524 1.00 0.00 C ATOM 633 O GLU A 43 15.277 -6.238 -9.936 1.00 0.00 O ATOM 634 CB GLU A 43 14.071 -7.458 -12.764 1.00 0.00 C ATOM 635 CG GLU A 43 13.012 -6.438 -12.340 1.00 0.00 C ATOM 636 CD GLU A 43 11.859 -6.468 -13.333 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.874 -6.167 -14.557 1.00 0.00 O ATOM 638 OE2 GLU A 43 10.739 -6.800 -12.862 1.00 0.00 O ATOM 0 H GLU A 43 15.780 -9.162 -12.757 1.00 0.00 H new ATOM 0 HA GLU A 43 15.782 -6.303 -12.274 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.252 -7.362 -13.835 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.688 -8.464 -12.594 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.650 -6.668 -11.338 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.447 -5.439 -12.301 1.00 0.00 H new ATOM 645 N LEU A 44 15.131 -8.493 -9.885 1.00 0.00 N ATOM 646 CA LEU A 44 14.942 -8.649 -8.476 1.00 0.00 C ATOM 647 C LEU A 44 16.066 -8.115 -7.656 1.00 0.00 C ATOM 648 O LEU A 44 15.896 -7.414 -6.660 1.00 0.00 O ATOM 649 CB LEU A 44 14.595 -10.052 -7.951 1.00 0.00 C ATOM 650 CG LEU A 44 13.200 -10.594 -8.306 1.00 0.00 C ATOM 651 CD1 LEU A 44 13.017 -12.048 -7.840 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.148 -9.634 -7.724 1.00 0.00 C ATOM 0 H LEU A 44 15.152 -9.385 -10.380 1.00 0.00 H new ATOM 0 HA LEU A 44 14.044 -8.044 -8.349 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.339 -10.752 -8.331 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.691 -10.043 -6.865 1.00 0.00 H new ATOM 0 HG LEU A 44 13.076 -10.631 -9.388 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.019 -12.394 -8.110 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.763 -12.681 -8.321 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.140 -12.102 -6.758 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.150 -9.999 -7.964 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.264 -9.580 -6.642 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.284 -8.641 -8.153 1.00 0.00 H new ATOM 664 N GLN A 45 17.329 -8.288 -8.084 1.00 0.00 N ATOM 665 CA GLN A 45 18.523 -7.734 -7.525 1.00 0.00 C ATOM 666 C GLN A 45 18.521 -6.267 -7.783 1.00 0.00 C ATOM 667 O GLN A 45 18.835 -5.496 -6.877 1.00 0.00 O ATOM 668 CB GLN A 45 19.869 -8.355 -7.935 1.00 0.00 C ATOM 669 CG GLN A 45 20.316 -8.122 -9.380 1.00 0.00 C ATOM 670 CD GLN A 45 21.507 -9.020 -9.679 1.00 0.00 C ATOM 671 OE1 GLN A 45 21.260 -10.095 -10.223 1.00 0.00 O ATOM 672 NE2 GLN A 45 22.796 -8.713 -9.373 1.00 0.00 N ATOM 0 H GLN A 45 17.531 -8.870 -8.897 1.00 0.00 H new ATOM 0 HA GLN A 45 18.473 -7.981 -6.465 1.00 0.00 H new ATOM 0 HB2 GLN A 45 20.641 -7.965 -7.272 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.815 -9.430 -7.764 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.498 -8.339 -10.067 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.586 -7.076 -9.527 1.00 0.00 H new ATOM 0 HE21 GLN A 45 23.015 -7.825 -8.922 1.00 0.00 H new ATOM 0 HE22 GLN A 45 23.543 -9.371 -9.595 1.00 0.00 H new ATOM 681 N ASP A 46 18.208 -5.768 -8.992 1.00 0.00 N ATOM 682 CA ASP A 46 18.188 -4.378 -9.326 1.00 0.00 C ATOM 683 C ASP A 46 17.181 -3.633 -8.518 1.00 0.00 C ATOM 684 O ASP A 46 17.448 -2.487 -8.161 1.00 0.00 O ATOM 685 CB ASP A 46 17.939 -4.390 -10.843 1.00 0.00 C ATOM 686 CG ASP A 46 18.111 -3.033 -11.510 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.153 -2.335 -11.392 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.092 -2.591 -12.104 1.00 0.00 O ATOM 0 H ASP A 46 17.955 -6.367 -9.778 1.00 0.00 H new ATOM 0 HA ASP A 46 19.107 -3.842 -9.090 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.623 -5.101 -11.307 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.928 -4.751 -11.032 1.00 0.00 H new ATOM 693 N MET A 47 16.027 -4.235 -8.179 1.00 0.00 N ATOM 694 CA MET A 47 15.053 -3.743 -7.256 1.00 0.00 C ATOM 695 C MET A 47 15.655 -3.380 -5.942 1.00 0.00 C ATOM 696 O MET A 47 15.491 -2.271 -5.435 1.00 0.00 O ATOM 697 CB MET A 47 13.901 -4.735 -7.018 1.00 0.00 C ATOM 698 CG MET A 47 12.713 -4.032 -6.359 1.00 0.00 C ATOM 699 SD MET A 47 11.378 -5.184 -5.914 1.00 0.00 S ATOM 700 CE MET A 47 11.149 -5.917 -7.559 1.00 0.00 C ATOM 0 H MET A 47 15.756 -5.132 -8.581 1.00 0.00 H new ATOM 0 HA MET A 47 14.648 -2.847 -7.726 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.590 -5.174 -7.966 1.00 0.00 H new ATOM 0 HB3 MET A 47 14.243 -5.553 -6.385 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.054 -3.513 -5.463 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.322 -3.274 -7.037 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.269 -6.561 -7.551 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.012 -5.124 -8.295 1.00 0.00 H new ATOM 0 HE3 MET A 47 12.028 -6.507 -7.820 1.00 0.00 H new ATOM 710 N ILE A 48 16.421 -4.277 -5.297 1.00 0.00 N ATOM 711 CA ILE A 48 17.035 -4.197 -4.008 1.00 0.00 C ATOM 712 C ILE A 48 18.158 -3.218 -3.954 1.00 0.00 C ATOM 713 O ILE A 48 18.247 -2.398 -3.042 1.00 0.00 O ATOM 714 CB ILE A 48 17.403 -5.506 -3.375 1.00 0.00 C ATOM 715 CG1 ILE A 48 16.202 -6.450 -3.202 1.00 0.00 C ATOM 716 CG2 ILE A 48 18.242 -5.414 -2.089 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.540 -7.797 -2.564 1.00 0.00 C ATOM 0 H ILE A 48 16.634 -5.171 -5.740 1.00 0.00 H new ATOM 0 HA ILE A 48 16.230 -3.812 -3.382 1.00 0.00 H new ATOM 0 HB ILE A 48 18.074 -5.950 -4.110 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.450 -5.952 -2.591 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.752 -6.628 -4.179 1.00 0.00 H new ATOM 0 HG21 ILE A 48 18.450 -6.417 -1.718 1.00 0.00 H new ATOM 0 HG22 ILE A 48 19.181 -4.904 -2.303 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.690 -4.855 -1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.634 -8.398 -2.481 1.00 0.00 H new ATOM 0 HD12 ILE A 48 17.267 -8.321 -3.184 1.00 0.00 H new ATOM 0 HD13 ILE A 48 16.960 -7.634 -1.571 1.00 0.00 H new ATOM 729 N ASN A 49 19.069 -3.187 -4.943 1.00 0.00 N ATOM 730 CA ASN A 49 20.091 -2.196 -5.083 1.00 0.00 C ATOM 731 C ASN A 49 19.784 -0.764 -4.814 1.00 0.00 C ATOM 732 O ASN A 49 20.594 -0.082 -4.187 1.00 0.00 O ATOM 733 CB ASN A 49 20.827 -2.253 -6.432 1.00 0.00 C ATOM 734 CG ASN A 49 21.348 -3.659 -6.691 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.303 -4.100 -7.838 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.947 -4.313 -5.660 1.00 0.00 N ATOM 0 H ASN A 49 19.094 -3.889 -5.683 1.00 0.00 H new ATOM 0 HA ASN A 49 20.709 -2.520 -4.246 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.153 -1.954 -7.235 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.656 -1.545 -6.432 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.390 -5.218 -5.819 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.954 -3.898 -4.728 1.00 0.00 H new ATOM 743 N GLU A 50 18.666 -0.180 -5.282 1.00 0.00 N ATOM 744 CA GLU A 50 18.305 1.168 -4.970 1.00 0.00 C ATOM 745 C GLU A 50 18.013 1.537 -3.556 1.00 0.00 C ATOM 746 O GLU A 50 18.204 2.648 -3.064 1.00 0.00 O ATOM 747 CB GLU A 50 17.144 1.528 -5.913 1.00 0.00 C ATOM 748 CG GLU A 50 16.789 3.016 -5.959 1.00 0.00 C ATOM 749 CD GLU A 50 15.965 3.368 -7.190 1.00 0.00 C ATOM 750 OE1 GLU A 50 16.452 3.311 -8.350 1.00 0.00 O ATOM 751 OE2 GLU A 50 14.797 3.773 -6.946 1.00 0.00 O ATOM 0 H GLU A 50 17.999 -0.655 -5.890 1.00 0.00 H new ATOM 0 HA GLU A 50 19.206 1.763 -5.122 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.398 1.199 -6.921 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.260 0.968 -5.608 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.232 3.284 -5.061 1.00 0.00 H new ATOM 0 HG3 GLU A 50 17.705 3.607 -5.954 1.00 0.00 H new ATOM 758 N VAL A 51 17.341 0.583 -2.888 1.00 0.00 N ATOM 759 CA VAL A 51 16.803 0.653 -1.565 1.00 0.00 C ATOM 760 C VAL A 51 17.695 0.107 -0.503 1.00 0.00 C ATOM 761 O VAL A 51 17.476 0.470 0.651 1.00 0.00 O ATOM 762 CB VAL A 51 15.364 0.234 -1.507 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.519 0.967 -2.562 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.124 -1.272 -1.706 1.00 0.00 C ATOM 0 H VAL A 51 17.158 -0.324 -3.318 1.00 0.00 H new ATOM 0 HA VAL A 51 16.780 1.710 -1.300 1.00 0.00 H new ATOM 0 HB VAL A 51 15.063 0.499 -0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.482 0.638 -2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.572 2.042 -2.388 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.903 0.741 -3.557 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.056 -1.481 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.500 -1.574 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.645 -1.829 -0.928 1.00 0.00 H new ATOM 774 N ASP A 52 18.716 -0.713 -0.810 1.00 0.00 N ATOM 775 CA ASP A 52 19.730 -1.203 0.072 1.00 0.00 C ATOM 776 C ASP A 52 20.751 -0.164 0.383 1.00 0.00 C ATOM 777 O ASP A 52 21.785 -0.066 -0.275 1.00 0.00 O ATOM 778 CB ASP A 52 20.247 -2.510 -0.552 1.00 0.00 C ATOM 779 CG ASP A 52 21.260 -3.196 0.354 1.00 0.00 C ATOM 780 OD1 ASP A 52 21.488 -2.702 1.490 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.812 -4.239 -0.087 1.00 0.00 O ATOM 0 H ASP A 52 18.841 -1.063 -1.760 1.00 0.00 H new ATOM 0 HA ASP A 52 19.348 -1.435 1.066 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.409 -3.182 -0.738 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.706 -2.297 -1.518 1.00 0.00 H new ATOM 786 N ALA A 53 20.448 0.601 1.447 1.00 0.00 N ATOM 787 CA ALA A 53 21.425 1.492 1.990 1.00 0.00 C ATOM 788 C ALA A 53 22.799 1.005 2.298 1.00 0.00 C ATOM 789 O ALA A 53 23.801 1.640 1.973 1.00 0.00 O ATOM 790 CB ALA A 53 20.701 2.042 3.231 1.00 0.00 C ATOM 0 H ALA A 53 19.546 0.604 1.923 1.00 0.00 H new ATOM 0 HA ALA A 53 21.707 2.211 1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.350 2.749 3.748 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.786 2.548 2.924 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.453 1.220 3.902 1.00 0.00 H new ATOM 796 N ASP A 54 22.946 -0.083 3.074 1.00 0.00 N ATOM 797 CA ASP A 54 24.242 -0.588 3.407 1.00 0.00 C ATOM 798 C ASP A 54 24.971 -1.219 2.271 1.00 0.00 C ATOM 799 O ASP A 54 26.152 -0.988 2.016 1.00 0.00 O ATOM 800 CB ASP A 54 24.332 -1.349 4.740 1.00 0.00 C ATOM 801 CG ASP A 54 23.434 -2.578 4.773 1.00 0.00 C ATOM 802 OD1 ASP A 54 23.246 -3.329 3.779 1.00 0.00 O ATOM 803 OD2 ASP A 54 22.899 -2.848 5.881 1.00 0.00 O ATOM 0 H ASP A 54 22.170 -0.612 3.470 1.00 0.00 H new ATOM 0 HA ASP A 54 24.815 0.316 3.612 1.00 0.00 H new ATOM 0 HB2 ASP A 54 25.365 -1.653 4.912 1.00 0.00 H new ATOM 0 HB3 ASP A 54 24.057 -0.680 5.556 1.00 0.00 H new ATOM 808 N GLY A 55 24.226 -1.893 1.377 1.00 0.00 N ATOM 809 CA GLY A 55 24.739 -2.499 0.187 1.00 0.00 C ATOM 810 C GLY A 55 25.207 -3.868 0.544 1.00 0.00 C ATOM 811 O GLY A 55 26.183 -4.392 0.010 1.00 0.00 O ATOM 0 H GLY A 55 23.220 -2.021 1.489 1.00 0.00 H new ATOM 0 HA2 GLY A 55 23.968 -2.546 -0.582 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.559 -1.908 -0.221 1.00 0.00 H new ATOM 815 N ASN A 56 24.462 -4.626 1.368 1.00 0.00 N ATOM 816 CA ASN A 56 24.897 -5.900 1.850 1.00 0.00 C ATOM 817 C ASN A 56 24.355 -6.882 0.868 1.00 0.00 C ATOM 818 O ASN A 56 25.084 -7.829 0.577 1.00 0.00 O ATOM 819 CB ASN A 56 24.448 -6.180 3.294 1.00 0.00 C ATOM 820 CG ASN A 56 22.975 -6.529 3.452 1.00 0.00 C ATOM 821 OD1 ASN A 56 22.045 -5.874 2.985 1.00 0.00 O ATOM 822 ND2 ASN A 56 22.707 -7.685 4.117 1.00 0.00 N ATOM 0 H ASN A 56 23.540 -4.349 1.706 1.00 0.00 H new ATOM 0 HA ASN A 56 25.984 -5.957 1.914 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.045 -7.000 3.692 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.666 -5.303 3.903 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.743 -8.000 4.224 1.00 0.00 H new ATOM 0 HD22 ASN A 56 23.470 -8.237 4.509 1.00 0.00 H new ATOM 829 N GLY A 57 23.099 -6.775 0.401 1.00 0.00 N ATOM 830 CA GLY A 57 22.534 -7.698 -0.535 1.00 0.00 C ATOM 831 C GLY A 57 21.080 -7.925 -0.303 1.00 0.00 C ATOM 832 O GLY A 57 20.270 -8.560 -0.977 1.00 0.00 O ATOM 0 H GLY A 57 22.460 -6.030 0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 57 22.683 -7.322 -1.547 1.00 0.00 H new ATOM 0 HA3 GLY A 57 23.063 -8.649 -0.467 1.00 0.00 H new ATOM 836 N THR A 58 20.695 -7.331 0.841 1.00 0.00 N ATOM 837 CA THR A 58 19.341 -7.478 1.276 1.00 0.00 C ATOM 838 C THR A 58 18.658 -6.187 1.571 1.00 0.00 C ATOM 839 O THR A 58 19.328 -5.227 1.947 1.00 0.00 O ATOM 840 CB THR A 58 19.080 -8.445 2.393 1.00 0.00 C ATOM 841 OG1 THR A 58 19.907 -8.398 3.546 1.00 0.00 O ATOM 842 CG2 THR A 58 19.415 -9.821 1.795 1.00 0.00 C ATOM 0 H THR A 58 21.295 -6.769 1.445 1.00 0.00 H new ATOM 0 HA THR A 58 18.902 -7.930 0.387 1.00 0.00 H new ATOM 0 HB THR A 58 18.067 -8.219 2.727 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.725 -9.177 4.111 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.252 -10.594 2.546 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.773 -10.010 0.935 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.458 -9.836 1.479 1.00 0.00 H new ATOM 850 N ILE A 59 17.343 -6.113 1.297 1.00 0.00 N ATOM 851 CA ILE A 59 16.493 -5.144 1.915 1.00 0.00 C ATOM 852 C ILE A 59 16.191 -5.605 3.299 1.00 0.00 C ATOM 853 O ILE A 59 15.534 -6.622 3.517 1.00 0.00 O ATOM 854 CB ILE A 59 15.249 -4.773 1.163 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.155 -4.049 1.966 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.600 -5.958 0.428 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.174 -3.221 1.138 1.00 0.00 C ATOM 0 H ILE A 59 16.865 -6.731 0.641 1.00 0.00 H new ATOM 0 HA ILE A 59 17.048 -4.206 1.921 1.00 0.00 H new ATOM 0 HB ILE A 59 15.648 -4.055 0.447 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.591 -4.791 2.531 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.635 -3.393 2.692 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.706 -5.617 -0.094 1.00 0.00 H new ATOM 0 HG22 ILE A 59 15.306 -6.370 -0.293 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.327 -6.728 1.149 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.445 -2.753 1.799 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.718 -2.449 0.594 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.658 -3.869 0.430 1.00 0.00 H new ATOM 869 N ASP A 60 16.760 -4.789 4.205 1.00 0.00 N ATOM 870 CA ASP A 60 16.568 -4.855 5.620 1.00 0.00 C ATOM 871 C ASP A 60 15.320 -4.125 5.982 1.00 0.00 C ATOM 872 O ASP A 60 14.652 -3.472 5.183 1.00 0.00 O ATOM 873 CB ASP A 60 17.729 -4.224 6.406 1.00 0.00 C ATOM 874 CG ASP A 60 19.021 -5.025 6.319 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.632 -4.873 5.228 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.359 -5.761 7.284 1.00 0.00 O ATOM 0 H ASP A 60 17.393 -4.037 3.931 1.00 0.00 H new ATOM 0 HA ASP A 60 16.510 -5.911 5.883 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.908 -3.217 6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.440 -4.127 7.452 1.00 0.00 H new ATOM 881 N PHE A 61 15.019 -4.181 7.292 1.00 0.00 N ATOM 882 CA PHE A 61 13.868 -3.467 7.748 1.00 0.00 C ATOM 883 C PHE A 61 14.025 -1.985 7.725 1.00 0.00 C ATOM 884 O PHE A 61 13.010 -1.394 7.358 1.00 0.00 O ATOM 885 CB PHE A 61 13.480 -4.022 9.128 1.00 0.00 C ATOM 886 CG PHE A 61 12.147 -3.544 9.593 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.006 -3.581 8.828 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.093 -3.048 10.875 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.813 -3.119 9.332 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.869 -2.662 11.368 1.00 0.00 C ATOM 891 CZ PHE A 61 9.725 -2.613 10.608 1.00 0.00 C ATOM 0 H PHE A 61 15.542 -4.692 8.003 1.00 0.00 H new ATOM 0 HA PHE A 61 13.049 -3.633 7.048 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.476 -5.111 9.088 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.238 -3.733 9.856 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.047 -3.976 7.824 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.986 -2.964 11.477 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.928 -3.154 8.714 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.803 -2.382 12.409 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.805 -2.199 10.993 1.00 0.00 H new ATOM 901 N PRO A 62 15.032 -1.298 8.176 1.00 0.00 N ATOM 902 CA PRO A 62 14.935 0.133 8.176 1.00 0.00 C ATOM 903 C PRO A 62 15.066 0.777 6.840 1.00 0.00 C ATOM 904 O PRO A 62 14.776 1.967 6.722 1.00 0.00 O ATOM 905 CB PRO A 62 15.981 0.595 9.189 1.00 0.00 C ATOM 906 CG PRO A 62 16.886 -0.607 9.499 1.00 0.00 C ATOM 907 CD PRO A 62 15.939 -1.782 9.207 1.00 0.00 C ATOM 0 HA PRO A 62 13.930 0.447 8.456 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.566 1.422 8.786 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.501 0.958 10.098 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.773 -0.627 8.866 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.232 -0.605 10.533 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.492 -2.657 8.865 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.394 -2.079 10.103 1.00 0.00 H new ATOM 915 N GLU A 63 15.457 0.001 5.814 1.00 0.00 N ATOM 916 CA GLU A 63 15.564 0.370 4.436 1.00 0.00 C ATOM 917 C GLU A 63 14.256 0.229 3.737 1.00 0.00 C ATOM 918 O GLU A 63 13.951 1.034 2.858 1.00 0.00 O ATOM 919 CB GLU A 63 16.570 -0.606 3.803 1.00 0.00 C ATOM 920 CG GLU A 63 17.944 -0.538 4.473 1.00 0.00 C ATOM 921 CD GLU A 63 18.907 -1.602 3.966 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.469 -2.565 3.281 1.00 0.00 O ATOM 923 OE2 GLU A 63 20.130 -1.537 4.260 1.00 0.00 O ATOM 0 H GLU A 63 15.722 -0.972 5.964 1.00 0.00 H new ATOM 0 HA GLU A 63 15.879 1.410 4.349 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.182 -1.622 3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.674 -0.380 2.742 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.377 0.447 4.302 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.822 -0.650 5.550 1.00 0.00 H new ATOM 930 N PHE A 64 13.460 -0.772 4.153 1.00 0.00 N ATOM 931 CA PHE A 64 12.055 -0.872 3.906 1.00 0.00 C ATOM 932 C PHE A 64 11.432 0.370 4.443 1.00 0.00 C ATOM 933 O PHE A 64 10.584 1.053 3.871 1.00 0.00 O ATOM 934 CB PHE A 64 11.423 -2.168 4.443 1.00 0.00 C ATOM 935 CG PHE A 64 9.989 -2.327 4.070 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.639 -3.010 2.929 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.995 -1.890 4.913 1.00 0.00 C ATOM 938 CE1 PHE A 64 8.345 -3.417 2.705 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.688 -2.287 4.755 1.00 0.00 C ATOM 940 CZ PHE A 64 7.413 -3.060 3.651 1.00 0.00 C ATOM 0 H PHE A 64 13.819 -1.558 4.694 1.00 0.00 H new ATOM 0 HA PHE A 64 11.869 -0.947 2.835 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.986 -3.021 4.065 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.512 -2.184 5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.397 -3.232 2.193 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.247 -1.218 5.720 1.00 0.00 H new ATOM 0 HE1 PHE A 64 8.074 -3.989 1.830 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.919 -2.007 5.460 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.400 -3.409 3.519 1.00 0.00 H new ATOM 950 N LEU A 65 11.637 0.673 5.738 1.00 0.00 N ATOM 951 CA LEU A 65 11.102 1.809 6.422 1.00 0.00 C ATOM 952 C LEU A 65 11.315 3.163 5.840 1.00 0.00 C ATOM 953 O LEU A 65 10.456 4.034 5.966 1.00 0.00 O ATOM 954 CB LEU A 65 11.334 1.933 7.937 1.00 0.00 C ATOM 955 CG LEU A 65 10.736 0.792 8.779 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.181 0.879 10.248 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.202 0.819 8.879 1.00 0.00 C ATOM 0 H LEU A 65 12.212 0.088 6.344 1.00 0.00 H new ATOM 0 HA LEU A 65 10.070 1.507 6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.407 1.979 8.123 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.911 2.878 8.279 1.00 0.00 H new ATOM 0 HG LEU A 65 11.086 -0.101 8.261 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.739 0.057 10.811 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.268 0.814 10.303 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.852 1.828 10.672 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.862 -0.018 9.489 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.884 1.755 9.338 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.771 0.739 7.881 1.00 0.00 H new ATOM 969 N THR A 66 12.531 3.314 5.284 1.00 0.00 N ATOM 970 CA THR A 66 12.931 4.530 4.647 1.00 0.00 C ATOM 971 C THR A 66 12.323 4.642 3.291 1.00 0.00 C ATOM 972 O THR A 66 12.238 5.721 2.707 1.00 0.00 O ATOM 973 CB THR A 66 14.421 4.627 4.503 1.00 0.00 C ATOM 974 OG1 THR A 66 14.964 4.529 5.812 1.00 0.00 O ATOM 975 CG2 THR A 66 14.923 5.943 3.887 1.00 0.00 C ATOM 0 H THR A 66 13.244 2.585 5.276 1.00 0.00 H new ATOM 0 HA THR A 66 12.582 5.341 5.286 1.00 0.00 H new ATOM 0 HB THR A 66 14.734 3.833 3.825 1.00 0.00 H new ATOM 0 HG1 THR A 66 15.022 3.586 6.073 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.011 5.923 3.822 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.502 6.061 2.889 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.612 6.780 4.513 1.00 0.00 H new ATOM 983 N MET A 67 11.919 3.525 2.662 1.00 0.00 N ATOM 984 CA MET A 67 11.084 3.501 1.501 1.00 0.00 C ATOM 985 C MET A 67 9.669 3.835 1.828 1.00 0.00 C ATOM 986 O MET A 67 9.213 4.955 1.605 1.00 0.00 O ATOM 987 CB MET A 67 11.248 2.155 0.775 1.00 0.00 C ATOM 988 CG MET A 67 10.529 2.039 -0.570 1.00 0.00 C ATOM 989 SD MET A 67 10.977 0.467 -1.365 1.00 0.00 S ATOM 990 CE MET A 67 10.236 1.145 -2.878 1.00 0.00 C ATOM 0 H MET A 67 12.187 2.593 2.978 1.00 0.00 H new ATOM 0 HA MET A 67 11.403 4.283 0.812 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.311 1.976 0.615 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.886 1.363 1.430 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.450 2.090 -0.423 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.803 2.875 -1.214 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.753 0.344 -3.437 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.496 1.900 -2.614 1.00 0.00 H new ATOM 0 HE3 MET A 67 11.014 1.599 -3.492 1.00 0.00 H new ATOM 1000 N MET A 68 8.997 2.925 2.557 1.00 0.00 N ATOM 1001 CA MET A 68 7.575 2.965 2.701 1.00 0.00 C ATOM 1002 C MET A 68 6.974 4.034 3.547 1.00 0.00 C ATOM 1003 O MET A 68 5.842 4.406 3.242 1.00 0.00 O ATOM 1004 CB MET A 68 6.994 1.624 3.180 1.00 0.00 C ATOM 1005 CG MET A 68 7.436 0.417 2.350 1.00 0.00 C ATOM 1006 SD MET A 68 6.955 0.612 0.608 1.00 0.00 S ATOM 1007 CE MET A 68 7.842 -0.888 0.098 1.00 0.00 C ATOM 0 H MET A 68 9.445 2.154 3.051 1.00 0.00 H new ATOM 0 HA MET A 68 7.294 3.205 1.676 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.287 1.464 4.218 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.906 1.685 3.161 1.00 0.00 H new ATOM 0 HG2 MET A 68 8.517 0.299 2.421 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.989 -0.491 2.755 1.00 0.00 H new ATOM 0 HE1 MET A 68 7.873 -0.940 -0.990 1.00 0.00 H new ATOM 0 HE2 MET A 68 8.859 -0.860 0.489 1.00 0.00 H new ATOM 0 HE3 MET A 68 7.327 -1.766 0.489 1.00 0.00 H new ATOM 1017 N ALA A 69 7.679 4.484 4.600 1.00 0.00 N ATOM 1018 CA ALA A 69 7.170 5.403 5.571 1.00 0.00 C ATOM 1019 C ALA A 69 7.155 6.844 5.194 1.00 0.00 C ATOM 1020 O ALA A 69 6.258 7.582 5.598 1.00 0.00 O ATOM 1021 CB ALA A 69 7.735 5.199 6.987 1.00 0.00 C ATOM 0 H ALA A 69 8.641 4.197 4.782 1.00 0.00 H new ATOM 0 HA ALA A 69 6.118 5.119 5.588 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.299 5.935 7.662 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.489 4.196 7.336 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.818 5.321 6.968 1.00 0.00 H new ATOM 1027 N ARG A 70 8.132 7.308 4.394 1.00 0.00 N ATOM 1028 CA ARG A 70 8.190 8.585 3.753 1.00 0.00 C ATOM 1029 C ARG A 70 7.324 8.614 2.542 1.00 0.00 C ATOM 1030 O ARG A 70 6.908 7.563 2.055 1.00 0.00 O ATOM 1031 CB ARG A 70 9.655 9.010 3.553 1.00 0.00 C ATOM 1032 CG ARG A 70 10.151 9.081 2.108 1.00 0.00 C ATOM 1033 CD ARG A 70 11.589 9.585 1.970 1.00 0.00 C ATOM 1034 NE ARG A 70 11.811 9.742 0.505 1.00 0.00 N ATOM 1035 CZ ARG A 70 12.925 10.310 -0.043 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.983 10.675 0.737 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.928 10.606 -1.375 1.00 0.00 N ATOM 0 H ARG A 70 8.951 6.739 4.178 1.00 0.00 H new ATOM 0 HA ARG A 70 7.763 9.357 4.393 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.792 9.990 4.010 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.291 8.313 4.099 1.00 0.00 H new ATOM 0 HG2 ARG A 70 10.079 8.090 1.661 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.491 9.736 1.539 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.726 10.532 2.492 1.00 0.00 H new ATOM 0 HD3 ARG A 70 12.297 8.878 2.402 1.00 0.00 H new ATOM 0 HE ARG A 70 11.086 9.404 -0.128 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.949 10.525 1.745 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.808 11.098 0.312 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.107 10.403 -1.944 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.752 11.031 -1.801 1.00 0.00 H new ATOM 1051 N LYS A 71 6.950 9.780 1.986 1.00 0.00 N ATOM 1052 CA LYS A 71 5.868 9.862 1.055 1.00 0.00 C ATOM 1053 C LYS A 71 6.412 9.916 -0.332 1.00 0.00 C ATOM 1054 O LYS A 71 7.585 10.220 -0.540 1.00 0.00 O ATOM 1055 CB LYS A 71 5.132 11.156 1.442 1.00 0.00 C ATOM 1056 CG LYS A 71 3.765 11.324 0.776 1.00 0.00 C ATOM 1057 CD LYS A 71 3.086 12.656 1.097 1.00 0.00 C ATOM 1058 CE LYS A 71 1.990 13.159 0.155 1.00 0.00 C ATOM 1059 NZ LYS A 71 2.599 13.409 -1.171 1.00 0.00 N ATOM 0 H LYS A 71 7.401 10.673 2.184 1.00 0.00 H new ATOM 0 HA LYS A 71 5.196 9.005 1.084 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.001 11.177 2.524 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.758 12.009 1.180 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.884 11.237 -0.304 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.114 10.509 1.092 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.656 12.577 2.095 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.861 13.421 1.143 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.191 12.422 0.074 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.542 14.073 0.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.895 13.847 -1.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.413 14.047 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.917 12.508 -1.583 1.00 0.00 H new ATOM 1073 N MET A 72 5.609 9.567 -1.353 1.00 0.00 N ATOM 1074 CA MET A 72 5.907 9.861 -2.720 1.00 0.00 C ATOM 1075 C MET A 72 5.199 11.049 -3.275 1.00 0.00 C ATOM 1076 O MET A 72 4.300 11.549 -2.602 1.00 0.00 O ATOM 1077 CB MET A 72 5.540 8.661 -3.609 1.00 0.00 C ATOM 1078 CG MET A 72 6.397 7.414 -3.379 1.00 0.00 C ATOM 1079 SD MET A 72 6.291 6.110 -4.641 1.00 0.00 S ATOM 1080 CE MET A 72 4.499 5.815 -4.621 1.00 0.00 C ATOM 0 H MET A 72 4.729 9.067 -1.224 1.00 0.00 H new ATOM 0 HA MET A 72 6.975 10.080 -2.727 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.495 8.404 -3.437 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.628 8.959 -4.654 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.438 7.726 -3.298 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.118 6.982 -2.418 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.241 5.088 -5.391 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.205 5.429 -3.645 1.00 0.00 H new ATOM 0 HE3 MET A 72 3.974 6.750 -4.815 1.00 0.00 H new ATOM 1090 N LYS A 73 5.643 11.488 -4.466 1.00 0.00 N ATOM 1091 CA LYS A 73 4.879 12.512 -5.107 1.00 0.00 C ATOM 1092 C LYS A 73 3.439 12.242 -5.380 1.00 0.00 C ATOM 1093 O LYS A 73 3.011 11.090 -5.321 1.00 0.00 O ATOM 1094 CB LYS A 73 5.581 12.827 -6.439 1.00 0.00 C ATOM 1095 CG LYS A 73 5.015 13.943 -7.319 1.00 0.00 C ATOM 1096 CD LYS A 73 5.999 14.223 -8.457 1.00 0.00 C ATOM 1097 CE LYS A 73 5.670 15.566 -9.111 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.543 15.585 -10.306 1.00 0.00 N ATOM 0 H LYS A 73 6.474 11.161 -4.959 1.00 0.00 H new ATOM 0 HA LYS A 73 4.850 13.335 -4.393 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.619 13.076 -6.216 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.593 11.912 -7.031 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.046 13.650 -7.722 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.855 14.845 -6.728 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.019 14.236 -8.073 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.948 13.425 -9.198 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.616 15.634 -9.381 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.883 16.401 -8.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.395 16.471 -10.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.538 15.520 -10.