data_2nss_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2nss _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 3.546 0 N-CA-C 116.131 1.213 . . . . 37.18 116.131 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.2 mp -106.18 153.76 21.67 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 108.489 -0.93 . . . . 33.14 108.489 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 86.7 p -70.89 169.07 15.52 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.873 0.844 . . . . 31.47 112.438 171.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.05 -36.2 82.78 Favored 'General case' 0 CA--C 1.49 -1.342 0 CA-C-N 114.477 -1.238 . . . . 45.17 113.225 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.45 -37.58 85.81 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 108.341 -1.904 . . . . 25.92 108.341 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -67.31 -55.96 11.75 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 117.818 -1.087 . . . . 24.75 109.692 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -46.08 -37.96 7.43 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 114.783 1.401 . . . . 24.9 114.783 169.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -65.23 -43.24 92.08 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 114.138 1.162 . . . . 35.16 114.138 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -60.23 -45.55 92.82 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 114.381 1.252 . . . . 39.4 114.381 172.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 56.8 t -54.59 -48.21 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 124.601 1.188 . . . . 22.7 108.471 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 77.2 mt -81.47 -23.27 37.52 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.332 -0.547 . . . . 26.64 111.418 -170.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . 0.578 ' CB ' ' O ' ' A' ' 461' ' ' HOH . 9.3 t-20 -62.26 -55.34 29.36 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 122.129 0.966 . . . . 37.35 109.522 169.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.72 -46.12 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 114.542 -1.208 . . . . 26.61 113.514 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -63.1 -39.39 94.57 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.456 0.539 . . . . 28.0 112.456 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.32 -43.2 43.15 Favored Glycine 0 N--CA 1.483 1.81 0 CA-C-O 118.447 -1.196 . . . . 29.3 114.396 171.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 0.619 ' CB ' ' O ' ' A' ' 463' ' ' HOH . 0.0 OUTLIER -63.8 -50.38 69.19 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 127.68 2.392 . . . . 33.86 110.5 174.783 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -48.08 -39.55 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 C-N-CA 123.781 0.832 . . . . 29.27 112.262 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . 0.745 ' OE2' ' O ' ' A' ' 460' ' ' HOH . 63.3 mt-10 -72.82 -12.63 61.06 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 114.81 1.411 . . . . 38.84 114.81 -175.056 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.07 -21.68 43.1 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.672 -1.233 . . . . 29.89 107.672 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -146.62 58.52 1.19 Allowed 'General case' 0 C--O 1.184 -2.359 0 CA-C-N 113.847 -1.524 . . . . 36.02 108.704 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 tp -62.64 -53.38 47.78 Favored 'Isoleucine or valine' 0 C--O 1.265 1.874 0 C-N-CA 123.923 0.889 . . . . 32.42 111.837 -172.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.0 -49.54 60.2 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.628 1.714 . . . . 22.3 115.628 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.71 -45.6 74.56 Favored Glycine 0 CA--C 1.546 2.021 0 CA-C-N 115.578 -0.737 . . . . 19.77 111.682 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -58.24 -46.21 86.37 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.48 -1.6 . . . . 22.08 112.815 169.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.23 -45.82 95.23 Favored Glycine 0 N--CA 1.481 1.641 0 C-N-CA 123.773 0.701 . . . . 20.36 112.517 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -53.61 -58.17 8.13 Favored 'General case' 0 C--O 1.208 -1.13 0 C-N-CA 124.651 1.18 . . . . 31.79 110.068 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -58.82 -38.37 78.5 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 116.663 2.097 . . . . 35.37 116.663 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.44 -44.68 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.214 0 CA-C-O 118.738 -0.649 . . . . 20.09 111.166 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.03 -41.95 81.36 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 109.382 -0.599 . . . . 25.74 109.382 -179.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.2 mt -63.7 -43.62 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 119.914 -0.714 . . . . 20.25 112.014 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -54.59 -45.52 73.62 Favored 'General case' 0 C--O 1.268 2.07 0 C-N-CA 120.114 -0.635 . . . . 28.1 112.634 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.85 -51.88 62.62 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 112.449 0.537 . . . . 26.19 112.449 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -61.74 -38.69 88.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.856 1.262 . . . . 24.21 112.827 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.9 p -80.27 -38.38 30.96 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.967 1.307 . . . . 24.47 113.041 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.72 -24.38 70.08 Favored Glycine 0 C--O 1.208 -1.515 0 C-N-CA 119.577 -1.297 . . . . 25.72 114.872 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -144.56 75.42 14.85 Favored Pre-proline 0 C--O 1.204 -1.297 0 N-CA-C 106.68 -1.6 . . . . 30.58 106.68 -173.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -60.42 -15.46 35.85 Favored 'Trans proline' 0 CA--C 1.556 1.607 0 C-N-CA 123.845 3.03 . . . . 34.08 114.713 -172.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -70.55 -17.1 62.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.393 0.886 . . . . 38.08 113.393 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.4 p -71.48 -17.86 62.33 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 107.911 -1.144 . . . . 35.52 107.911 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.15 -26.27 33.6 Favored 'General case' 0 CA--C 1.56 1.327 0 CA-C-N 113.937 -1.483 . . . . 36.86 113.615 -169.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -79.98 -8.41 59.33 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 110.038 -0.356 . . . . 38.68 110.038 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -65.52 -8.93 22.04 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 112.641 0.608 . . . . 37.28 112.641 162.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.56 103.46 5.92 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 118.513 0.597 . . . . 36.72 111.553 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . 0.508 ' OD1' ' CE ' ' A' ' 47' ' ' LYS . 93.0 m-20 -57.98 -47.08 84.03 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 119.956 -0.698 . . . . 39.82 112.04 176.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -52.0 -19.23 1.72 Allowed 'General case' 0 CA--C 1.561 1.37 0 N-CA-C 115.699 1.74 . . . . 45.25 115.699 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -114.6 -7.1 12.79 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 114.939 1.459 . . . . 37.1 114.939 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . 0.508 ' CE ' ' OD1' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -66.98 -27.92 67.84 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 113.288 0.848 . . . . 41.24 113.288 -173.317 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -66.42 -20.37 66.04 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 113.212 0.819 . . . . 45.32 113.212 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.88 95.31 2.93 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.007 -1.108 . . . . 44.78 108.007 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -91.47 -19.64 22.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.513 -1.676 . . . . 44.3 113.154 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.0 p -130.31 156.82 44.04 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.217 1.192 . . . . 42.32 114.217 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.63 -41.35 69.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 114.31 1.226 . . . . 46.33 114.31 170.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.34 77.75 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.979 0.912 . . . . 38.71 111.805 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -66.0 -39.42 90.28 Favored 'General case' 0 C--O 1.26 1.622 0 C-N-CA 120.678 -0.409 . . . . 42.89 111.066 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.8 mtt -59.76 -42.94 94.38 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.668 -0.493 . . . . 33.08 109.668 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -72.58 -23.82 61.01 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.025 1.12 . . . . 42.13 114.025 -177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.23 -13.08 47.9 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 123.721 0.638 . . . . 33.26 111.497 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -77.41 110.71 12.4 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.77 1.228 . . . . 31.15 112.953 -171.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -62.41 -33.09 74.1 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.116 1.154 . . . . 38.04 114.116 172.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -70.97 -29.35 65.32 Favored 'General case' 0 C--O 1.281 2.721 0 CA-C-O 121.305 0.574 . . . . 