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.311 14.777 -10.919 1.00 0.00 H new ATOM 1112 N ASP A 74 2.576 13.272 -5.444 1.00 0.00 N ATOM 1113 CA ASP A 74 1.161 13.070 -5.405 1.00 0.00 C ATOM 1114 C ASP A 74 0.611 12.577 -6.699 1.00 0.00 C ATOM 1115 O ASP A 74 -0.522 12.106 -6.791 1.00 0.00 O ATOM 1116 CB ASP A 74 0.360 14.333 -5.047 1.00 0.00 C ATOM 1117 CG ASP A 74 0.623 14.858 -3.642 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.682 14.038 -2.687 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.843 16.081 -3.432 1.00 0.00 O ATOM 0 H ASP A 74 2.860 14.248 -5.523 1.00 0.00 H new ATOM 0 HA ASP A 74 1.043 12.323 -4.620 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.597 15.117 -5.767 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.703 14.117 -5.150 1.00 0.00 H new ATOM 1124 N THR A 75 1.477 12.544 -7.728 1.00 0.00 N ATOM 1125 CA THR A 75 1.318 11.766 -8.917 1.00 0.00 C ATOM 1126 C THR A 75 1.358 10.306 -8.625 1.00 0.00 C ATOM 1127 O THR A 75 0.413 9.565 -8.895 1.00 0.00 O ATOM 1128 CB THR A 75 2.291 12.061 -10.020 1.00 0.00 C ATOM 1129 OG1 THR A 75 3.650 11.934 -9.631 1.00 0.00 O ATOM 1130 CG2 THR A 75 2.126 13.566 -10.293 1.00 0.00 C ATOM 0 H THR A 75 2.337 13.092 -7.729 1.00 0.00 H new ATOM 0 HA THR A 75 0.335 12.065 -9.282 1.00 0.00 H new ATOM 0 HB THR A 75 2.091 11.376 -10.844 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.229 12.138 -10.395 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.805 13.868 -11.091 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.099 13.771 -10.594 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.358 14.127 -9.388 1.00 0.00 H new ATOM 1138 N ASP A 76 2.459 9.915 -7.959 1.00 0.00 N ATOM 1139 CA ASP A 76 2.717 8.561 -7.578 1.00 0.00 C ATOM 1140 C ASP A 76 1.751 8.058 -6.561 1.00 0.00 C ATOM 1141 O ASP A 76 1.207 6.958 -6.640 1.00 0.00 O ATOM 1142 CB ASP A 76 4.158 8.268 -7.126 1.00 0.00 C ATOM 1143 CG ASP A 76 5.116 8.798 -8.182 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.709 8.847 -9.373 1.00 0.00 O ATOM 1145 OD2 ASP A 76 6.282 9.183 -7.897 1.00 0.00 O ATOM 0 H ASP A 76 3.194 10.563 -7.676 1.00 0.00 H new ATOM 0 HA ASP A 76 2.575 8.012 -8.509 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.356 8.741 -6.164 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.301 7.196 -6.990 1.00 0.00 H new ATOM 1150 N SER A 77 1.384 8.913 -5.590 1.00 0.00 N ATOM 1151 CA SER A 77 0.361 8.664 -4.622 1.00 0.00 C ATOM 1152 C SER A 77 -1.017 8.464 -5.153 1.00 0.00 C ATOM 1153 O SER A 77 -1.929 8.031 -4.450 1.00 0.00 O ATOM 1154 CB SER A 77 0.348 9.819 -3.607 1.00 0.00 C ATOM 1155 OG SER A 77 1.667 10.174 -3.218 1.00 0.00 O ATOM 0 H SER A 77 1.824 9.826 -5.474 1.00 0.00 H new ATOM 0 HA SER A 77 0.624 7.707 -4.171 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.151 10.684 -4.043 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.228 9.528 -2.728 1.00 0.00 H new ATOM 0 HG SER A 77 2.095 10.682 -3.938 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.281 8.795 -6.429 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.535 8.584 -7.083 1.00 0.00 C ATOM 1163 C GLU A 78 -2.520 7.209 -7.656 1.00 0.00 C ATOM 1164 O GLU A 78 -3.517 6.495 -7.557 1.00 0.00 O ATOM 1165 CB GLU A 78 -2.822 9.676 -8.128 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.301 9.878 -8.464 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.619 10.988 -9.456 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.460 12.153 -9.003 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -4.999 10.713 -10.625 1.00 0.00 O ATOM 0 H GLU A 78 -0.586 9.231 -7.034 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.357 8.661 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.415 10.620 -7.766 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.287 9.429 -9.045 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.693 8.941 -8.860 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -4.838 10.082 -7.538 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.458 6.810 -8.378 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.182 5.537 -8.969 1.00 0.00 C ATOM 1178 C GLU A 79 -1.209 4.385 -8.025 1.00 0.00 C ATOM 1179 O GLU A 79 -1.619 3.245 -8.239 1.00 0.00 O ATOM 1180 CB GLU A 79 0.102 5.640 -9.809 1.00 0.00 C ATOM 1181 CG GLU A 79 0.067 4.602 -10.933 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.947 4.987 -12.000 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -0.692 5.976 -12.737 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -2.103 4.485 -11.985 1.00 0.00 O ATOM 0 H GLU A 79 -0.700 7.465 -8.569 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.011 5.293 -9.634 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.194 6.642 -10.229 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.975 5.477 -9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.056 4.513 -11.382 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.186 3.624 -10.522 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.674 4.731 -6.841 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.429 3.865 -5.729 1.00 0.00 C ATOM 1193 C GLU A 80 -1.637 3.174 -5.198 1.00 0.00 C ATOM 1194 O GLU A 80 -1.653 2.000 -4.830 1.00 0.00 O ATOM 1195 CB GLU A 80 0.154 4.737 -4.605 1.00 0.00 C ATOM 1196 CG GLU A 80 0.744 3.961 -3.426 1.00 0.00 C ATOM 1197 CD GLU A 80 1.226 4.691 -2.180 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.973 5.911 -1.993 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.940 4.099 -1.327 1.00 0.00 O ATOM 0 H GLU A 80 -0.391 5.692 -6.647 1.00 0.00 H new ATOM 0 HA GLU A 80 0.241 3.078 -6.074 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.931 5.375 -5.026 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.631 5.395 -4.232 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.010 3.242 -3.105 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.588 3.388 -3.809 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.799 3.849 -5.168 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.037 3.345 -4.659 1.00 0.00 C ATOM 1208 C ILE A 81 -4.682 2.437 -5.649 1.00 0.00 C ATOM 1209 O ILE A 81 -5.265 1.403 -5.329 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.918 4.398 -4.055 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.131 5.283 -3.074 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.013 3.685 -3.245 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.845 6.452 -2.398 1.00 0.00 C ATOM 0 H ILE A 81 -2.879 4.803 -5.520 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.820 2.720 -3.792 1.00 0.00 H new ATOM 0 HB ILE A 81 -5.324 5.017 -4.855 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.740 4.637 -2.288 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.273 5.687 -3.611 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.672 4.426 -2.792 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.593 3.040 -3.906 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.552 3.082 -2.462 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.149 6.972 -1.739 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.211 7.143 -3.157 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.685 6.077 -1.814 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.639 2.807 -6.941 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.197 2.151 -8.083 1.00 0.00 C ATOM 1227 C ARG A 82 -4.575 0.812 -8.283 1.00 0.00 C ATOM 1228 O ARG A 82 -5.263 -0.207 -8.323 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.076 2.882 -9.430 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.057 4.040 -9.622 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.040 4.696 -11.004 1.00 0.00 C ATOM 1232 NE ARG A 82 -4.743 5.364 -11.310 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.552 6.715 -11.310 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -5.483 7.651 -10.964 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -3.302 7.144 -11.651 1.00 0.00 N ATOM 0 H ARG A 82 -4.157 3.664 -7.213 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.256 2.109 -7.830 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.060 3.265 -9.530 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.225 2.161 -10.233 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.065 3.676 -9.425 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.842 4.803 -8.874 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.242 3.940 -11.763 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.844 5.429 -11.063 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.944 4.771 -11.535 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.416 7.359 -10.674 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -5.246 8.642 -10.996 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -2.577 6.466 -11.886 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.093 8.142 -11.670 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.231 0.765 -8.261 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.382 -0.386 -8.223 1.00 0.00 C ATOM 1251 C GLU A 83 -2.733 -1.288 -7.089 1.00 0.00 C ATOM 1252 O GLU A 83 -2.959 -2.471 -7.338 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.903 -0.004 -8.044 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.056 0.464 -9.229 1.00 0.00 C ATOM 1255 CD GLU A 83 0.336 -0.589 -10.256 1.00 0.00 C ATOM 1256 OE1 GLU A 83 0.214 -1.813 -9.982 1.00 0.00 O ATOM 1257 OE2 GLU A 83 0.884 -0.141 -11.298 1.00 0.00 O ATOM 0 H GLU A 83 -2.684 1.626 -8.271 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.531 -0.889 -9.178 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.867 0.787 -7.295 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.400 -0.871 -7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.602 1.254 -9.745 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.857 0.912 -8.837 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.909 -0.864 -5.825 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.296 -1.705 -4.735 1.00 0.00 C ATOM 1266 C ALA A 84 -4.654 -2.296 -4.901 1.00 0.00 C ATOM 1267 O ALA A 84 -4.902 -3.482 -4.690 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.362 -0.900 -3.427 1.00 0.00 C ATOM 0 H ALA A 84 -2.775 0.109 -5.550 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.543 -2.493 -4.710 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.658 -1.558 -2.610 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.382 -0.473 -3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.093 -0.098 -3.530 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.596 -1.500 -5.435 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.899 -1.952 -5.813 1.00 0.00 C ATOM 1276 C PHE A 85 -6.865 -2.950 -6.919 1.00 0.00 C ATOM 1277 O PHE A 85 -7.612 -3.926 -6.976 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.726 -0.720 -6.219 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.163 -1.048 -6.437 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.025 -1.127 -5.368 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.563 -1.326 -7.722 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.320 -1.518 -5.613 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.881 -1.648 -7.947 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.763 -1.737 -6.896 1.00 0.00 C ATOM 0 H PHE A 85 -5.446 -0.506 -5.610 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.353 -2.464 -4.964 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.643 0.041 -5.443 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.311 -0.292 -7.132 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.695 -0.889 -4.368 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.857 -1.292 -8.538 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -12.000 -1.655 -4.785 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.225 -1.832 -8.954 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.800 -1.978 -7.078 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.950 -2.793 -7.893 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.756 -3.696 -8.984 1.00 0.00 C ATOM 1296 C ARG A 86 -5.326 -5.075 -8.619 1.00 0.00 C ATOM 1297 O ARG A 86 -5.503 -6.054 -9.343 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.938 -3.002 -10.087 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.006 -3.799 -11.391 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.046 -3.241 -12.444 1.00 0.00 C ATOM 1301 NE ARG A 86 -2.628 -3.289 -11.991 1.00 0.00 N ATOM 1302 CZ ARG A 86 -1.522 -3.264 -12.792 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -1.668 -3.463 -14.134 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -0.306 -2.937 -12.266 1.00 0.00 N ATOM 0 H ARG A 86 -5.314 -1.996 -7.920 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.737 -3.921 -9.402 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.320 -1.994 -10.250 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.900 -2.902 -9.769 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.763 -4.843 -11.193 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.025 -3.777 -11.779 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.151 -3.811 -13.367 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.318 -2.211 -12.673 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.467 -3.346 -10.985 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -2.595 -3.628 -14.527 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.851 -3.447 -14.744 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.223 -2.711 -11.275 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.520 -2.918 -12.864 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.829 -5.232 -7.380 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.608 -6.451 -6.664 1.00 0.00 C ATOM 1320 C VAL A 87 -5.840 -7.118 -6.159 1.00 0.00 C ATOM 1321 O VAL A 87 -5.928 -8.339 -6.276 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.593 -6.403 -5.560 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -3.227 -7.818 -5.081 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.371 -5.745 -6.221 1.00 0.00 C ATOM 0 H VAL A 87 -4.555 -4.422 -6.825 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.183 -7.058 -7.464 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.958 -5.866 -4.685 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.490 -7.752 -4.281 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.121 -8.319 -4.710 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.810 -8.387 -5.912 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.564 -5.662 -5.493 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.040 -6.355 -7.062 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.641 -4.751 -6.578 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.743 -6.362 -5.509 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.970 -6.839 -4.950 1.00 0.00 C ATOM 1336 C PHE A 88 -8.975 -7.199 -5.989 1.00 0.00 C ATOM 1337 O PHE A 88 -9.389 -8.355 -6.059 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.555 -5.713 -4.081 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.896 -5.770 -2.746 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -8.362 -6.633 -1.782 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.844 -4.919 -2.502 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.768 -6.572 -0.543 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.255 -4.874 -1.260 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.761 -5.679 -0.266 1.00 0.00 C ATOM 0 H PHE A 88 -6.609 -5.361 -5.366 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.754 -7.741 -4.377 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.384 -4.743 -4.549 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.634 -5.832 -3.979 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -9.161 -7.330 -1.989 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.477 -4.281 -3.292 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.102 -7.244 0.233 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.415 -4.222 -1.070 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.365 -5.609 0.736 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.294 -6.229 -6.865 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.136 -6.304 -8.019 1.00 0.00 C ATOM 1356 C ASP A 89 -9.466 -6.920 -9.199 1.00 0.00 C ATOM 1357 O ASP A 89 -8.605 -6.319 -9.839 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.691 -4.928 -8.426 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.873 -4.979 -9.384 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.845 -5.717 -9.071 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.820 -4.229 -10.394 1.00 0.00 O ATOM 0 H ASP A 89 -8.918 -5.288 -6.748 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.959 -6.952 -7.716 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.993 -4.392 -7.526 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.890 -4.350 -8.888 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.732 -8.210 -9.468 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.061 -9.040 -10.421 1.00 0.00 C ATOM 1368 C LYS A 90 -9.453 -8.773 -11.833 1.00 0.00 C ATOM 1369 O LYS A 90 -8.591 -8.596 -12.693 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.149 -10.555 -10.169 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.306 -11.400 -11.126 1.00 0.00 C ATOM 1372 CD LYS A 90 -6.832 -11.007 -11.234 1.00 0.00 C ATOM 1373 CE LYS A 90 -6.005 -11.078 -9.949 1.00 0.00 C ATOM 1374 NZ LYS A 90 -4.545 -10.956 -10.161 1.00 0.00 N ATOM 0 H LYS A 90 -10.475 -8.711 -8.981 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.024 -8.744 -10.266 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.833 -10.761 -9.146 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.191 -10.865 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.363 -12.441 -10.809 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.752 -11.345 -12.119 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.362 -11.651 -11.977 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.779 -9.988 -11.617 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.331 -10.285 -9.276 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -6.211 -12.025 -9.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.055 -11.013 -9.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.218 -11.727 -10.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.335 -10.042 -10.609 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.763 -8.830 -12.133 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.463 -8.857 -13.380 1.00 0.00 C ATOM 1390 C ASP A 91 -11.270 -7.611 -14.174 1.00 0.00 C ATOM 1391 O ASP A 91 -10.803 -7.605 -15.312 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.939 -9.246 -13.191 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.655 -8.569 -12.032 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.425 -7.363 -11.744 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.461 -9.188 -11.287 1.00 0.00 O ATOM 0 H ASP A 91 -11.436 -8.862 -11.367 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.017 -9.646 -13.985 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.477 -9.016 -14.111 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.996 -10.325 -13.049 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.571 -6.446 -13.574 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.464 -5.156 -14.182 1.00 0.00 C ATOM 1402 C GLY A 92 -12.653 -4.272 -14.018 1.00 0.00 C ATOM 1403 O GLY A 92 -12.766 -3.312 -14.778 1.00 0.00 O ATOM 0 H GLY A 92 -11.907 -6.402 -12.612 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.594 -4.648 -13.766 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.276 -5.289 -15.247 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.688 -4.628 -13.236 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.874 -3.830 -13.194 1.00 0.00 C ATOM 1409 C ASN A 93 -14.827 -2.595 -12.362 1.00 0.00 C ATOM 1410 O ASN A 93 -15.449 -1.597 -12.720 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.196 -4.546 -12.873 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.240 -5.303 -11.553 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.334 -5.289 -10.721 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.384 -6.020 -11.390 1.00 0.00 N ATOM 0 H ASN A 93 -13.705 -5.456 -12.641 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.875 -3.552 -14.248 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.996 -3.806 -12.872 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.412 -5.247 -13.679 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.520 -6.579 -10.548 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.106 -5.999 -12.110 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.193 -2.644 -11.176 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.245 -1.659 -10.141 1.00 0.00 C ATOM 1423 C GLY A 94 -15.024 -1.997 -8.917 1.00 0.00 C ATOM 1424 O GLY A 94 -15.364 -1.098 -8.150 1.00 0.00 O ATOM 0 H GLY A 94 -13.599 -3.434 -10.923 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.223 -1.433 -9.839 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.662 -0.745 -10.565 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.332 -3.290 -8.706 1.00 0.00 N ATOM 1429 CA TYR A 95 -16.143 -3.751 -7.622 1.00 0.00 C ATOM 1430 C TYR A 95 -15.504 -4.976 -7.064 1.00 0.00 C ATOM 1431 O TYR A 95 -15.325 -5.915 -7.839 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.612 -4.019 -7.989 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.391 -2.827 -8.426 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.238 -2.314 -9.693 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -19.300 -2.214 -7.596 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.824 -1.141 -10.105 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.840 -1.012 -7.987 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.662 -0.476 -9.241 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.299 0.705 -9.676 1.00 0.00 O ATOM 0 H TYR A 95 -15.004 -4.042 -9.313 1.00 0.00 H new ATOM 0 HA TYR A 95 -16.191 -2.951 -6.883 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.640 -4.762 -8.786 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -18.110 -4.460 -7.125 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.628 -2.859 -10.398 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -19.583 -2.667 -6.657 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -18.629 -0.748 -11.092 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -20.434 -0.461 -7.273 1.00 0.00 H new ATOM 0 HH TYR A 95 -20.860 1.059 -8.954 1.00 0.00 H new ATOM 1449 N ILE A 96 -15.166 -4.998 -5.762 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.520 -6.033 -5.016 1.00 0.00 C ATOM 1451 C ILE A 96 -15.574 -6.995 -4.590 1.00 0.00 C ATOM 1452 O ILE A 96 -16.491 -6.617 -3.862 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.632 -5.708 -3.851 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -12.523 -4.712 -4.228 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.994 -7.021 -3.369 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.624 -4.211 -3.099 1.00 0.00 C ATOM 0 H ILE A 96 -15.371 -4.195 -5.167 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.781 -6.416 -5.720 1.00 0.00 H new ATOM 0 HB ILE A 96 -14.233 -5.242 -3.070 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.890 -5.180 -4.982 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.991 -3.847 -4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -12.341 -6.818 -2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -13.777 -7.716 -3.066 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -12.411 -7.461 -4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.887 -3.516 -3.502 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -12.230 -3.702 -2.350 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -11.112 -5.056 -2.639 1.00 0.00 H new ATOM 1468 N SER A 97 -15.497 -8.245 -5.082 1.00 0.00 N ATOM 1469 CA SER A 97 -16.381 -9.318 -4.745 1.00 0.00 C ATOM 1470 C SER A 97 -15.820 -10.242 -3.720 1.00 0.00 C ATOM 1471 O SER A 97 -14.609 -10.269 -3.504 1.00 0.00 O ATOM 1472 CB SER A 97 -16.677 -10.075 -6.051 1.00 0.00 C ATOM 1473 OG SER A 97 -15.613 -10.867 -6.557 1.00 0.00 O ATOM 0 H SER A 97 -14.779 -8.521 -5.751 1.00 0.00 H new ATOM 0 HA SER A 97 -17.287 -8.909 -4.297 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.540 -10.720 -5.888 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.961 -9.350 -6.814 1.00 0.00 H new ATOM 0 HG SER A 97 -15.037 -10.316 -7.127 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.613 -11.194 -3.196 1.00 0.00 N ATOM 1480 CA ALA A 98 -16.212 -12.085 -2.152 1.00 0.00 C ATOM 1481 C ALA A 98 -15.426 -13.236 -2.681 1.00 0.00 C ATOM 1482 O ALA A 98 -14.695 -13.905 -1.953 1.00 0.00 O ATOM 1483 CB ALA A 98 -17.396 -12.568 -1.299 1.00 0.00 C ATOM 0 H ALA A 98 -17.570 -11.349 -3.512 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.562 -11.509 -1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -17.034 -13.241 -0.522 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.885 -11.711 -0.837 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -18.110 -13.095 -1.932 1.00 0.00 H new ATOM 1489 N ALA A 99 -15.435 -13.376 -4.018 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.683 -14.381 -4.702 1.00 0.00 C ATOM 1491 C ALA A 99 -13.295 -13.882 -4.914 1.00 0.00 C ATOM 1492 O ALA A 99 -12.357 -14.620 -4.619 1.00 0.00 O ATOM 1493 CB ALA A 99 -15.405 -14.586 -6.045 1.00 0.00 C ATOM 0 H ALA A 99 -15.978 -12.776 -4.639 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.617 -15.317 -4.147 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.883 -15.346 -6.626 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.430 -14.910 -5.862 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.415 -13.648 -6.600 1.00 0.00 H new ATOM 1499 N GLU A 100 -13.162 -12.621 -5.364 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.880 -11.990 -5.403 1.00 0.00 C ATOM 1501 C GLU A 100 -11.120 -11.919 -4.123 1.00 0.00 C ATOM 1502 O GLU A 100 -9.989 -12.389 -4.010 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.995 -10.613 -6.078 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.388 -10.803 -7.545 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.905 -9.474 -8.076 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.011 -8.987 -7.718 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.395 -8.874 -9.060 1.00 0.00 O ATOM 0 H GLU A 100 -13.934 -12.044 -5.698 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.263 -12.661 -6.001 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.740 -10.004 -5.565 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.046 -10.081 -6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.530 -11.137 -8.128 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.154 -11.573 -7.636 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.729 -11.446 -3.021 1.00 0.00 N ATOM 1515 CA LEU A 101 -11.131 -11.349 -1.725 1.00 0.00 C ATOM 1516 C LEU A 101 -10.472 -12.558 -1.158 1.00 0.00 C ATOM 1517 O LEU A 101 -9.356 -12.521 -0.642 1.00 0.00 O ATOM 1518 CB LEU A 101 -12.074 -10.782 -0.651 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.469 -10.069 0.570 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.317 -9.123 0.191 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.454 -9.227 1.399 1.00 0.00 C ATOM 0 H LEU A 101 -12.693 -11.113 -3.036 1.00 0.00 H new ATOM 0 HA LEU A 101 -10.327 -10.652 -1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.748 -10.080 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.686 -11.605 -0.282 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.126 -10.910 1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.927 -8.646 1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.523 -9.692 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.684 -8.359 -0.495 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.926 -8.768 2.235 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.885 -8.448 0.770 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -13.249 -9.868 1.780 1.00 0.00 H new ATOM 1533 N ARG A 102 -11.063 -13.749 -1.361 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.593 -15.076 -1.111 1.00 0.00 C ATOM 1535 C ARG A 102 -9.316 -15.410 -1.802 1.00 0.00 C ATOM 1536 O ARG A 102 -8.337 -15.844 -1.196 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.677 -16.038 -1.625 1.00 0.00 C ATOM 1538 CG ARG A 102 -12.804 -16.333 -0.633 1.00 0.00 C ATOM 1539 CD ARG A 102 -14.104 -17.009 -1.074 1.00 0.00 C ATOM 1540 NE ARG A 102 -14.935 -17.408 0.096 1.00 0.00 N ATOM 1541 CZ ARG A 102 -15.959 -16.707 0.666 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -16.268 -15.435 0.281 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -16.714 -17.276 1.651 1.00 0.00 N ATOM 0 H ARG A 102 -12.003 -13.779 -1.756 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.399 -15.162 -0.042 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.112 -15.619 -2.532 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.203 -16.979 -1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.377 -16.953 0.156 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.081 -15.382 -0.177 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -14.671 -16.329 -1.710 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.873 -17.889 -1.674 1.00 0.00 H new ATOM 0 HE ARG A 102 -14.714 -18.309 0.520 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -15.727 -14.979 -0.454 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -17.040 -14.940 0.728 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -16.514 -18.226 1.962 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -17.478 -16.751 2.075 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.264 -15.109 -3.112 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.011 -15.083 -3.800 1.00 0.00 C ATOM 1559 C HIS A 103 -6.969 -14.128 -3.327 1.00 0.00 C ATOM 1560 O HIS A 103 -5.835 -14.607 -3.338 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.174 -14.777 -5.298 1.00 0.00 C ATOM 1562 CG HIS A 103 -8.884 -15.754 -6.188 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -10.254 -15.904 -6.252 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -8.420 -16.771 -6.962 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.513 -16.890 -7.152 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -9.417 -17.430 -7.653 1.00 0.00 N ATOM 0 H HIS A 103 -10.076 -14.887 -3.688 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.663 -16.093 -3.584 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.697 -13.824 -5.380 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.176 -14.629 -5.710 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -10.945 -15.373 -5.722 