34.04 109.834 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.9 tt -71.6 -46.75 58.31 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 116.257 -0.429 . . . . 23.98 110.385 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -46.06 -50.17 15.47 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 114.173 1.175 . . . . 35.1 114.173 164.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 66.9 tttt -64.79 -45.27 86.98 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.283 1.033 . . . . 28.72 110.342 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.32 -50.07 74.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.082 0.864 . . . . 29.91 113.212 172.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -54.16 -41.11 69.0 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 114.443 0.537 . . . . 21.51 114.443 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.2 m -61.6 -44.94 96.08 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.173 0.989 . . . . 24.82 111.511 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.63 -49.39 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 O-C-N 121.459 -0.776 . . . . 19.57 110.511 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.01 -56.45 15.79 Favored 'Isoleucine or valine' 0 C--O 1.271 2.216 0 N-CA-C 114.17 1.174 . . . . 20.46 114.17 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.55 -36.8 84.86 Favored 'General case' 0 C--O 1.266 1.965 0 N-CA-C 114.115 1.154 . . . . 25.08 114.115 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -57.96 -47.34 83.23 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.335 -1.346 . . . . 20.1 113.492 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.88 -45.15 90.87 Favored 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.87 1.433 . . . . 18.72 114.87 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.4 tp -60.21 -42.57 95.41 Favored 'General case' 0 CA--C 1.563 1.448 0 O-C-N 121.616 -0.677 . . . . 22.49 111.128 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.23 54.98 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 111.439 -0.664 . . . . 22.79 111.439 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -52.52 -41.95 56.98 Favored Glycine 0 N--CA 1.507 3.405 0 C-N-CA 120.009 -1.091 . . . . 26.29 112.683 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.13 -54.95 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 O-C-N 122.387 -0.478 . . . . 29.88 110.548 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -53.02 -39.0 62.83 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.542 1.137 . . . . 24.87 113.021 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -71.15 -8.96 57.06 Favored 'General case' 0 C--O 1.209 -1.065 0 O-C-N 124.399 1.062 . . . . 32.97 112.18 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -85.07 -2.43 57.98 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-N 118.754 0.707 . . . . 32.24 110.416 174.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt 45.35 50.39 9.97 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.392 0.886 . . . . 30.21 113.392 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.01 -10.18 71.67 Favored Glycine 0 N--CA 1.475 1.243 0 N-CA-C 117.123 1.609 . . . . 25.89 117.123 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 73.7 m80 -94.42 52.81 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.032 1.733 . . . . 35.18 110.461 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HIS . . . . . 0.425 ' NE2' ' OD2' ' A' ' 141' ' ' ASP . 1.3 p-80 -114.04 14.33 18.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.744 1.016 . . . . 22.83 113.744 -163.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -44.5 -50.91 9.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 115.533 1.679 . . . . 43.06 115.533 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.32 80.37 Favored 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 114.287 1.217 . . . . 24.76 114.287 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -81.11 -33.9 32.95 Favored 'General case' 0 C--O 1.244 0.798 0 C-N-CA 124.87 1.268 . . . . 31.27 113.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.7 tt -81.32 -40.88 22.93 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.47 -0.769 . . . . 25.46 109.853 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -45.59 -59.83 4.08 Favored Pre-proline 0 C--O 1.253 1.285 0 N-CA-C 116.025 1.861 . . . . 28.8 116.025 -178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -60.55 -29.36 88.39 Favored 'Trans proline' 0 C--N 1.353 0.791 0 O-C-N 122.959 0.978 . . . . 22.65 112.895 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 mt -79.58 -43.24 23.33 Favored 'General case' 0 N--CA 1.427 -1.612 0 O-C-N 124.206 0.941 . . . . 24.74 109.81 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.8 -49.63 70.49 Favored 'General case' 0 C--O 1.251 1.133 0 O-C-N 123.592 0.557 . . . . 19.66 112.013 167.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 462' ' ' HOH 0.283 51.9 mt-30 -59.83 -49.18 78.71 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 118.488 -0.768 . . . . 26.91 112.05 178.308 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.8 p -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 118.664 -1.215 . . . . 20.79 113.774 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . 0.258 27.4 m80 -66.79 -34.56 78.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 116.02 1.859 . . . . 21.01 116.02 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.32 -39.48 39.51 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.148 0.979 . . . . 23.27 112.168 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.5 m -91.18 -51.0 5.53 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 115.804 1.779 . . . . 30.1 115.804 -171.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.8 tttm -93.86 -52.21 4.53 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 123.992 0.917 . . . . 27.23 112.021 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -82.92 -20.34 35.54 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 120.18 -0.608 . . . . 20.5 111.443 -174.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt 48.42 58.52 5.11 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.003 1.721 . . . . 34.7 114.878 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.7 mm -95.86 116.46 66.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 108.634 -0.876 . . . . 21.87 108.634 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.72 151.08 72.93 Favored 'Trans proline' 0 C--O 1.287 2.959 0 C-N-CA 117.412 -1.259 . . . . 22.2 112.367 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . 0.284 15.9 tt -66.4 -24.39 33.23 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.058 0 C-N-CA 118.926 -1.11 . . . . 25.03 110.846 -173.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -54.81 -29.42 54.65 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.079 0.552 . . . . 30.12 111.596 174.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . 0.594 ' CD1' ' O ' ' A' ' 458' ' ' HOH . 8.2 m-30 -73.89 -33.64 64.1 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.454 -1.404 . . . . 36.35 112.166 177.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.7 tp -57.69 -44.44 85.83 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 114.636 -1.166 . . . . 25.62 114.075 165.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.78 -59.32 4.77 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.667 0.787 . . . . 28.01 112.187 165.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -47.54 -45.56 26.92 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 118.162 2.653 . . . . 27.95 118.162 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.73 -29.98 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 113.106 0.78 . . . . 23.55 113.106 -179.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.3 m -63.57 -53.85 45.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.194 -0.669 . . . . 21.93 109.194 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASP . . . . . 0.482 ' OD2' ' O ' ' A' ' 385' ' ' HOH . 86.8 m-20 -51.28 -44.99 61.96 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 117.41 -1.281 . . . . 26.21 113.258 168.718 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.71 -42.33 83.55 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.727 1.149 . . . . 20.48 111.097 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.94 -47.89 89.9 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.763 0 N-CA-C 114.521 1.304 . . . . 22.62 114.521 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.5 mm -60.63 -44.8 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 C-N-CA 124.677 1.191 . . . . 20.35 108.928 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -58.91 -49.87 76.17 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 118.66 -1.216 . . . . 19.68 112.97 175.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 79.6 t -62.35 -42.06 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.526 0 O-C-N 123.733 0.645 . . . . 19.62 109.278 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.8 mt -53.72 -49.67 67.59 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 113.406 0.891 . . . . 22.07 113.406 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -64.19 -34.04 77.18 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.382 0.882 . . . . 24.12 113.382 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.9 t -77.96 -33.53 51.51 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.431 -0.952 . . . . 28.99 108.431 -169.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -85.13 -26.33 26.93 Favored 'General case' 0 C--O 1.259 1.554 0 N-CA-C 113.954 1.094 . . . . 27.58 113.954 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -129.2 64.84 72.52 Favored Pre-proline 0 C--O 1.206 -1.218 0 N-CA-C 114.091 1.145 . . . . 26.57 114.091 176.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.2 118.59 5.54 Favored 'Trans proline' 0 CA--C 1.571 2.369 0 C-N-CA 122.78 2.32 . . . . 22.1 111.751 -171.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 80.45 2.63 89.65 Favored Glycine 0 C--O 1.213 -1.178 0 CA-C-O 118.204 -1.331 . . . . 21.81 113.12 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -100.75 -12.09 19.38 Favored 'General case' 0 C--O 1.27 2.158 0 N-CA-C 115.282 1.586 . . . . 32.57 115.282 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -99.61 88.74 3.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 124.133 0.896 . . . . 22.35 108.647 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -52.74 153.48 6.63 Favored Glycine 0 N--CA 1.492 2.367 0 CA-C-N 113.356 -1.747 . . . . 20.12 115.138 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.95 -38.93 83.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.029 0.414 . . . . 18.42 111.125 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -67.5 -39.78 85.19 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.132 0.573 . . . . 24.97 111.608 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.19 -47.96 83.73 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.62 1.711 . . . . 20.56 115.62 172.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.14 -38.08 72.98 Favored 'General case' 0 C--O 1.261 1.696 0 N-CA-C 111.762 0.282 . . . . 25.96 111.762 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -65.03 -45.68 91.37 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 120.226 -0.987 . . . . 19.55 112.931 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.62 87.94 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.942 0.897 . . . . 16.83 112.71 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 35.7 tpp -62.76 -51.0 68.82 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.973 -0.558 . . . . 28.67 111.286 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 61.4 m -50.84 -52.36 42.14 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.29 1.036 . . . . 19.51 109.098 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -58.85 -43.23 90.75 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 113.426 0.899 . . . . 27.94 113.426 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.45 -43.73 79.79 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.86 -1.136 . . . . 20.48 111.353 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.9 -35.29 72.24 Favored 'General case' 0 C--O 1.26 1.644 0 C-N-CA 123.282 0.633 . . . . 21.59 111.06 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -70.88 -41.89 70.74 Favored 'General case' 0 C--O 1.188 -2.177 0 CA-C-O 118.425 -0.798 . . . . 24.06 111.907 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 29.8 tp -50.37 -48.74 55.59 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.995 0.903 . . . . 24.31 113.41 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.88 -55.38 35.58 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.889 1.676 . . . . 28.77 111.18 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 ttp-105 -55.52 -39.55 70.67 Favored 'General case' 0 C--O 1.253 1.258 0 C-N-CA 126.025 1.73 . . . . 25.97 114.09 172.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . 0.265 20.4 t30 -65.39 -40.41 93.43 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 115.445 1.646 . . . . 31.13 115.445 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASP . . . . . 0.425 ' OD2' ' NE2' ' A' ' 82' ' ' HIS . 96.7 m-20 -73.81 -32.57 63.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 107.854 -1.165 . . . . 28.46 107.854 179.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.57 -43.29 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 N-CA-C 114.359 1.244 . . . . 25.41 114.359 170.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.12 71.68 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-N 116.023 -0.535 . . . . 18.32 110.61 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.26 73.01 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 108.956 -0.757 . . . . 19.78 108.956 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -64.77 -46.18 83.19 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.368 0.667 . . . . 33.9 112.337 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -54.86 -43.19 72.87 Favored 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 114.805 1.409 . . . . 22.04 114.805 173.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -63.56 -40.67 97.58 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.347 -0.845 . . . . 27.03 108.843 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -57.52 -35.27 70.04 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.747 0.784 . . . . 29.58 111.669 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 33.7 mt -95.1 2.4 55.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.228 1.011 . . . . 25.89 113.365 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.36 78.19 Favored Glycine 0 C--N 1.347 1.169 0 C-N-CA 125.077 1.322 . . . . 21.71 110.496 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -79.22 117.3 20.11 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.02 -1.072 . . . . 31.13 108.714 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 113.137 0.792 . . . . 39.65 113.137 166.432 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HEM . . . . . 0.461 ' CBC' ' CD2' ' A' ' 103' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' HOH . . . . . 0.482 ' O ' ' OD2' ' A' ' 109' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 398' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' HOH . . . . . 0.594 ' O ' ' CD1' ' A' ' 103' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' HOH . . . . . 0.745 ' O ' ' OE2' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' HOH . . . . . 0.578 ' O ' ' CB ' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' HOH . . . . . 0.43 ' O ' ' OE1' ' A' ' 91' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' HOH . . . . . 0.619 ' O ' ' CB ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' HOH . . . . . 0.598 ' O ' ' CE ' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 3.546 0 N-CA-C 116.131 1.213 . . . . 37.18 116.131 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.2 mp -106.18 153.76 21.67 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 108.489 -0.93 . . . . 33.14 108.489 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 86.7 p -70.89 169.07 15.52 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.873 0.844 . . . . 31.47 112.438 171.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.05 -36.2 82.78 Favored 'General case' 0 CA--C 1.49 -1.342 0 CA-C-N 114.477 -1.238 . . . . 45.17 113.225 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.45 -37.58 85.81 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 108.341 -1.904 . . . . 25.92 108.341 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -67.31 -55.96 11.75 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 117.818 -1.087 . . . . 24.75 109.692 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TRP . . . . . 0.633 ' HB3' ' HD2' ' A' ' 79' ' ' LYS . 56.6 m95 -46.08 -37.96 7.43 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 114.783 1.401 . . . . 24.9 114.783 169.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -65.23 -43.24 92.08 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 114.138 1.162 . . . . 35.16 114.138 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -60.23 -45.55 92.82 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 114.381 1.252 . . . . 39.4 114.381 172.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 56.8 t -54.59 -48.21 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 124.601 1.188 . . . . 22.7 108.471 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 77.2 mt -81.47 -23.27 37.52 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.332 -0.547 . . . . 26.64 111.418 -170.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . 1.01 ' HB2' ' O ' ' A' ' 461' ' ' HOH . 9.3 t-20 -62.26 -55.34 29.36 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 122.129 0.966 . . . . 37.35 109.522 169.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.72 -46.12 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 114.542 -1.208 . . . . 26.61 113.514 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -63.1 -39.39 94.57 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.456 0.539 . . . . 28.0 112.456 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.32 -43.2 43.15 Favored Glycine 0 N--CA 1.483 1.81 0 CA-C-O 118.447 -1.196 . . . . 29.3 114.396 171.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 0.948 ' HB2' ' O ' ' A' ' 463' ' ' HOH . 0.0 OUTLIER -63.8 -50.38 69.19 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 127.68 2.392 . . . . 33.86 110.5 174.783 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -48.08 -39.55 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 C-N-CA 123.781 0.832 . . . . 29.27 112.262 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.745 ' OE2' ' O ' ' A' ' 460' ' ' HOH . 63.3 mt-10 -72.82 -12.63 61.06 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 114.81 1.411 . . . . 38.84 114.81 -175.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.07 -21.68 43.1 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.672 -1.233 . . . . 29.89 107.672 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -146.62 58.52 1.19 Allowed 'General case' 0 C--O 1.184 -2.359 0 CA-C-N 113.847 -1.524 . . . . 36.02 108.704 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 tp -62.64 -53.38 47.78 Favored 'Isoleucine or valine' 0 C--O 1.265 1.874 0 C-N-CA 123.923 0.889 . . . . 32.42 111.837 -172.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.0 -49.54 60.2 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.628 1.714 . . . . 22.3 115.628 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.71 -45.6 74.56 Favored Glycine 0 CA--C 1.546 2.021 0 CA-C-N 115.578 -0.737 . . . . 19.77 111.682 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -58.24 -46.21 86.37 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.48 -1.6 . . . . 22.08 112.815 169.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.23 -45.82 95.23 Favored Glycine 0 N--CA 1.481 1.641 0 C-N-CA 123.773 0.701 . . . . 