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.375 -17.037 -7.029 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -11.510 -17.199 -7.428 1.00 0.00 H new ATOM 1574 N VAL A 104 -7.276 -12.955 -2.746 1.00 0.00 N ATOM 1575 CA VAL A 104 -6.332 -11.991 -2.272 1.00 0.00 C ATOM 1576 C VAL A 104 -5.587 -12.603 -1.135 1.00 0.00 C ATOM 1577 O VAL A 104 -4.363 -12.589 -1.022 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.900 -10.684 -1.804 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.823 -9.686 -1.348 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -7.548 -10.119 -3.080 1.00 0.00 C ATOM 0 H VAL A 104 -8.242 -12.662 -2.598 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.709 -11.744 -3.131 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.564 -10.830 -0.952 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.299 -8.761 -1.022 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.257 -10.114 -0.521 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.149 -9.474 -2.178 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.002 -9.153 -2.860 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -6.787 -9.995 -3.850 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.315 -10.808 -3.435 1.00 0.00 H new ATOM 1590 N MET A 105 -6.373 -13.234 -0.244 1.00 0.00 N ATOM 1591 CA MET A 105 -5.829 -13.895 0.900 1.00 0.00 C ATOM 1592 C MET A 105 -4.975 -15.077 0.593 1.00 0.00 C ATOM 1593 O MET A 105 -3.897 -15.334 1.126 1.00 0.00 O ATOM 1594 CB MET A 105 -6.926 -14.331 1.886 1.00 0.00 C ATOM 1595 CG MET A 105 -7.783 -13.161 2.375 1.00 0.00 C ATOM 1596 SD MET A 105 -6.802 -11.760 2.991 1.00 0.00 S ATOM 1597 CE MET A 105 -7.784 -10.360 2.380 1.00 0.00 C ATOM 0 H MET A 105 -7.389 -13.286 -0.317 1.00 0.00 H new ATOM 0 HA MET A 105 -5.187 -13.138 1.351 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.568 -15.069 1.405 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.464 -14.820 2.743 1.00 0.00 H new ATOM 0 HG2 MET A 105 -8.419 -12.819 1.558 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.443 -13.510 3.169 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.461 -9.445 2.877 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.642 -10.258 1.304 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.839 -10.535 2.592 1.00 0.00 H new ATOM 1607 N THR A 106 -5.288 -15.812 -0.489 1.00 0.00 N ATOM 1608 CA THR A 106 -4.503 -16.936 -0.895 1.00 0.00 C ATOM 1609 C THR A 106 -3.219 -16.599 -1.574 1.00 0.00 C ATOM 1610 O THR A 106 -2.157 -17.183 -1.365 1.00 0.00 O ATOM 1611 CB THR A 106 -5.364 -17.890 -1.668 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.600 -17.976 -0.974 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.731 -19.288 -1.567 1.00 0.00 C ATOM 0 H THR A 106 -6.093 -15.625 -1.088 1.00 0.00 H new ATOM 0 HA THR A 106 -4.157 -17.432 0.012 1.00 0.00 H new ATOM 0 HB THR A 106 -5.476 -17.567 -2.703 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.179 -17.233 -1.244 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.338 -20.003 -2.122 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.725 -19.263 -1.987 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.680 -19.590 -0.521 1.00 0.00 H new ATOM 1621 N ASN A 107 -3.326 -15.624 -2.495 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.130 -15.145 -3.114 1.00 0.00 C ATOM 1623 C ASN A 107 -1.220 -14.451 -2.159 1.00 0.00 C ATOM 1624 O ASN A 107 -0.012 -14.630 -2.311 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.595 -14.098 -4.140 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.288 -14.728 -5.339 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.130 -15.927 -5.565 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.016 -13.927 -6.163 1.00 0.00 N ATOM 0 H ASN A 107 -4.195 -15.185 -2.800 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.581 -15.987 -3.536 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.276 -13.398 -3.657 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.735 -13.522 -4.482 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.452 -14.317 -6.999 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.126 -12.937 -5.945 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.709 -13.640 -1.205 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.780 -13.015 -0.316 1.00 0.00 C ATOM 1637 C LEU A 108 -0.236 -13.975 0.685 1.00 0.00 C ATOM 1638 O LEU A 108 0.950 -13.958 1.011 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.419 -11.838 0.440 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.648 -10.500 -0.284 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -2.184 -9.608 0.848 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -0.321 -9.990 -0.872 1.00 0.00 C ATOM 0 H LEU A 108 -2.694 -13.424 -1.051 1.00 0.00 H new ATOM 0 HA LEU A 108 0.032 -12.648 -0.944 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.386 -12.177 0.812 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.796 -11.634 1.311 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.330 -10.543 -1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.390 -8.611 0.459 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.102 -10.039 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.440 -9.541 1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.490 -9.042 -1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.401 -9.845 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.067 -10.721 -1.581 1.00 0.00 H new ATOM 1654 N GLY A 109 -1.071 -14.907 1.181 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.774 -15.923 2.142 1.00 0.00 C ATOM 1656 C GLY A 109 -1.201 -15.546 3.518 1.00 0.00 C ATOM 1657 O GLY A 109 -0.530 -15.851 4.503 1.00 0.00 O ATOM 0 H GLY A 109 -2.044 -14.951 0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.270 -16.850 1.852 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.298 -16.120 2.139 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.359 -14.872 3.640 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.981 -14.585 4.895 1.00 0.00 C ATOM 1663 C GLU A 110 -4.067 -15.591 5.067 1.00 0.00 C ATOM 1664 O GLU A 110 -4.893 -15.799 4.179 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.549 -13.156 4.895 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.378 -12.176 5.005 1.00 0.00 C ATOM 1667 CD GLU A 110 -1.818 -12.159 6.420 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -0.955 -13.032 6.705 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.065 -11.212 7.214 1.00 0.00 O ATOM 0 H GLU A 110 -2.879 -14.515 2.838 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.267 -14.643 5.716 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.114 -12.972 3.982 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.238 -13.021 5.729 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.594 -12.459 4.302 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -2.709 -11.175 4.728 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.115 -16.351 6.176 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.996 -17.471 6.287 1.00 0.00 C ATOM 1678 C LYS A 111 -6.328 -17.112 6.849 1.00 0.00 C ATOM 1679 O LYS A 111 -6.679 -17.578 7.932 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.216 -18.516 7.103 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.927 -18.987 6.427 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.079 -19.927 7.286 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.925 -20.640 6.577 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.115 -19.743 6.026 1.00 0.00 N ATOM 0 H LYS A 111 -3.539 -16.187 7.001 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.265 -17.877 5.312 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.971 -18.094 8.078 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.858 -19.378 7.281 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.182 -19.494 5.496 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.329 -18.115 6.162 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.668 -19.353 8.117 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.736 -20.683 7.716 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.456 -21.329 7.280 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.333 -21.242 5.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.855 -20.311 5.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.314 -19.101 5.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.536 -19.185 6.796 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.145 -16.288 6.169 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.506 -16.015 6.513 1.00 0.00 C ATOM 1700 C LEU A 112 -9.485 -17.076 6.142 1.00 0.00 C ATOM 1701 O LEU A 112 -9.347 -17.583 5.030 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.059 -14.622 6.168 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.446 -13.365 6.808 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -6.949 -13.218 6.484 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.171 -12.094 6.335 1.00 0.00 C ATOM 0 H LEU A 112 -6.840 -15.786 5.335 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.408 -16.020 7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.984 -14.503 5.087 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.121 -14.626 6.415 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.565 -13.486 7.885 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.561 -12.316 6.958 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.408 -14.087 6.860 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.816 -13.147 5.405 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.717 -11.221 6.803 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.088 -12.009 5.251 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -10.223 -12.150 6.615 1.00 0.00 H new ATOM 1717 N THR A 113 -10.536 -17.396 6.918 1.00 0.00 N ATOM 1718 CA THR A 113 -11.597 -18.293 6.577 1.00 0.00 C ATOM 1719 C THR A 113 -12.634 -17.637 5.732 1.00 0.00 C ATOM 1720 O THR A 113 -12.709 -16.421 5.562 1.00 0.00 O ATOM 1721 CB THR A 113 -12.295 -19.031 7.680 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.974 -18.089 8.497 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.233 -19.798 8.487 1.00 0.00 C ATOM 0 H THR A 113 -10.652 -16.999 7.850 1.00 0.00 H new ATOM 0 HA THR A 113 -11.039 -19.057 6.036 1.00 0.00 H new ATOM 0 HB THR A 113 -13.025 -19.739 7.287 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.437 -18.558 9.222 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.716 -20.344 9.297 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.716 -20.501 7.833 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.513 -19.093 8.903 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.612 -18.426 5.251 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.742 -17.988 4.492 1.00 0.00 C ATOM 1733 C ASP A 114 -15.622 -16.946 5.092 1.00 0.00 C ATOM 1734 O ASP A 114 -15.976 -15.920 4.514 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.619 -19.213 4.179 1.00 0.00 C ATOM 1736 CG ASP A 114 -14.889 -19.952 3.067 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.053 -19.503 1.901 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -14.154 -20.947 3.309 1.00 0.00 O ATOM 0 H ASP A 114 -13.612 -19.435 5.403 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.300 -17.506 3.620 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -15.741 -19.845 5.058 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.618 -18.912 3.862 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.000 -17.285 6.338 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.726 -16.569 7.340 1.00 0.00 C ATOM 1745 C GLU A 115 -16.114 -15.222 7.520 1.00 0.00 C ATOM 1746 O GLU A 115 -16.858 -14.245 7.460 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.832 -17.359 8.655 1.00 0.00 C ATOM 1748 CG GLU A 115 -18.052 -16.787 9.379 1.00 0.00 C ATOM 1749 CD GLU A 115 -18.063 -17.196 10.845 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -18.324 -18.413 11.047 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.685 -16.475 11.806 1.00 0.00 O ATOM 0 H GLU A 115 -15.753 -18.210 6.690 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.755 -16.435 7.007 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.954 -18.425 8.463 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.930 -17.244 9.256 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.047 -15.700 9.302 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.963 -17.137 8.894 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.775 -15.104 7.555 1.00 0.00 N ATOM 1759 CA GLU A 116 -14.062 -13.876 7.724 1.00 0.00 C ATOM 1760 C GLU A 116 -14.048 -12.968 6.542 1.00 0.00 C ATOM 1761 O GLU A 116 -14.319 -11.769 6.588 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.653 -14.235 8.225 1.00 0.00 C ATOM 1763 CG GLU A 116 -12.657 -14.854 9.624 1.00 0.00 C ATOM 1764 CD GLU A 116 -11.247 -14.859 10.198 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -10.730 -13.787 10.611 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -10.637 -15.962 10.199 1.00 0.00 O ATOM 0 H GLU A 116 -14.156 -15.909 7.460 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.596 -13.271 8.457 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -12.191 -14.933 7.526 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.036 -13.336 8.233 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -13.322 -14.290 10.278 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -13.043 -15.872 9.578 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.578 -13.520 5.409 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.636 -12.808 4.170 1.00 0.00 C ATOM 1775 C VAL A 117 -14.967 -12.242 3.813 1.00 0.00 C ATOM 1776 O VAL A 117 -14.957 -11.070 3.440 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.046 -13.671 3.095 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -13.401 -13.203 1.673 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -11.523 -13.720 3.309 1.00 0.00 C ATOM 0 H VAL A 117 -13.162 -14.449 5.350 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.037 -11.905 4.288 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.476 -14.669 3.175 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -12.942 -13.872 0.945 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.483 -13.216 1.545 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.029 -12.190 1.520 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.067 -14.343 2.539 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.114 -12.711 3.249 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.307 -14.141 4.291 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.091 -12.947 4.032 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.409 -12.472 3.750 1.00 0.00 C ATOM 1791 C ASP A 118 -17.859 -11.486 4.773 1.00 0.00 C ATOM 1792 O ASP A 118 -18.586 -10.533 4.499 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.533 -13.521 3.753 1.00 0.00 C ATOM 1794 CG ASP A 118 -18.398 -14.459 2.562 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -18.330 -14.044 1.374 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -18.553 -15.675 2.854 1.00 0.00 O ATOM 0 H ASP A 118 -16.080 -13.889 4.423 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.283 -12.071 2.744 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.499 -14.095 4.679 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -19.502 -13.023 3.722 1.00 0.00 H new ATOM 1801 N GLU A 119 -17.407 -11.596 6.035 1.00 0.00 N ATOM 1802 CA GLU A 119 -17.606 -10.602 7.044 1.00 0.00 C ATOM 1803 C GLU A 119 -17.060 -9.278 6.634 1.00 0.00 C ATOM 1804 O GLU A 119 -17.845 -8.339 6.763 1.00 0.00 O ATOM 1805 CB GLU A 119 -17.048 -11.081 8.395 1.00 0.00 C ATOM 1806 CG GLU A 119 -17.468 -10.397 9.697 1.00 0.00 C ATOM 1807 CD GLU A 119 -16.767 -11.074 10.867 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.512 -11.019 10.967 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -17.466 -11.510 11.820 1.00 0.00 O ATOM 0 H GLU A 119 -16.884 -12.407 6.365 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.679 -10.457 7.170 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -17.301 -12.137 8.491 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -15.962 -11.017 8.335 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -17.209 -9.339 9.666 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.549 -10.457 9.821 1.00 0.00 H new ATOM 1816 N MET A 120 -15.828 -9.330 6.098 1.00 0.00 N ATOM 1817 CA MET A 120 -15.157 -8.152 5.642 1.00 0.00 C ATOM 1818 C MET A 120 -15.841 -7.358 4.583 1.00 0.00 C ATOM 1819 O MET A 120 -15.911 -6.133 4.679 1.00 0.00 O ATOM 1820 CB MET A 120 -13.760 -8.460 5.078 1.00 0.00 C ATOM 1821 CG MET A 120 -12.825 -8.579 6.283 1.00 0.00 C ATOM 1822 SD MET A 120 -11.271 -9.386 5.796 1.00 0.00 S ATOM 1823 CE MET A 120 -10.590 -7.902 5.000 1.00 0.00 C ATOM 0 H MET A 120 -15.294 -10.191 5.980 1.00 0.00 H new ATOM 0 HA MET A 120 -15.133 -7.560 6.557 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.769 -9.385 4.501 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.429 -7.668 4.406 1.00 0.00 H new ATOM 0 HG2 MET A 120 -12.617 -7.589 6.690 1.00 0.00 H new ATOM 0 HG3 MET A 120 -13.309 -9.153 7.073 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.556 -8.087 4.709 1.00 0.00 H new ATOM 0 HE2 MET A 120 -11.179 -7.661 4.115 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.626 -7.066 5.698 1.00 0.00 H new ATOM 1833 N ILE A 121 -16.265 -8.023 3.495 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.920 -7.475 2.347 1.00 0.00 C ATOM 1835 C ILE A 121 -18.158 -6.795 2.821 1.00 0.00 C ATOM 1836 O ILE A 121 -18.394 -5.716 2.279 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.316 -8.601 1.439 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.041 -9.138 0.766 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.335 -8.190 0.363 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.532 -8.262 -0.377 1.00 0.00 C ATOM 0 H ILE A 121 -16.138 -9.032 3.412 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.267 -6.780 1.819 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.806 -9.363 2.045 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.257 -9.231 1.517 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.237 -10.140 0.384 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.576 -9.053 -0.258 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.242 -7.823 0.843 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.909 -7.403 -0.259 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.631 -8.705 -0.802 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.299 -8.189 -1.148 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.303 -7.266 0.002 1.00 0.00 H new ATOM 1852 N ARG A 122 -19.031 -7.369 3.669 1.00 0.00 N ATOM 1853 CA ARG A 122 -20.241 -6.720 4.069 1.00 0.00 C ATOM 1854 C ARG A 122 -19.985 -5.485 4.863 1.00 0.00 C ATOM 1855 O ARG A 122 -20.716 -4.496 4.874 1.00 0.00 O ATOM 1856 CB ARG A 122 -21.081 -7.595 5.014 1.00 0.00 C ATOM 1857 CG ARG A 122 -21.478 -8.894 4.309 1.00 0.00 C ATOM 1858 CD ARG A 122 -22.121 -9.808 5.354 1.00 0.00 C ATOM 1859 NE ARG A 122 -22.181 -11.114 4.639 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.929 -12.327 5.213 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.686 -12.621 6.523 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -21.898 -13.370 4.333 1.00 0.00 N ATOM 0 H ARG A 122 -18.896 -8.292 4.081 1.00 0.00 H new ATOM 0 HA ARG A 122 -20.752 -6.510 3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -20.512 -7.820 5.916 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -21.974 -7.054 5.327 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -22.175 -8.691 3.496 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.604 -9.373 3.867 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.523 -9.869 6.264 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -23.111 -9.458 5.646 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.428 -11.101 3.649 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.678 -11.876 7.220 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -21.513 -13.586 6.806 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -22.056 -13.204 3.339 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -21.717 -14.316 4.669 1.00 0.00 H new ATOM 1876 N GLU A 123 -18.941 -5.574 5.706 1.00 0.00 N ATOM 1877 CA GLU A 123 -18.532 -4.609 6.678 1.00 0.00 C ATOM 1878 C GLU A 123 -18.040 -3.327 6.099 1.00 0.00 C ATOM 1879 O GLU A 123 -18.516 -2.303 6.587 1.00 0.00 O ATOM 1880 CB GLU A 123 -17.374 -5.230 7.477 1.00 0.00 C ATOM 1881 CG GLU A 123 -17.164 -4.731 8.907 1.00 0.00 C ATOM 1882 CD GLU A 123 -16.428 -3.399 8.873 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -15.324 -3.249 8.285 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -17.007 -2.419 9.415 1.00 0.00 O ATOM 0 H GLU A 123 -18.332 -6.392 5.706 1.00 0.00 H new ATOM 0 HA GLU A 123 -19.408 -4.369 7.281 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -17.530 -6.308 7.515 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -16.452 -5.061 6.921 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -18.125 -4.616 9.409 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -16.591 -5.461 9.479 1.00 0.00 H new ATOM 1891 N ALA A 124 -17.327 -3.407 4.962 1.00 0.00 N ATOM 1892 CA ALA A 124 -17.046 -2.293 4.110 1.00 0.00 C ATOM 1893 C ALA A 124 -18.081 -1.740 3.192 1.00 0.00 C ATOM 1894 O ALA A 124 -18.283 -0.534 3.058 1.00 0.00 O ATOM 1895 CB ALA A 124 -15.916 -2.746 3.170 1.00 0.00 C ATOM 0 H ALA A 124 -16.930 -4.283 4.622 1.00 0.00 H new ATOM 0 HA ALA A 124 -16.868 -1.494 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -15.658 -1.932 2.493 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -15.041 -3.020 3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -16.248 -3.608 2.591 1.00 0.00 H new ATOM 1901 N ASP A 125 -18.940 -2.554 2.553 1.00 0.00 N ATOM 1902 CA ASP A 125 -20.074 -2.220 1.748 1.00 0.00 C ATOM 1903 C ASP A 125 -21.038 -1.414 2.548 1.00 0.00 C ATOM 1904 O ASP A 125 -21.542 -1.894 3.563 1.00 0.00 O ATOM 1905 CB ASP A 125 -20.693 -3.570 1.347 1.00 0.00 C ATOM 1906 CG ASP A 125 -21.959 -3.400 0.518 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -22.026 -2.340 -0.161 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -22.877 -4.262 0.491 1.00 0.00 O ATOM 0 H ASP A 125 -18.822 -3.566 2.610 1.00 0.00 H new ATOM 0 HA ASP A 125 -19.807 -1.626 0.874 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.964 -4.147 0.779 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.923 -4.143 2.245 1.00 0.00 H new ATOM 1913 N ILE A 126 -21.324 -0.167 2.135 1.00 0.00 N ATOM 1914 CA ILE A 126 -22.179 0.823 2.712 1.00 0.00 C ATOM 1915 C ILE A 126 -23.505 0.743 2.037 1.00 0.00 C ATOM 1916 O ILE A 126 -24.494 0.479 2.719 1.00 0.00 O ATOM 1917 CB ILE A 126 -21.672 2.219 2.498 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -20.232 2.317 3.029 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -22.599 3.202 3.232 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -19.710 3.753 3.049 1.00 0.00 C ATOM 0 H ILE A 126 -20.895 0.190 1.281 1.00 0.00 H new ATOM 0 HA ILE A 126 -22.228 0.626 3.783 1.00 0.00 H new ATOM 0 HB ILE A 126 -21.667 2.469 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -20.192 1.906 4.038 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -19.577 1.705 2.409 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -22.240 4.220 3.083 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -23.611 3.112 2.836 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -22.604 2.971 4.297 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -18.690 3.764 3.432 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -19.722 4.159 2.037 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -20.346 4.362 3.692 1.00 0.00 H new ATOM 1932 N ASP A 127 -23.604 0.875 0.702 1.00 0.00 N ATOM 1933 CA ASP A 127 -24.865 0.951 0.031 1.00 0.00 C ATOM 1934 C ASP A 127 -25.748 -0.248 0.074 1.00 0.00 C ATOM 1935 O ASP A 127 -26.977 -0.197 0.072 1.00 0.00 O ATOM 1936 CB ASP A 127 -24.660 1.344 -1.442 1.00 0.00 C ATOM 1937 CG ASP A 127 -23.663 0.543 -2.268 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -23.932 -0.668 -2.491 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -22.506 0.997 -2.472 1.00 0.00 O ATOM 0 H ASP A 127 -22.798 0.930 0.079 1.00 0.00 H new ATOM 0 HA ASP A 127 -25.395 1.708 0.609 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -25.628 1.286 -1.940 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -24.351 2.389 -1.468 1.00 0.00 H new ATOM 1944 N GLY A 128 -25.167 -1.460 0.128 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.903 -2.682 0.225 1.00 0.00 C ATOM 1946 C GLY A 128 -26.061 -3.464 -1.034 1.00 0.00 C ATOM 1947 O GLY A 128 -27.078 -4.144 -1.162 1.00 0.00 O ATOM 0 H GLY A 128 -24.156 -1.594 0.103 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -25.413 -3.318 0.963 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.896 -2.453 0.611 1.00 0.00 H new ATOM 1951 N ASP A 129 -25.131 -3.342 -1.999 1.00 0.00 N ATOM 1952 CA ASP A 129 -25.034 -4.141 -3.181 1.00 0.00 C ATOM 1953 C ASP A 129 -24.399 -5.457 -2.892 1.00 0.00 C ATOM 1954 O ASP A 129 -24.917 -6.481 -3.336 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.576 -3.416 -4.458 1.00 0.00 C ATOM 1956 CG ASP A 129 -23.098 -3.072 -4.565 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.440 -3.138 -3.492 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.619 -2.778 -5.693 1.00 0.00 O ATOM 0 H ASP A 129 -24.397 -2.636 -1.948 1.00 0.00 H new ATOM 0 HA ASP A 129 -26.058 -4.370 -3.478 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.842 -4.037 -5.314 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -25.146 -2.491 -4.545 1.00 0.00 H new ATOM 1963 N GLY A 130 -23.382 -5.478 -2.013 1.00 0.00 N ATOM 1964 CA GLY A 130 -22.633 -6.638 -1.639 1.00 0.00 C ATOM 1965 C GLY A 130 -21.211 -6.658 -2.084 1.00 0.00 C ATOM 1966 O GLY A 130 -20.423 -7.506 -1.669 1.00 0.00 O ATOM 0 H GLY A 130 -23.064 -4.635 -1.535 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -22.656 -6.729 -0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -23.134 -7.518 -2.043 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.834 -5.728 -2.979 1.00 0.00 N ATOM 1971 CA GLN A 131 -19.489 -5.572 -3.440 1.00 0.00 C ATOM 1972 C GLN A 131 -18.987 -4.279 -2.897 1.00 0.00 C ATOM 1973 O GLN A 131 -19.683 -3.269 -2.805 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.312 -5.564 -4.968 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.832 -6.831 -5.650 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.364 -6.900 -7.096 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.246 -7.301 -7.414 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.258 -6.742 -8.109 1.00 0.00 N ATOM 0 H GLN A 131 -21.486 -5.063 -3.395 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.933 -6.442 -3.091 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.831 -4.699 -5.381 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.254 -5.443 -5.203 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.483 -7.710 -5.108 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.921 -6.847 -5.615 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.202 -6.412 -7.909 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.984 -6.953 -9.069 1.00 0.00 H new ATOM 1987 N VAL A 132 -17.685 -4.261 -2.561 1.00 0.00 N ATOM 1988 CA VAL A 132 -17.063 -3.025 -2.197 1.00 0.00 C ATOM 1989 C VAL A 132 -16.608 -2.321 -3.429 1.00 0.00 C ATOM 1990 O VAL A 132 -15.814 -2.888 -4.177 1.00 0.00 O ATOM 1991 CB VAL A 132 -15.904 -3.352 -1.303 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -15.549 -2.111 -0.467 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -16.273 -4.368 -0.208 1.00 0.00 C ATOM 0 H VAL A 132 -17.076 -5.079 -2.541 1.00 0.00 H new ATOM 0 HA VAL A 132 -17.757 -2.367 -1.674 1.00 0.00 H new ATOM 0 HB VAL A 132 -15.119 -3.718 -1.965 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -14.707 -2.341 0.186 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -15.280 -1.290 -1.131 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -16.408 -1.822 0.138 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -15.399 -4.570 0.411 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -17.071 -3.960 0.413 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.611 -5.295 -0.671 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.993 -1.063 -3.708 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.443 -0.331 -4.806 1.00 0.00 C ATOM 2005 C ASN A 133 -15.143 0.330 -4.503 1.00 0.00 C ATOM 2006 O ASN A 133 -14.436 -0.060 -3.575 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.568 0.593 -5.303 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.054 1.673 -4.347 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -17.276 2.419 -3.754 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.389 1.933 -4.345 1.00 0.00 N ATOM 0 H ASN A 133 -17.690 -0.550 -3.169 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.139 -0.995 -5.615 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.227 1.079 -6.217 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.422 -0.029 -5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.749 2.749 -3.850 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -20.030 1.312 -4.838 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.720 1.323 -5.305 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.524 2.064 -5.050 1.00 0.00 C ATOM 2019 C TYR A 134 -13.569 2.989 -3.882 1.00 0.00 C ATOM 2020 O TYR A 134 -12.809 2.968 -2.916 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.225 3.039 -6.201 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.772 3.359 -6.281 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -10.905 2.361 -6.661 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.408 4.665 -6.056 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.579 2.710 -6.765 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.062 4.943 -6.092 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.159 3.995 -6.511 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.788 4.264 -6.709 1.00 0.00 O ATOM 0 H TYR A 134 -15.217 1.617 -6.146 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.797 1.267 -4.895 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.555 2.603 -7.144 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.794 3.958 -6.058 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.247 1.357 -6.867 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.141 5.433 -5.861 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.854 1.962 -7.051 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.710 5.918 -5.788 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.606 5.204 -6.500 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.611 3.840 -3.861 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.872 4.815 -2.849 1.00 0.00 C ATOM 2040 C GLU A 135 -15.065 4.214 -1.499 1.00 0.00 C ATOM 2041 O GLU A 135 -14.516 4.703 -0.513 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.066 5.747 -3.118 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.020 6.516 -4.439 1.00 0.00 C ATOM 2044 CD GLU A 135 -17.355 7.169 -4.771 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.656 8.222 -4.148 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -18.011 6.691 -5.734 1.00 0.00 O ATOM 0 H GLU A 135 -15.315 3.846 -4.599 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.964 5.417 -2.878 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.980 5.153 -3.096 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.133 6.466 -2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.246 7.282 -4.385 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -15.740 5.836 -5.244 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.857 3.134 -1.377 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.941 2.268 -0.243 1.00 0.00 C ATOM 2055 C GLU A 136 -14.644 1.685 0.201 1.00 0.00 C ATOM 2056 O GLU A 136 -14.415 1.328 1.356 1.00 0.00 O ATOM 2057 CB GLU A 136 -16.962 1.150 -0.514 1.00 0.00 C ATOM 2058 CG GLU A 136 -18.435 1.540 -0.658 1.00 0.00 C ATOM 2059 CD GLU A 136 -19.372 0.401 -1.035 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -19.083 -0.232 -2.086 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -20.490 0.171 -0.503 1.00 0.00 O ATOM 0 H GLU A 136 -16.485 2.846 -2.128 1.00 0.00 H new ATOM 0 HA GLU A 136 -16.268 2.899 0.584 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -16.661 0.638 -1.428 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -16.886 0.425 0.297 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -18.774 1.972 0.284 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.516 2.321 -1.414 1.00 0.00 H new ATOM 2068 N PHE A 137 -13.699 1.443 -0.725 1.00 0.00 N ATOM 2069 CA PHE A 137 -12.399 0.887 -0.507 1.00 0.00 C ATOM 2070 C PHE A 137 -11.457 1.918 0.013 1.00 0.00 C ATOM 2071 O PHE A 137 -10.904 1.716 1.093 1.00 0.00 O ATOM 2072 CB PHE A 137 -11.804 0.176 -1.734 1.00 0.00 C ATOM 2073 CG PHE A 137 -10.409 -0.337 -1.630 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -10.229 -1.575 -1.059 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -9.302 0.393 -1.997 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -9.009 -2.206 -1.116 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -8.060 -0.197 -2.008 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.936 -1.512 -1.625 1.00 0.00 C ATOM 0 H PHE A 137 -13.860 1.655 -1.710 1.00 0.00 H new ATOM 0 HA PHE A 137 -12.537 0.112 0.247 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -12.453 -0.664 -1.981 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -11.845 0.868 -2.575 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -11.056 -2.057 -0.560 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -9.409 1.431 -2.277 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.896 -3.223 -0.769 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -7.191 0.366 -2.314 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.982 -2.007 -1.725 1.00 0.00 H new ATOM 2088 N VAL A 138 -11.210 2.998 -0.749 1.00 0.00 N ATOM 2089 CA VAL A 138 -10.211 4.006 -0.571 1.00 0.00 C ATOM 2090 C VAL A 138 -10.244 4.671 0.762 1.00 0.00 C ATOM 2091 O VAL A 138 -9.212 4.870 1.401 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.218 4.967 -1.723 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.282 6.162 -1.475 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.612 4.137 -2.867 1.00 0.00 C ATOM 0 H VAL A 138 -11.773 3.182 -1.579 1.00 0.00 H new ATOM 0 HA VAL A 138 -9.247 3.498 -0.574 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.215 5.366 -1.906 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.316 6.834 -2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.604 6.697 -0.581 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.262 5.803 -1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.566 4.743 -3.772 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.606 3.819 -2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.233 3.260 -3.049 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.499 4.970 1.142 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.840 5.945 2.130 1.00 0.00 C ATOM 2106 C GLN A 139 -11.613 5.322 3.465 1.00 0.00 C ATOM 2107 O GLN A 139 -11.205 5.932 4.452 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.309 6.331 1.889 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.907 7.318 2.894 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.011 8.549 2.914 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -13.137 9.296 1.945 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -12.111 8.711 3.920 1.00 0.00 N ATOM 0 H GLN A 139 -12.315 4.509 0.740 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.237 6.852 2.079 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.394 6.760 0.891 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.911 5.422 1.897 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.923 7.588 2.608 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.964 6.869 3.885 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -12.077 8.039 4.687 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -11.470 9.504 3.908 1.00 0.00 H new ATOM 2121 N MET A 140 -11.893 4.017 3.630 1.00 0.00 N ATOM 2122 CA MET A 140 -11.537 3.198 4.747 1.00 0.00 C ATOM 2123 C MET A 140 -10.081 3.166 5.063 1.00 0.00 C ATOM 2124 O MET A 140 -9.679 3.047 6.219 1.00 0.00 O ATOM 2125 CB MET A 140 -12.033 1.772 4.454 1.00 0.00 C ATOM 2126 CG MET A 140 -11.748 0.570 5.357 1.00 0.00 C ATOM 2127 SD MET A 140 -12.787 -0.875 4.987 1.00 0.00 S ATOM 2128 CE MET A 140 -12.163 -1.430 3.375 1.00 0.00 C ATOM 0 H MET A 140 -12.411 3.494 2.924 1.00 0.00 H new ATOM 0 HA MET A 140 -12.008 3.634 5.628 1.00 0.00 H new ATOM 0 HB2 MET A 140 -13.117 1.838 4.366 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.648 1.511 3.468 1.00 0.00 H new ATOM 0 HG2 MET A 140 -10.700 0.290 5.256 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.901 0.861 6.396 1.00 0.00 H new ATOM 0 HE1 MET A 140 -12.711 -2.317 3.058 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.299 -0.637 2.639 1.00 0.00 H new ATOM 0 HE3 MET A 140 -11.103 -1.669 3.458 1.00 0.00 H new ATOM 2138 N MET A 141 -9.282 3.012 3.992 1.00 0.00 N ATOM 2139 CA MET A 141 -7.874 2.764 4.026 1.00 0.00 C ATOM 2140 C MET A 141 -7.090 3.984 4.368 1.00 0.00 C ATOM 2141 O MET A 141 -6.096 3.943 5.091 1.00 0.00 O ATOM 2142 CB MET A 141 -7.389 2.315 2.637 1.00 0.00 C ATOM 2143 CG MET A 141 -7.635 0.867 2.210 1.00 0.00 C ATOM 2144 SD MET A 141 -7.422 -0.459 3.435 1.00 0.00 S ATOM 2145 CE MET A 141 -7.981 -1.818 2.368 1.00 0.00 C ATOM 0 H MET A 141 -9.644 3.064 3.040 1.00 0.00 H new ATOM 0 HA MET A 141 -7.718 2.000 4.787 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.858 2.963 1.897 1.00 0.00 H new ATOM 0 HB3 MET A 141 -6.316 2.498 2.586 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.655 0.804 1.831 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.970 0.653 1.373 1.00 0.00 H new ATOM 0 HE1 MET A 141 -7.936 -2.757 2.920 1.00 0.00 H new ATOM 0 HE2 MET A 141 -9.007 -1.633 2.051 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.336 -1.881 1.492 1.00 0.00 H new ATOM 2155 N THR A 142 -7.540 5.193 3.987 1.00 0.00 N ATOM 2156 CA THR A 142 -6.910 6.467 4.141 1.00 0.00 C ATOM 2157 C THR A 142 -7.068 7.157 5.488 1.00 0.00 C ATOM 2158 O THR A 142 -8.223 7.138 5.990 1.00 0.00 O ATOM 2159 CB THR A 142 -7.399 7.521 3.192 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.811 7.667 3.214 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.069 7.206 1.724 1.00 0.00 C ATOM 0 H THR A 142 -8.443 5.284 3.521 1.00 0.00 H new ATOM 0 HA THR A 142 -5.880 6.154 3.970 1.00 0.00 H new ATOM 0 HB THR A 142 -6.891 8.422 3.536 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.135 7.578 4.135 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.448 8.005 1.086 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.989 7.127 1.603 1.00 0.00 H new ATOM 0 HG23 THR A 142 -7.536 6.263 1.440 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -12.975 -3.193 9.692 1.00 0.00 N ATOM 2171 CA ARG B 1 -12.032 -2.123 9.298 1.00 0.00 C ATOM 2172 C ARG B 1 -10.592 -2.497 9.390 1.00 0.00 C ATOM 2173 O ARG B 1 -9.851 -2.338 8.422 1.00 0.00 O ATOM 2174 CB ARG B 1 -12.309 -0.855 10.122 1.00 0.00 C ATOM 2175 CG ARG B 1 -11.595 0.403 9.622 1.00 0.00 C ATOM 2176 CD ARG B 1 -12.199 1.789 9.853 1.00 0.00 C ATOM 2177 NE ARG B 1 -13.298 1.937 8.858 1.00 0.00 N ATOM 2178 CZ ARG B 1 -13.678 3.066 8.192 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -12.944 4.206 8.345 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -14.674 2.980 7.262 1.00 0.00 N ATOM 0 H1 ARG B 1 -13.856 -3.097 9.147 1.00 0.00 H new ATOM 0 H2 ARG B 1 -12.547 -4.121 9.499 1.00 0.00 H new ATOM 0 H3 ARG B 1 -13.186 -3.114 10.707 1.00 0.00 H new ATOM 0 HA ARG B 1 -12.214 -1.940 8.239 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -13.383 -0.669 10.127 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -12.013 -1.038 11.155 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.602 0.407 10.071 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -11.458 0.288 8.547 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -12.580 1.883 10.870 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.448 2.568 9.721 1.00 0.00 H new ATOM 0 HE ARG B 1 -13.831 1.093 8.649 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -12.123 4.207 8.951 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -13.216 5.057 7.854 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -15.121 2.082 7.075 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -14.971 3.813 6.754 1.00 0.00 H new ATOM 2193 N ARG B 2 -10.104 -2.930 10.566 1.00 0.00 N ATOM 2194 CA ARG B 2 -8.743 -3.297 10.808 1.00 0.00 C ATOM 2195 C ARG B 2 -8.248 -4.404 9.942 1.00 0.00 C ATOM 2196 O ARG B 2 -7.215 -4.242 9.295 1.00 0.00 O ATOM 2197 CB ARG B 2 -8.503 -3.480 12.316 1.00 0.00 C ATOM 2198 CG ARG B 2 -7.018 -3.436 12.685 1.00 0.00 C ATOM 2199 CD ARG B 2 -6.500 -1.996 12.695 1.00 0.00 C ATOM 2200 NE ARG B 2 -5.026 -2.031 12.910 1.00 0.00 N ATOM 2201 CZ ARG B 2 -4.465 -1.779 14.128 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -5.161 -1.421 15.247 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -3.100 -1.814 14.137 1.00 0.00 N ATOM 0 H ARG B 2 -10.692 -3.029 11.394 1.00 0.00 H new ATOM 0 HA ARG B 2 -8.109 -2.468 10.493 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -9.033 -2.699 12.862 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -8.925 -4.433 12.634 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -6.870 -3.887 13.666 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -6.444 -4.028 11.972 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -6.735 -1.501 11.752 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -6.986 -1.423 13.485 1.00 0.00 H new ATOM 0 HE ARG B 2 -4.417 -2.250 12.122 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -6.176 -1.325 15.208 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -4.666 -1.250 16.122 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -2.589 -2.016 13.278 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -2.591 -1.638 15.003 1.00 0.00 H new ATOM 2217 N LYS B 3 -8.986 -5.506 9.718 1.00 0.00 N ATOM 2218 CA LYS B 3 -8.551 -6.531 8.821 1.00 0.00 C ATOM 2219 C LYS B 3 -8.328 -6.185 7.389 1.00 0.00 C ATOM 2220 O LYS B 3 -7.408 -6.685 6.744 1.00 0.00 O ATOM 2221 CB LYS B 3 -9.400 -7.812 8.764 1.00 0.00 C ATOM 2222 CG LYS B 3 -9.421 -8.559 10.098 1.00 0.00 C ATOM 2223 CD LYS B 3 -10.258 -9.832 9.949 1.00 0.00 C ATOM 2224 CE LYS B 3 -10.630 -10.486 11.281 1.00 0.00 C ATOM 2225 NZ LYS B 3 -11.757 -11.414 11.040 1.00 0.00 N ATOM 0 H LYS B 3 -9.887 -5.687 10.160 1.00 0.00 H new ATOM 0 HA LYS B 3 -7.596 -6.688 9.322 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -10.420 -7.556 8.478 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -9.008 -8.470 7.989 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -8.405 -8.811 10.403 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -9.840 -7.923 10.878 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -11.172 -9.593 9.405 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.705 -10.551 9.344 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -9.776 -11.024 11.692 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -10.911 -9.728 12.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -12.181 -11.689 11.