20.36 112.517 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 30' ' ' ILE . 44.8 tt0 -53.61 -58.17 8.13 Favored 'General case' 0 C--O 1.208 -1.13 0 C-N-CA 124.651 1.18 . . . . 31.79 110.068 175.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -58.82 -38.37 78.5 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 116.663 2.097 . . . . 35.37 116.663 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.44 -44.68 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.214 0 CA-C-O 118.738 -0.649 . . . . 20.09 111.166 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.03 -41.95 81.36 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 109.382 -0.599 . . . . 25.74 109.382 -179.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 26' ' ' GLN . 4.2 mt -63.7 -43.62 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 119.914 -0.714 . . . . 20.25 112.014 179.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -54.59 -45.52 73.62 Favored 'General case' 0 C--O 1.268 2.07 0 C-N-CA 120.114 -0.635 . . . . 28.1 112.634 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.85 -51.88 62.62 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 112.449 0.537 . . . . 26.19 112.449 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -61.74 -38.69 88.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.856 1.262 . . . . 24.21 112.827 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.9 p -80.27 -38.38 30.96 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.967 1.307 . . . . 24.47 113.041 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.72 -24.38 70.08 Favored Glycine 0 C--O 1.208 -1.515 0 C-N-CA 119.577 -1.297 . . . . 25.72 114.872 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -144.56 75.42 14.85 Favored Pre-proline 0 C--O 1.204 -1.297 0 N-CA-C 106.68 -1.6 . . . . 30.58 106.68 -173.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -60.42 -15.46 35.85 Favored 'Trans proline' 0 CA--C 1.556 1.607 0 C-N-CA 123.845 3.03 . . . . 34.08 114.713 -172.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -70.55 -17.1 62.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.393 0.886 . . . . 38.08 113.393 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.4 p -71.48 -17.86 62.33 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 107.911 -1.144 . . . . 35.52 107.911 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.15 -26.27 33.6 Favored 'General case' 0 CA--C 1.56 1.327 0 CA-C-N 113.937 -1.483 . . . . 36.86 113.615 -169.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -79.98 -8.41 59.33 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 110.038 -0.356 . . . . 38.68 110.038 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -65.52 -8.93 22.04 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 112.641 0.608 . . . . 37.28 112.641 162.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.56 103.46 5.92 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 118.513 0.597 . . . . 36.72 111.553 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . 1.106 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 93.0 m-20 -57.98 -47.08 84.03 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 119.956 -0.698 . . . . 39.82 112.04 176.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -52.0 -19.23 1.72 Allowed 'General case' 0 CA--C 1.561 1.37 0 N-CA-C 115.699 1.74 . . . . 45.25 115.699 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -114.6 -7.1 12.79 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 114.939 1.459 . . . . 37.1 114.939 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 1.106 ' HD3' ' HA ' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -66.98 -27.92 67.84 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 113.288 0.848 . . . . 41.24 113.288 -173.317 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . 0.548 ' O ' ' HG2' ' A' ' 50' ' ' LYS . 56.4 p-80 -66.42 -20.37 66.04 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 113.212 0.819 . . . . 45.32 113.212 174.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.88 95.31 2.93 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.007 -1.108 . . . . 44.78 108.007 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 48' ' ' HIS . 61.8 mmtt -91.47 -19.64 22.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.513 -1.676 . . . . 44.3 113.154 -178.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . 0.52 ' OG1' ' HG3' ' A' ' 54' ' ' GLU . 52.0 p -130.31 156.82 44.04 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.217 1.192 . . . . 42.32 114.217 179.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.63 -41.35 69.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 114.31 1.226 . . . . 46.33 114.31 170.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.34 77.75 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.979 0.912 . . . . 38.71 111.805 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . 0.52 ' HG3' ' OG1' ' A' ' 51' ' ' THR . 52.5 mt-10 -66.0 -39.42 90.28 Favored 'General case' 0 C--O 1.26 1.622 0 C-N-CA 120.678 -0.409 . . . . 42.89 111.066 178.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.8 mtt -59.76 -42.94 94.38 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.668 -0.493 . . . . 33.08 109.668 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -72.58 -23.82 61.01 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.025 1.12 . . . . 42.13 114.025 -177.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.23 -13.08 47.9 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 123.721 0.638 . . . . 33.26 111.497 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -77.41 110.71 12.4 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.77 1.228 . . . . 31.15 112.953 -171.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -62.41 -33.09 74.1 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.116 1.154 . . . . 38.04 114.116 172.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -70.97 -29.35 65.32 Favored 'General case' 0 C--O 1.281 2.721 0 CA-C-O 121.305 0.574 . . . . 34.04 109.834 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.9 tt -71.6 -46.75 58.31 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 116.257 -0.429 . . . . 23.98 110.385 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -46.06 -50.17 15.47 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 114.173 1.175 . . . . 35.1 114.173 164.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.468 ' HB2' ' C4 ' ' A' ' 375' ' ' NBE . 66.9 tttt -64.79 -45.27 86.98 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.283 1.033 . . . . 28.72 110.342 -178.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.32 -50.07 74.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.082 0.864 . . . . 29.91 113.212 172.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -54.16 -41.11 69.0 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 114.443 0.537 . . . . 21.51 114.443 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.2 m -61.6 -44.94 96.08 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.173 0.989 . . . . 24.82 111.511 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.63 -49.39 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 O-C-N 121.459 -0.776 . . . . 19.57 110.511 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.01 -56.45 15.79 Favored 'Isoleucine or valine' 0 C--O 1.271 2.216 0 N-CA-C 114.17 1.174 . . . . 20.46 114.17 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.55 -36.8 84.86 Favored 'General case' 0 C--O 1.266 1.965 0 N-CA-C 114.115 1.154 . . . . 25.08 114.115 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -57.96 -47.34 83.23 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.335 -1.346 . . . . 20.1 113.492 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.88 -45.15 90.87 Favored 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.87 1.433 . . . . 18.72 114.87 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.4 tp -60.21 -42.57 95.41 Favored 'General case' 0 CA--C 1.563 1.448 0 O-C-N 121.616 -0.677 . . . . 22.49 111.128 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.23 54.98 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 111.439 -0.664 . . . . 22.79 111.439 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -52.52 -41.95 56.98 Favored Glycine 0 N--CA 1.507 3.405 0 C-N-CA 120.009 -1.091 . . . . 26.29 112.683 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.13 -54.95 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 O-C-N 122.387 -0.478 . . . . 29.88 110.548 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -53.02 -39.0 62.83 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.542 1.137 . . . . 24.87 113.021 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -71.15 -8.96 57.06 Favored 'General case' 0 C--O 1.209 -1.065 0 O-C-N 124.399 1.062 . . . . 32.97 112.18 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -85.07 -2.43 57.98 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-N 118.754 0.707 . . . . 32.24 110.416 174.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.633 ' HD2' ' HB3' ' A' ' 7' ' ' TRP . 7.6 mtmt 45.35 50.39 9.97 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.392 0.886 . . . . 30.21 113.392 -179.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.01 -10.18 71.67 Favored Glycine 0 N--CA 1.475 1.243 0 N-CA-C 117.123 1.609 . . . . 25.89 117.123 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 73.7 m80 -94.42 52.81 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.032 1.733 . . . . 35.18 110.461 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -114.04 14.33 18.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.744 1.016 . . . . 22.83 113.744 -163.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -44.5 -50.91 9.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 115.533 1.679 . . . . 43.06 115.533 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.32 80.37 Favored 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 114.287 1.217 . . . . 24.76 114.287 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -81.11 -33.9 32.95 Favored 'General case' 0 C--O 1.244 0.798 0 C-N-CA 124.87 1.268 . . . . 31.27 113.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.7 tt -81.32 -40.88 22.93 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.47 -0.769 . . . . 25.46 109.853 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -45.59 -59.83 4.08 Favored Pre-proline 0 C--O 1.253 1.285 0 N-CA-C 116.025 1.861 . . . . 28.8 116.025 -178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -60.55 -29.36 88.39 Favored 'Trans proline' 0 C--N 1.353 0.791 0 O-C-N 122.959 0.978 . . . . 22.65 112.895 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 mt -79.58 -43.24 23.33 Favored 'General case' 0 N--CA 1.427 -1.612 0 O-C-N 124.206 0.941 . . . . 24.74 109.81 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.8 -49.63 70.49 Favored 'General case' 0 C--O 1.251 1.133 0 O-C-N 123.592 0.557 . . . . 19.66 112.013 167.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . 0.283 13.6 mt-30 -59.83 -49.18 78.71 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 118.488 -0.768 . . . . 26.91 112.05 178.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.8 p -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 118.664 -1.215 . . . . 20.79 113.774 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . 0.258 27.4 m80 -66.79 -34.56 78.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 116.02 1.859 . . . . 21.01 116.02 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . 0.569 ' HB2' ' CE1' ' A' ' 146' ' ' TYR . . . -78.32 -39.48 39.51 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.148 0.979 . . . . 23.27 112.168 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 439' ' ' HOH . 41.5 m -91.18 -51.0 5.53 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 115.804 1.779 . . . . 30.1 115.804 -171.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.8 tttm -93.86 -52.21 4.53 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 123.992 0.917 . . . . 27.23 112.021 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -82.92 -20.34 35.54 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 120.18 -0.608 . . . . 20.5 111.443 -174.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt 48.42 58.52 5.11 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.003 1.721 . . . . 34.7 114.878 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . 0.619 HG23 ' CD2' ' A' ' 103' ' ' TYR . 44.7 mm -95.86 116.46 66.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 108.634 -0.876 . . . . 21.87 108.634 -176.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.72 151.08 72.93 Favored 'Trans proline' 0 C--O 1.287 2.959 0 C-N-CA 117.412 -1.259 . . . . 22.2 112.367 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . 0.284 15.9 tt -66.4 -24.39 33.23 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.058 0 C-N-CA 118.926 -1.11 . . . . 25.03 110.846 -173.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -54.81 -29.42 54.65 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.079 0.552 . . . . 30.12 111.596 174.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . 0.619 ' CD2' HG23 ' A' ' 99' ' ' ILE . 8.2 m-30 -73.89 -33.64 64.1 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.454 -1.404 . . . . 36.35 112.166 177.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 138' ' ' PHE . 26.7 tp -57.69 -44.44 85.83 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 114.636 -1.166 . . . . 25.62 114.075 165.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.78 -59.32 4.77 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.667 0.787 . . . . 28.01 112.187 165.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -47.54 -45.56 26.92 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 118.162 2.653 . . . . 27.95 118.162 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.73 -29.98 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 113.106 0.78 . . . . 23.55 113.106 -179.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.3 m -63.57 -53.85 45.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.194 -0.669 . . . . 21.93 109.194 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASP . . . . . 0.482 ' OD2' ' O ' ' A' ' 385' ' ' HOH . 86.8 m-20 -51.28 -44.99 61.96 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 117.41 -1.281 . . . . 26.21 113.258 168.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.71 -42.33 83.55 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.727 1.149 . . . . 20.48 111.097 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.94 -47.89 89.9 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.763 0 N-CA-C 114.521 1.304 . . . . 22.62 114.521 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.5 mm -60.63 -44.8 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 C-N-CA 124.677 1.191 . . . . 20.35 108.928 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -58.91 -49.87 76.17 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 118.66 -1.216 . . . . 19.68 112.97 175.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 79.6 t -62.35 -42.06 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.526 0 O-C-N 123.733 0.645 . . . . 19.62 109.278 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.8 mt -53.72 -49.67 67.59 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 113.406 0.891 . . . . 22.07 113.406 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -64.19 -34.04 77.18 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.382 0.882 . . . . 24.12 113.382 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.9 t -77.96 -33.53 51.51 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.431 -0.952 . . . . 28.99 108.431 -169.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -85.13 -26.33 26.93 Favored 'General case' 0 C--O 1.259 1.554 0 N-CA-C 113.954 1.094 . . . . 27.58 113.954 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -129.2 64.84 72.52 Favored Pre-proline 0 C--O 1.206 -1.218 0 N-CA-C 114.091 1.145 . . . . 26.57 114.091 176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.2 118.59 5.54 Favored 'Trans proline' 0 CA--C 1.571 2.369 0 C-N-CA 122.78 2.32 . . . . 22.1 111.751 -171.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 80.45 2.63 89.65 Favored Glycine 0 C--O 1.213 -1.178 0 CA-C-O 118.204 -1.331 . . . . 21.81 113.12 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -100.75 -12.09 19.38 Favored 'General case' 0 C--O 1.27 2.158 0 N-CA-C 115.282 1.586 . . . . 32.57 115.282 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -99.61 88.74 3.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 124.133 0.896 . . . . 22.35 108.647 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -52.74 153.48 6.63 Favored Glycine 0 N--CA 1.492 2.367 0 CA-C-N 113.356 -1.747 . . . . 20.12 115.138 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.95 -38.93 83.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.029 0.414 . . . . 18.42 111.125 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -67.5 -39.78 85.19 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.132 0.573 . . . . 24.97 111.608 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.19 -47.96 83.73 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.62 1.711 . . . . 20.56 115.62 172.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -57.14 -38.08 72.98 Favored 'General case' 0 C--O 1.261 1.696 0 N-CA-C 111.762 0.282 . . . . 25.96 111.762 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -65.03 -45.68 91.37 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 120.226 -0.987 . . . . 19.55 112.931 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.62 87.94 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.942 0.897 . . . . 16.83 112.71 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 35.7 tpp -62.76 -51.0 68.82 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.973 -0.558 . . . . 28.67 111.286 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 61.4 m -50.84 -52.36 42.14 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.29 1.036 . . . . 19.51 109.098 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -58.85 -43.23 90.75 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 113.426 0.899 . . . . 27.94 113.426 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.45 -43.73 79.79 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.86 -1.136 . . . . 20.48 111.353 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.9 -35.29 72.24 Favored 'General case' 0 C--O 1.26 1.644 0 C-N-CA 123.282 0.633 . . . . 21.59 111.06 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -70.88 -41.89 70.74 Favored 'General case' 0 C--O 1.188 -2.177 0 CA-C-O 118.425 -0.798 . . . . 24.06 111.907 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 29.8 tp -50.37 -48.74 55.59 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.995 0.903 . . . . 24.31 113.41 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PHE . . . . . 0.562 ' CE2' HD11 ' A' ' 104' ' ' LEU . 24.2 t80 -57.88 -55.38 35.58 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.889 1.676 . . . . 28.77 111.18 179.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 ttp-105 -55.52 -39.55 70.67 Favored 'General case' 0 C--O 1.253 1.258 0 C-N-CA 126.025 1.73 . . . . 25.97 114.09 172.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . 0.265 20.4 t30 -65.39 -40.41 93.43 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 115.445 1.646 . . . . 31.13 115.445 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -73.81 -32.57 63.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 107.854 -1.165 . . . . 28.46 107.854 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . 0.585 HD13 ' C6 ' ' A' ' 373' ' ' NBE . 85.6 mt -61.57 -43.29 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 N-CA-C 114.359 1.244 . . . . 25.41 114.359 170.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.12 71.68 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-N 116.023 -0.535 . . . . 