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -12.474 -10.944 10.451 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -11.409 -12.263 10.550 1.00 0.00 H new ATOM 2239 N TRP B 4 -9.059 -5.163 6.909 1.00 0.00 N ATOM 2240 CA TRP B 4 -8.889 -4.594 5.608 1.00 0.00 C ATOM 2241 C TRP B 4 -7.620 -3.813 5.575 1.00 0.00 C ATOM 2242 O TRP B 4 -6.831 -4.032 4.657 1.00 0.00 O ATOM 2243 CB TRP B 4 -10.020 -3.637 5.195 1.00 0.00 C ATOM 2244 CG TRP B 4 -11.199 -4.421 4.670 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -12.426 -4.611 5.236 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -11.324 -4.839 3.297 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -13.300 -5.010 4.260 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -12.666 -5.148 3.047 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -10.466 -4.863 2.232 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -13.167 -5.587 1.852 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.923 -5.271 1.001 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -12.223 -5.697 0.859 1.00 0.00 C ATOM 0 H TRP B 4 -9.799 -4.715 7.450 1.00 0.00 H new ATOM 0 HA TRP B 4 -8.886 -5.434 4.913 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -10.326 -3.034 6.050 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -9.662 -2.948 4.430 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -12.668 -4.470 6.279 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -14.294 -5.183 4.413 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -9.436 -4.563 2.357 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -14.210 -5.825 1.702 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -10.262 -5.257 0.147 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -12.517 -6.141 -0.081 1.00 0.00 H new ATOM 2263 N GLN B 5 -7.342 -2.913 6.536 1.00 0.00 N ATOM 2264 CA GLN B 5 -6.205 -2.061 6.700 1.00 0.00 C ATOM 2265 C GLN B 5 -4.888 -2.745 6.833 1.00 0.00 C ATOM 2266 O GLN B 5 -3.894 -2.466 6.165 1.00 0.00 O ATOM 2267 CB GLN B 5 -6.476 -1.149 7.908 1.00 0.00 C ATOM 2268 CG GLN B 5 -7.574 -0.102 7.712 1.00 0.00 C ATOM 2269 CD GLN B 5 -7.878 0.645 9.003 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -8.097 0.100 10.084 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -7.931 2.001 8.918 1.00 0.00 N ATOM 0 H GLN B 5 -8.006 -2.768 7.296 1.00 0.00 H new ATOM 0 HA GLN B 5 -6.099 -1.498 5.773 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -6.743 -1.774 8.760 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -5.551 -0.635 8.167 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -7.266 0.608 6.945 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -8.480 -0.588 7.351 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -7.751 2.464 8.027 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -8.151 2.556 9.745 1.00 0.00 H new ATOM 2280 N LYS B 6 -4.861 -3.859 7.586 1.00 0.00 N ATOM 2281 CA LYS B 6 -3.796 -4.803 7.720 1.00 0.00 C ATOM 2282 C LYS B 6 -3.317 -5.289 6.396 1.00 0.00 C ATOM 2283 O LYS B 6 -2.201 -4.997 5.967 1.00 0.00 O ATOM 2284 CB LYS B 6 -4.311 -6.000 8.537 1.00 0.00 C ATOM 2285 CG LYS B 6 -3.358 -7.118 8.966 1.00 0.00 C ATOM 2286 CD LYS B 6 -4.189 -8.184 9.682 1.00 0.00 C ATOM 2287 CE LYS B 6 -3.444 -9.314 10.395 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.199 -9.689 9.688 1.00 0.00 N ATOM 0 H LYS B 6 -5.665 -4.122 8.156 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.959 -4.313 8.218 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -4.764 -5.599 9.443 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -5.110 -6.463 7.959 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.853 -7.544 8.099 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.583 -6.729 9.627 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -4.816 -7.681 10.418 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -4.858 -8.635 8.949 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.204 -9.005 11.412 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -4.094 -10.185 10.471 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.070 -10.720 9.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.262 -9.393 8.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.389 -9.218 10.138 1.00 0.00 H new ATOM 2302 N THR B 7 -4.184 -6.040 5.694 1.00 0.00 N ATOM 2303 CA THR B 7 -4.002 -6.795 4.493 1.00 0.00 C ATOM 2304 C THR B 7 -3.823 -5.931 3.292 1.00 0.00 C ATOM 2305 O THR B 7 -3.108 -6.274 2.352 1.00 0.00 O ATOM 2306 CB THR B 7 -5.054 -7.844 4.287 1.00 0.00 C ATOM 2307 OG1 THR B 7 -6.354 -7.288 4.152 1.00 0.00 O ATOM 2308 CG2 THR B 7 -5.109 -8.870 5.432 1.00 0.00 C ATOM 0 H THR B 7 -5.147 -6.126 6.020 1.00 0.00 H new ATOM 0 HA THR B 7 -3.065 -7.335 4.630 1.00 0.00 H new ATOM 0 HB THR B 7 -4.761 -8.342 3.363 1.00 0.00 H new ATOM 0 HG1 THR B 7 -6.716 -7.083 5.039 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.889 -9.603 5.226 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.147 -9.376 5.513 1.00 0.00 H new ATOM 0 HG23 THR B 7 -5.330 -8.358 6.369 1.00 0.00 H new ATOM 2316 N GLY B 8 -4.400 -4.719 3.217 1.00 0.00 N ATOM 2317 CA GLY B 8 -4.257 -3.819 2.115 1.00 0.00 C ATOM 2318 C GLY B 8 -2.995 -3.030 2.184 1.00 0.00 C ATOM 2319 O GLY B 8 -2.633 -2.375 1.208 1.00 0.00 O ATOM 0 H GLY B 8 -4.994 -4.349 3.959 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -4.278 -4.384 1.183 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -5.107 -3.137 2.094 1.00 0.00 H new ATOM 2323 N HIS B 9 -2.369 -3.002 3.374 1.00 0.00 N ATOM 2324 CA HIS B 9 -1.071 -2.510 3.716 1.00 0.00 C ATOM 2325 C HIS B 9 -0.012 -3.364 3.109 1.00 0.00 C ATOM 2326 O HIS B 9 0.929 -2.803 2.551 1.00 0.00 O ATOM 2327 CB HIS B 9 -0.818 -2.242 5.209 1.00 0.00 C ATOM 2328 CG HIS B 9 0.401 -1.459 5.597 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.523 -0.128 5.255 1.00 0.00 N ATOM 2330 CD2 HIS B 9 1.509 -1.808 6.305 1.00 0.00 C ATOM 2331 CE1 HIS B 9 1.699 0.285 5.799 1.00 0.00 C ATOM 2332 NE2 HIS B 9 2.307 -0.692 6.446 1.00 0.00 N ATOM 0 H HIS B 9 -2.838 -3.374 4.200 1.00 0.00 H new ATOM 0 HA HIS B 9 -1.027 -1.512 3.281 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -1.688 -1.718 5.604 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -0.768 -3.206 5.716 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.727 -2.793 6.691 1.00 0.00 H new ATOM 0 HE1 HIS B 9 2.088 1.289 5.712 1.00 0.00 H new ATOM 0 HE2 HIS B 9 3.192 -0.633 6.950 1.00 0.00 H new ATOM 2340 N ALA B 10 -0.074 -4.708 3.098 1.00 0.00 N ATOM 2341 CA ALA B 10 0.826 -5.590 2.422 1.00 0.00 C ATOM 2342 C ALA B 10 0.811 -5.423 0.942 1.00 0.00 C ATOM 2343 O ALA B 10 1.874 -5.448 0.323 1.00 0.00 O ATOM 2344 CB ALA B 10 0.394 -7.009 2.829 1.00 0.00 C ATOM 0 H ALA B 10 -0.806 -5.213 3.598 1.00 0.00 H new ATOM 0 HA ALA B 10 1.855 -5.373 2.709 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.043 -7.740 2.346 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.470 -7.116 3.911 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.637 -7.178 2.519 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.379 -5.271 0.334 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.642 -5.166 -1.068 1.00 0.00 C ATOM 2352 C VAL B 11 -0.007 -3.915 -1.569 1.00 0.00 C ATOM 2353 O VAL B 11 0.756 -3.872 -2.532 1.00 0.00 O ATOM 2354 CB VAL B 11 -2.125 -5.046 -1.263 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.527 -4.700 -2.706 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.787 -6.369 -0.844 1.00 0.00 C ATOM 0 H VAL B 11 -1.239 -5.217 0.879 1.00 0.00 H new ATOM 0 HA VAL B 11 -0.253 -6.036 -1.597 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.468 -4.218 -0.642 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.613 -4.629 -2.774 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.082 -3.746 -2.989 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.171 -5.480 -3.380 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.866 -6.295 -0.981 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.398 -7.181 -1.458 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -2.567 -6.570 0.205 1.00 0.00 H new ATOM 2366 N ARG B 12 -0.232 -2.832 -0.804 1.00 0.00 N ATOM 2367 CA ARG B 12 0.326 -1.539 -1.053 1.00 0.00 C ATOM 2368 C ARG B 12 1.814 -1.601 -1.101 1.00 0.00 C ATOM 2369 O ARG B 12 2.468 -1.073 -1.998 1.00 0.00 O ATOM 2370 CB ARG B 12 -0.110 -0.572 0.062 1.00 0.00 C ATOM 2371 CG ARG B 12 0.370 0.872 -0.096 1.00 0.00 C ATOM 2372 CD ARG B 12 -0.258 1.791 0.954 1.00 0.00 C ATOM 2373 NE ARG B 12 0.224 3.170 0.661 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.183 4.326 1.261 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.226 4.299 2.142 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.285 5.535 0.835 1.00 0.00 N ATOM 0 H ARG B 12 -0.828 -2.859 0.023 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.036 -1.185 -2.018 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -1.199 -0.571 0.114 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.254 -0.956 1.015 1.00 0.00 H new ATOM 0 HG2 ARG B 12 1.456 0.907 -0.009 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.119 1.233 -1.093 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -1.346 1.744 0.908 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.032 1.485 1.959 1.00 0.00 H new ATOM 0 HE ARG B 12 0.934 3.260 -0.066 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.696 3.418 2.349 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.535 5.160 2.594 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.946 5.581 0.060 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.027 6.392 1.292 1.00 0.00 H new ATOM 2390 N ALA B 13 2.404 -2.278 -0.099 1.00 0.00 N ATOM 2391 CA ALA B 13 3.792 -2.413 0.215 1.00 0.00 C ATOM 2392 C ALA B 13 4.470 -3.120 -0.908 1.00 0.00 C ATOM 2393 O ALA B 13 5.497 -2.660 -1.403 1.00 0.00 O ATOM 2394 CB ALA B 13 4.026 -2.986 1.622 1.00 0.00 C ATOM 0 H ALA B 13 1.833 -2.793 0.571 1.00 0.00 H new ATOM 0 HA ALA B 13 4.265 -1.434 0.290 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.097 -3.067 1.808 1.00 0.00 H new ATOM 0 HB2 ALA B 13 3.578 -2.324 2.363 1.00 0.00 H new ATOM 0 HB3 ALA B 13 3.569 -3.973 1.693 1.00 0.00 H new ATOM 2400 N ILE B 14 3.864 -4.228 -1.371 1.00 0.00 N ATOM 2401 CA ILE B 14 4.458 -4.970 -2.440 1.00 0.00 C ATOM 2402 C ILE B 14 4.472 -4.304 -3.773 1.00 0.00 C ATOM 2403 O ILE B 14 5.448 -4.361 -4.519 1.00 0.00 O ATOM 2404 CB ILE B 14 4.183 -6.443 -2.506 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.050 -7.343 -3.403 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.687 -6.750 -2.687 1.00 0.00 C ATOM 2407 CD1 ILE B 14 6.560 -7.353 -3.169 1.00 0.00 C ATOM 0 H ILE B 14 2.985 -4.604 -1.016 1.00 0.00 H new ATOM 0 HA ILE B 14 5.494 -4.941 -2.104 1.00 0.00 H new ATOM 0 HB ILE B 14 4.524 -6.741 -1.514 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.689 -8.366 -3.296 1.00 0.00 H new ATOM 0 HG13 ILE B 14 4.875 -7.050 -4.438 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.540 -7.829 -2.729 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.127 -6.340 -1.847 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.333 -6.299 -3.614 1.00 0.00 H new ATOM 0 HD11 ILE B 14 7.033 -8.033 -3.877 1.00 0.00 H new ATOM 0 HD12 ILE B 14 6.957 -6.348 -3.311 1.00 0.00 H new ATOM 0 HD13 ILE B 14 6.768 -7.685 -2.152 1.00 0.00 H new ATOM 2419 N GLY B 15 3.426 -3.558 -4.171 1.00 0.00 N ATOM 2420 CA GLY B 15 3.245 -2.874 -5.414 1.00 0.00 C ATOM 2421 C GLY B 15 4.003 -1.592 -5.467 1.00 0.00 C ATOM 2422 O GLY B 15 3.929 -0.796 -6.401 1.00 0.00 O ATOM 0 H GLY B 15 2.624 -3.422 -3.555 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.567 -3.519 -6.232 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.184 -2.673 -5.565 1.00 0.00 H new ATOM 2426 N ARG B 16 4.736 -1.239 -4.396 1.00 0.00 N ATOM 2427 CA ARG B 16 5.631 -0.126 -4.471 1.00 0.00 C ATOM 2428 C ARG B 16 7.008 -0.597 -4.791 1.00 0.00 C ATOM 2429 O ARG B 16 7.743 0.106 -5.482 1.00 0.00 O ATOM 2430 CB ARG B 16 5.446 0.601 -3.129 1.00 0.00 C ATOM 2431 CG ARG B 16 6.162 1.940 -2.940 1.00 0.00 C ATOM 2432 CD ARG B 16 5.358 2.823 -1.983 1.00 0.00 C ATOM 2433 NE ARG B 16 6.052 4.111 -1.701 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.695 4.915 -0.658 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.412 4.868 -0.193 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.585 5.718 -0.006 1.00 0.00 N ATOM 0 H ARG B 16 4.711 -1.714 -3.494 1.00 0.00 H new ATOM 0 HA ARG B 16 5.429 0.579 -5.277 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.379 0.768 -2.982 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.775 -0.070 -2.336 1.00 0.00 H new ATOM 0 HG2 ARG B 16 7.164 1.775 -2.543 1.00 0.00 H new ATOM 0 HG3 ARG B 16 6.278 2.440 -3.901 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.377 3.026 -2.413 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.192 2.288 -1.048 1.00 0.00 H new ATOM 0 HE ARG B 16 6.819 4.401 -2.307 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.736 4.238 -0.625 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.130 5.463 0.586 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.563 5.734 -0.294 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.272 6.303 0.769 1.00 0.00 H new ATOM 2450 N LEU B 17 7.338 -1.861 -4.471 1.00 0.00 N ATOM 2451 CA LEU B 17 8.537 -2.507 -4.906 1.00 0.00 C ATOM 2452 C LEU B 17 8.459 -2.941 -6.330 1.00 0.00 C ATOM 2453 O LEU B 17 9.345 -2.695 -7.147 1.00 0.00 O ATOM 2454 CB LEU B 17 8.782 -3.645 -3.901 1.00 0.00 C ATOM 2455 CG LEU B 17 9.563 -3.322 -2.616 1.00 0.00 C ATOM 2456 CD1 LEU B 17 9.379 -4.458 -1.595 1.00 0.00 C ATOM 2457 CD2 LEU B 17 11.079 -3.240 -2.864 1.00 0.00 C ATOM 0 H LEU B 17 6.748 -2.455 -3.888 1.00 0.00 H new ATOM 0 HA LEU B 17 9.392 -1.830 -4.909 1.00 0.00 H new ATOM 0 HB2 LEU B 17 7.812 -4.047 -3.609 1.00 0.00 H new ATOM 0 HB3 LEU B 17 9.313 -4.442 -4.422 1.00 0.00 H new ATOM 0 HG LEU B 17 9.180 -2.365 -2.260 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.934 -4.224 -0.687 1.00 0.00 H new ATOM 0 HD12 LEU B 17 8.321 -4.565 -1.356 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.751 -5.391 -2.018 1.00 0.00 H new ATOM 0 HD21 LEU B 17 11.589 -3.010 -1.928 1.00 0.00 H new ATOM 0 HD22 LEU B 17 11.437 -4.196 -3.247 1.00 0.00 H new ATOM 0 HD23 LEU B 17 11.287 -2.456 -3.593 1.00 0.00 H new ATOM 2469 N SER B 18 7.404 -3.733 -6.591 1.00 0.00 N ATOM 2470 CA SER B 18 7.258 -4.273 -7.907 1.00 0.00 C ATOM 2471 C SER B 18 6.805 -3.297 -8.938 1.00 0.00 C ATOM 2472 O SER B 18 5.817 -2.614 -8.672 1.00 0.00 O ATOM 2473 CB SER B 18 6.162 -5.343 -7.769 1.00 0.00 C ATOM 2474 OG SER B 18 6.029 -6.172 -8.914 1.00 0.00 O ATOM 0 H SER B 18 6.679 -3.992 -5.922 1.00 0.00 H new ATOM 0 HA SER B 18 8.230 -4.631 -8.245 1.00 0.00 H new ATOM 0 HB2 SER B 18 6.382 -5.967 -6.903 1.00 0.00 H new ATOM 0 HB3 SER B 18 5.209 -4.852 -7.574 1.00 0.00 H new ATOM 0 HG SER B 18 5.319 -6.830 -8.761 1.00 0.00 H new ATOM 2480 N SER B 19 7.498 -3.117 -10.076 1.00 0.00 N ATOM 2481 CA SER B 19 7.254 -2.190 -11.138 1.00 0.00 C ATOM 2482 C SER B 19 6.206 -2.617 -12.155 1.00 0.00 C ATOM 2483 O SER B 19 5.107 -2.004 -12.095 1.00 0.00 O ATOM 2484 CB SER B 19 8.555 -1.856 -11.887 1.00 0.00 C ATOM 2485 OG SER B 19 9.526 -1.286 -11.022 1.00 0.00 O ATOM 2486 OXT SER B 19 6.458 -3.524 -12.993 1.00 0.00 O ATOM 0 H SER B 19 8.321 -3.687 -10.271 1.00 0.00 H new ATOM 0 HA SER B 19 6.851 -1.314 -10.630 1.00 0.00 H new ATOM 0 HB2 SER B 19 8.958 -2.762 -12.339 1.00 0.00 H new ATOM 0 HB3 SER B 19 8.339 -1.162 -12.700 1.00 0.00 H new ATOM 0 HG SER B 19 10.340 -1.088 -11.530 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 14.764 -13.620 5.197 1.00 0.00 CA HETATM 2494 CA CA A 152 20.735 -3.780 3.478 1.00 0.00 CA HETATM 2495 CA CA A 153 -14.228 -7.475 -9.515 1.00 0.00 CA HETATM 2496 CA CA A 154 -21.454 -1.324 -2.262 1.00 0.00 CA