18.32 110.61 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.26 73.01 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 108.956 -0.757 . . . . 19.78 108.956 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -64.77 -46.18 83.19 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.368 0.667 . . . . 33.9 112.337 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' TYR . . . . . 0.569 ' CE1' ' HB2' ' A' ' 94' ' ' ALA . 3.1 m-85 -54.86 -43.19 72.87 Favored 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 114.805 1.409 . . . . 22.04 114.805 173.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -63.56 -40.67 97.58 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.347 -0.845 . . . . 27.03 108.843 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -57.52 -35.27 70.04 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.747 0.784 . . . . 29.58 111.669 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 33.7 mt -95.1 2.4 55.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.228 1.011 . . . . 25.89 113.365 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.36 78.19 Favored Glycine 0 C--N 1.347 1.169 0 C-N-CA 125.077 1.322 . . . . 21.71 110.496 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -79.22 117.3 20.11 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.02 -1.072 . . . . 31.13 108.714 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 113.137 0.792 . . . . 39.65 113.137 166.432 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HEM . . . . . 0.593 HMC2 HBC2 ' A' ' 154' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 371' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 372' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 373' ' ' NBE . . . . . 0.585 ' C6 ' HD13 ' A' ' 142' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 374' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 375' ' ' NBE . . . . . 0.609 ' H6 ' ' O ' ' A' ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 385' ' ' HOH . . . . . 0.482 ' O ' ' OD2' ' A' ' 109' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 387' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 390' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 398' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . 0.518 ' O ' HG23 ' A' ' 95' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 458' ' ' HOH . . . . . 0.594 ' O ' ' CD1' ' A' ' 103' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 460' ' ' HOH . . . . . 0.745 ' O ' ' OE2' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 461' ' ' HOH . . . . . 1.01 ' O ' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 463' ' ' HOH . . . . . 0.948 ' O ' ' HB2' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 464' ' ' HOH . . . . . 0.635 ' O ' ' HE2' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 465' ' ' HOH . . . . . 0.609 ' O ' ' H6 ' ' A' ' 375' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 3.546 0 N-CA-C 116.131 1.213 . . . . 37.18 116.131 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 6.2 mp -106.18 153.76 21.67 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 108.489 -0.93 . . . . 33.14 108.489 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 86.7 p -70.89 169.07 15.52 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-O 121.873 0.844 . . . . 31.47 112.438 171.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -63.05 -36.2 82.78 Favored 'General case' 0 CA--C 1.49 -1.342 0 CA-C-N 114.477 -1.238 . . . . 45.17 113.225 171.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.45 -37.58 85.81 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 108.341 -1.904 . . . . 25.92 108.341 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -67.31 -55.96 11.75 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 117.818 -1.087 . . . . 24.75 109.692 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.633 ' HB3' ' HD2' ' A' ' 79' ' ' LYS . 56.6 m95 -46.08 -37.96 7.43 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 114.783 1.401 . . . . 24.9 114.783 169.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -65.23 -43.24 92.08 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 114.138 1.162 . . . . 35.16 114.138 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -60.23 -45.55 92.82 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 114.381 1.252 . . . . 39.4 114.381 172.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 56.8 t -54.59 -48.21 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 124.601 1.188 . . . . 22.7 108.471 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 77.2 mt -81.47 -23.27 37.52 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.332 -0.547 . . . . 26.64 111.418 -170.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . 1.01 ' HB2' ' O ' ' A' ' 461' ' ' HOH . 9.3 t-20 -62.26 -55.34 29.36 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 122.129 0.966 . . . . 37.35 109.522 169.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.72 -46.12 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 114.542 -1.208 . . . . 26.61 113.514 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -63.1 -39.39 94.57 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.456 0.539 . . . . 28.0 112.456 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.32 -43.2 43.15 Favored Glycine 0 N--CA 1.483 1.81 0 CA-C-O 118.447 -1.196 . . . . 29.3 114.396 171.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.948 ' HB2' ' O ' ' A' ' 463' ' ' HOH . 0.0 OUTLIER -63.8 -50.38 69.19 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 127.68 2.392 . . . . 33.86 110.5 174.783 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 98.1 t -48.08 -39.55 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 C-N-CA 123.781 0.832 . . . . 29.27 112.262 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.745 ' OE2' ' O ' ' A' ' 460' ' ' HOH . 63.3 mt-10 -72.82 -12.63 61.06 Favored 'General case' 0 CA--C 1.501 -0.927 0 N-CA-C 114.81 1.411 . . . . 38.84 114.81 -175.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.07 -21.68 43.1 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.672 -1.233 . . . . 29.89 107.672 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -146.62 58.52 1.19 Allowed 'General case' 0 C--O 1.184 -2.359 0 CA-C-N 113.847 -1.524 . . . . 36.02 108.704 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 tp -62.64 -53.38 47.78 Favored 'Isoleucine or valine' 0 C--O 1.265 1.874 0 C-N-CA 123.923 0.889 . . . . 32.42 111.837 -172.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -51.0 -49.54 60.2 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.628 1.714 . . . . 22.3 115.628 174.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -67.71 -45.6 74.56 Favored Glycine 0 CA--C 1.546 2.021 0 CA-C-N 115.578 -0.737 . . . . 19.77 111.682 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -58.24 -46.21 86.37 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.48 -1.6 . . . . 22.08 112.815 169.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.23 -45.82 95.23 Favored Glycine 0 N--CA 1.481 1.641 0 C-N-CA 123.773 0.701 . . . . 20.36 112.517 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 30' ' ' ILE . 18.2 tt0 -53.61 -58.17 8.13 Favored 'General case' 0 C--O 1.208 -1.13 0 C-N-CA 124.651 1.18 . . . . 31.79 110.068 175.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -58.82 -38.37 78.5 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 116.663 2.097 . . . . 35.37 116.663 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.44 -44.68 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.214 0 CA-C-O 118.738 -0.649 . . . . 20.09 111.166 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.03 -41.95 81.36 Favored 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 109.382 -0.599 . . . . 25.74 109.382 -179.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.571 HG13 ' O ' ' A' ' 26' ' ' GLN . 4.2 mt -63.7 -43.62 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 119.914 -0.714 . . . . 20.25 112.014 179.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -54.59 -45.52 73.62 Favored 'General case' 0 C--O 1.268 2.07 0 C-N-CA 120.114 -0.635 . . . . 28.1 112.634 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 25.8 tp -63.85 -51.88 62.62 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 112.449 0.537 . . . . 26.19 112.449 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -61.74 -38.69 88.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.856 1.262 . . . . 24.21 112.827 -175.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.9 p -80.27 -38.38 30.96 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.967 1.307 . . . . 24.47 113.041 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.72 -24.38 70.08 Favored Glycine 0 C--O 1.208 -1.515 0 C-N-CA 119.577 -1.297 . . . . 25.72 114.872 174.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -144.56 75.42 14.85 Favored Pre-proline 0 C--O 1.204 -1.297 0 N-CA-C 106.68 -1.6 . . . . 30.58 106.68 -173.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -60.42 -15.46 35.85 Favored 'Trans proline' 0 CA--C 1.556 1.607 0 C-N-CA 123.845 3.03 . . . . 34.08 114.713 -172.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.5 pm0 -70.55 -17.1 62.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.393 0.886 . . . . 38.08 113.393 176.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.4 p -71.48 -17.86 62.33 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 107.911 -1.144 . . . . 35.52 107.911 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.15 -26.27 33.6 Favored 'General case' 0 CA--C 1.56 1.327 0 CA-C-N 113.937 -1.483 . . . . 36.86 113.615 -169.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -79.98 -8.41 59.33 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 110.038 -0.356 . . . . 38.68 110.038 176.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -65.52 -8.93 22.04 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 112.641 0.608 . . . . 37.28 112.641 162.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.56 103.46 5.92 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 118.513 0.597 . . . . 36.72 111.553 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.106 ' HA ' ' HD3' ' A' ' 47' ' ' LYS . 93.0 m-20 -57.98 -47.08 84.03 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 119.956 -0.698 . . . . 39.82 112.04 176.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.3 ptmt -52.0 -19.23 1.72 Allowed 'General case' 0 CA--C 1.561 1.37 0 N-CA-C 115.699 1.74 . . . . 45.25 115.699 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -114.6 -7.1 12.79 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 114.939 1.459 . . . . 37.1 114.939 -176.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 1.106 ' HD3' ' HA ' ' A' ' 44' ' ' ASP . 0.7 OUTLIER -66.98 -27.92 67.84 Favored 'General case' 0 C--O 1.254 1.31 0 N-CA-C 113.288 0.848 . . . . 41.24 113.288 -173.317 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.548 ' O ' ' HG2' ' A' ' 50' ' ' LYS . 14.2 p80 -66.42 -20.37 66.04 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 113.212 0.819 . . . . 45.32 113.212 174.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.88 95.31 2.93 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 108.007 -1.108 . . . . 44.78 108.007 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 48' ' ' HIS . 61.8 mmtt -91.47 -19.64 22.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 113.513 -1.676 . . . . 44.3 113.154 -178.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . 0.52 ' OG1' ' HG3' ' A' ' 54' ' ' GLU . 52.0 p -130.31 156.82 44.04 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 114.217 1.192 . . . . 42.32 114.217 179.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -54.63 -41.35 69.93 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 114.31 1.226 . . . . 46.33 114.31 170.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.72 -46.34 77.75 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.979 0.912 . . . . 38.71 111.805 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.52 ' HG3' ' OG1' ' A' ' 51' ' ' THR . 52.5 mt-10 -66.0 -39.42 90.28 Favored 'General case' 0 C--O 1.26 1.622 0 C-N-CA 120.678 -0.409 . . . . 42.89 111.066 178.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.8 mtt -59.76 -42.94 94.38 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.668 -0.493 . . . . 33.08 109.668 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.6 mtpp -72.58 -23.82 61.01 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 114.025 1.12 . . . . 42.13 114.025 -177.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.23 -13.08 47.9 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 123.721 0.638 . . . . 33.26 111.497 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 31.0 t -77.41 110.71 12.4 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.77 1.228 . . . . 31.15 112.953 -171.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -62.41 -33.09 74.1 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.116 1.154 . . . . 38.04 114.116 172.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -70.97 -29.35 65.32 Favored 'General case' 0 C--O 1.281 2.721 0 CA-C-O 121.305 0.574 . . . . 34.04 109.834 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.9 tt -71.6 -46.75 58.31 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 116.257 -0.429 . . . . 23.98 110.385 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -46.06 -50.17 15.47 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 114.173 1.175 . . . . 35.1 114.173 164.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.468 ' HB2' ' C4 ' ' A' ' 375' ' ' NBE . 66.9 tttt -64.79 -45.27 86.98 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.283 1.033 . . . . 28.72 110.342 -178.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -57.32 -50.07 74.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.082 0.864 . . . . 29.91 113.212 172.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -54.16 -41.11 69.0 Favored Glycine 0 N--CA 1.496 2.643 0 N-CA-C 114.443 0.537 . . . . 21.51 114.443 174.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 32.2 m -61.6 -44.94 96.08 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.173 0.989 . . . . 24.82 111.511 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.63 -49.39 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 O-C-N 121.459 -0.776 . . . . 19.57 110.511 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.01 -56.45 15.79 Favored 'Isoleucine or valine' 0 C--O 1.271 2.216 0 N-CA-C 114.17 1.174 . . . . 20.46 114.17 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.8 mt -65.55 -36.8 84.86 Favored 'General case' 0 C--O 1.266 1.965 0 N-CA-C 114.115 1.154 . . . . 25.08 114.115 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.8 m -57.96 -47.34 83.23 Favored 'General case' 0 C--O 1.252 1.223 0 C-N-CA 118.335 -1.346 . . . . 20.1 113.492 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.88 -45.15 90.87 Favored 'General case' 0 CA--C 1.583 2.223 0 N-CA-C 114.87 1.433 . . . . 18.72 114.87 173.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.4 tp -60.21 -42.57 95.41 Favored 'General case' 0 CA--C 1.563 1.448 0 O-C-N 121.616 -0.677 . . . . 22.49 111.128 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.23 54.98 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 111.439 -0.664 . . . . 22.79 111.439 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -52.52 -41.95 56.98 Favored Glycine 0 N--CA 1.507 3.405 0 C-N-CA 120.009 -1.091 . . . . 26.29 112.683 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.13 -54.95 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 O-C-N 122.387 -0.478 . . . . 29.88 110.548 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -53.02 -39.0 62.83 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.542 1.137 . . . . 24.87 113.021 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 mttm -71.15 -8.96 57.06 Favored 'General case' 0 C--O 1.209 -1.065 0 O-C-N 124.399 1.062 . . . . 32.97 112.18 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -85.07 -2.43 57.98 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-N 118.754 0.707 . . . . 32.24 110.416 174.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.633 ' HD2' ' HB3' ' A' ' 7' ' ' TRP . 7.6 mtmt 45.35 50.39 9.97 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.392 0.886 . . . . 30.21 113.392 -179.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 88.01 -10.18 71.67 Favored Glycine 0 N--CA 1.475 1.243 0 N-CA-C 117.123 1.609 . . . . 25.89 117.123 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 73.7 m80 -94.42 52.81 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.032 1.733 . . . . 35.18 110.461 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -114.04 14.33 18.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.744 1.016 . . . . 22.83 113.744 -163.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -44.5 -50.91 9.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 115.533 1.679 . . . . 43.06 115.533 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.32 80.37 Favored 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 114.287 1.217 . . . . 24.76 114.287 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mp0 -81.11 -33.9 32.95 Favored 'General case' 0 C--O 1.244 0.798 0 C-N-CA 124.87 1.268 . . . . 31.27 113.924 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.7 tt -81.32 -40.88 22.93 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.47 -0.769 . . . . 25.46 109.853 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -45.59 -59.83 4.08 Favored Pre-proline 0 C--O 1.253 1.285 0 N-CA-C 116.025 1.861 . . . . 28.8 116.025 -178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -60.55 -29.36 88.39 Favored 'Trans proline' 0 C--N 1.353 0.791 0 O-C-N 122.959 0.978 . . . . 22.65 112.895 -174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 mt -79.58 -43.24 23.33 Favored 'General case' 0 N--CA 1.427 -1.612 0 O-C-N 124.206 0.941 . . . . 24.74 109.81 -172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -54.8 -49.63 70.49 Favored 'General case' 0 C--O 1.251 1.133 0 O-C-N 123.592 0.557 . . . . 19.66 112.013 167.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 462' ' ' HOH 0.283 51.9 mt-30 -59.83 -49.18 78.71 Favored 'General case' 0 C--O 1.249 1.03 0 CA-C-O 118.488 -0.768 . . . . 26.91 112.05 178.308 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 59.8 p -64.5 -41.84 96.19 Favored 'General case' 0 N--CA 1.502 2.136 0 C-N-CA 118.664 -1.215 . . . . 20.79 113.774 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . 0.258 27.4 m80 -66.79 -34.56 78.08 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 116.02 1.859 . . . . 21.01 116.02 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.569 ' HB2' ' CE1' ' A' ' 146' ' ' TYR . . . -78.32 -39.48 39.51 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.148 0.979 . . . . 23.27 112.168 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 439' ' ' HOH . 41.5 m -91.18 -51.0 5.53 Favored 'General case' 0 CA--C 1.565 1.554 0 N-CA-C 115.804 1.779 . . . . 30.1 115.804 -171.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.8 tttm -93.86 -52.21 4.53 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 123.992 0.917 . . . . 27.23 112.021 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -82.92 -20.34 35.54 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 120.18 -0.608 . . . . 20.5 111.443 -174.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt 48.42 58.52 5.11 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 126.003 1.721 . . . . 34.7 114.878 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.619 HG23 ' CD2' ' A' ' 103' ' ' TYR . 44.7 mm -95.86 116.46 66.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 108.634 -0.876 . . . . 21.87 108.634 -176.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.72 151.08 72.93 Favored 'Trans proline' 0 C--O 1.287 2.959 0 C-N-CA 117.412 -1.259 . . . . 22.2 112.367 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . 0.284 15.9 tt -66.4 -24.39 33.23 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.058 0 C-N-CA 118.926 -1.11 . . . . 25.03 110.846 -173.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -54.81 -29.42 54.65 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.079 0.552 . . . . 30.12 111.596 174.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.619 ' CD2' HG23 ' A' ' 99' ' ' ILE . 8.2 m-30 -73.89 -33.64 64.1 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 120.454 -1.404 . . . . 36.35 112.166 177.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 138' ' ' PHE . 26.7 tp -57.69 -44.44 85.83 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 114.636 -1.166 . . . . 25.62 114.075 165.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -53.78 -59.32 4.77 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.667 0.787 . . . . 28.01 112.187 165.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 15.2 m-30 -47.54 -45.56 26.92 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 118.162 2.653 . . . . 27.95 118.162 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.73 -29.98 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 N-CA-C 113.106 0.78 . . . . 23.55 113.106 -179.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.3 m -63.57 -53.85 45.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 109.194 -0.669 . . . . 21.93 109.194 174.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.482 ' OD2' ' O ' ' A' ' 385' ' ' HOH . 86.8 m-20 -51.28 -44.99 61.96 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 117.41 -1.281 . . . . 26.21 113.258 168.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.71 -42.33 83.55 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.727 1.149 . . . . 20.48 111.097 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 65.4 mt -59.94 -47.89 89.9 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.763 0 N-CA-C 114.521 1.304 . . . . 22.62 114.521 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.5 mm -60.63 -44.8 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.331 0 C-N-CA 124.677 1.191 . . . . 20.35 108.928 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -58.91 -49.87 76.17 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 118.66 -1.216 . . . . 19.68 112.97 175.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 79.6 t -62.35 -42.06 94.04 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.526 0 O-C-N 123.733 0.645 . . . . 19.62 109.278 -176.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.8 mt -53.72 -49.67 67.59 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 113.406 0.891 . . . . 22.07 113.406 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -64.19 -34.04 77.18 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.382 0.882 . . . . 24.12 113.382 176.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.9 t -77.96 -33.53 51.51 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.431 -0.952 . . . . 28.99 108.431 -169.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -85.13 -26.33 26.93 Favored 'General case' 0 C--O 1.259 1.554 0 N-CA-C 113.954 1.094 . . . . 27.58 113.954 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -129.2 64.84 72.52 Favored Pre-proline 0 C--O 1.206 -1.218 0 N-CA-C 114.091 1.145 . . . . 26.57 114.091 176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.2 118.59 5.54 Favored 'Trans proline' 0 CA--C 1.571 2.369 0 C-N-CA 122.78 2.32 . . . . 22.1 111.751 -171.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 80.45 2.63 89.65 Favored Glycine 0 C--O 1.213 -1.178 0 CA-C-O 118.204 -1.331 . . . . 21.81 113.12 -178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -100.75 -12.09 19.38 Favored 'General case' 0 C--O 1.27 2.158 0 N-CA-C 115.282 1.586 . . . . 32.57 115.282 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -99.61 88.74 3.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 124.133 0.896 . . . . 22.35 108.647 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -52.74 153.48 6.63 Favored Glycine 0 N--CA 1.492 2.367 0 CA-C-N 113.356 -1.747 . . . . 20.12 115.138 -175.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.95 -38.93 83.87 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.029 0.414 . . . . 18.42 111.125 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.7 p-10 -67.5 -39.78 85.19 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.132 0.573 . . . . 24.97 111.608 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.19 -47.96 83.73 Favored 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.62 1.711 . . . . 20.56 115.62 172.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.14 -38.08 72.98 Favored 'General case' 0 C--O 1.261 1.696 0 N-CA-C 111.762 0.282 . . . . 25.96 111.762 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -65.03 -45.68 91.37 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 120.226 -0.987 . . . . 19.55 112.931 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.62 87.94 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.942 0.897 . . . . 16.83 112.71 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 35.7 tpp -62.76 -51.0 68.82 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.973 -0.558 . . . . 28.67 111.286 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 61.4 m -50.84 -52.36 42.14 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 124.29 1.036 . . . . 19.51 109.098 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -58.85 -43.23 90.75 Favored 'General case' 0 N--CA 1.505 2.304 0 N-CA-C 113.426 0.899 . . . . 27.94 113.426 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.45 -43.73 79.79 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.86 -1.136 . . . . 20.48 111.353 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 33.2 mt -70.9 -35.29 72.24 Favored 'General case' 0 C--O 1.26 1.644 0 C-N-CA 123.282 0.633 . . . . 21.59 111.06 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -70.88 -41.89 70.74 Favored 'General case' 0 C--O 1.188 -2.177 0 CA-C-O 118.425 -0.798 . . . . 24.06 111.907 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 29.8 tp -50.37 -48.74 55.59 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.995 0.903 . . . . 24.31 113.41 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.562 ' CE2' HD11 ' A' ' 104' ' ' LEU . 24.2 t80 -57.88 -55.38 35.58 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.889 1.676 . . . . 28.77 111.18 179.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 19.9 ttp-105 -55.52 -39.55 70.67 Favored 'General case' 0 C--O 1.253 1.258 0 C-N-CA 126.025 1.73 . . . . 25.97 114.09 172.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . 0.265 20.4 t30 -65.39 -40.41 93.43 Favored 'General case' 0 N--CA 1.438 -1.053 0 N-CA-C 115.445 1.646 . . . . 31.13 115.445 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -73.81 -32.57 63.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 107.854 -1.165 . . . . 28.46 107.854 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.585 HD13 ' C6 ' ' A' ' 373' ' ' NBE . 85.6 mt -61.57 -43.29 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 N-CA-C 114.359 1.244 . . . . 25.41 114.359 170.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.12 71.68 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-N 116.023 -0.535 . . . . 18.32 110.61 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -70.46 -41.26 73.01 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 108.956 -0.757 . . . . 19.78 108.956 -177.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 37.8 mmtt -64.77 -46.18 83.19 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.368 0.667 . . . . 33.9 112.337 173.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' TYR . . . . . 0.569 ' CE1' ' HB2' ' A' ' 94' ' ' ALA . 3.1 m-85 -54.86 -43.19 72.87 Favored 'General case' 0 CA--C 1.586 2.353 0 N-CA-C 114.805 1.409 . . . . 22.04 114.805 173.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 61.6 tttt -63.56 -40.67 97.58 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 121.347 -0.845 . . . . 27.03 108.843 176.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 -57.52 -35.27 70.04 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.747 0.784 . . . . 29.58 111.669 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 33.7 mt -95.1 2.4 55.15 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.228 1.011 . . . . 25.89 113.365 -178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.36 78.19 Favored Glycine 0 C--N 1.347 1.169 0 C-N-CA 125.077 1.322 . . . . 21.71 110.496 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -79.22 117.3 20.11 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.02 -1.072 . . . . 31.13 108.714 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 113.137 0.792 . . . . 39.65 113.137 166.432 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HEM . . . . . 0.593 HMC2 HBC2 ' A' ' 154' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' NBE . . . . . 0.585 ' C6 ' HD13 ' A' ' 142' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' NBE . . . . . 0.609 ' H6 ' ' O ' ' A' ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' HOH . . . . . 0.482 ' O ' ' OD2' ' A' ' 109' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 398' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 399' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . 0.518 ' O ' HG23 ' A' ' 95' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' HOH . . . . . 0.594 ' O ' ' CD1' ' A' ' 103' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' HOH . . . . . 0.745 ' O ' ' OE2' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' HOH . . . . . 1.01 ' O ' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' HOH . . . . . 0.43 ' O ' ' OE1' ' A' ' 91' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' HOH . . . . . 0.948 ' O ' ' HB2' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' HOH . . . . . 0.635 ' O ' ' HE2' ' A' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' HOH . . . . . 0.609 ' O ' ' H6 ' ' A' ' 375' ' ' NBE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_