data_3cpo_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 3cpo _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 ' 3' ' ' LEU . . . . . . . . . . . . . 23.4 tp . . . . . 0 N--CA 1.531 3.585 0 N-CA-C 109.455 -0.572 . . . . 35.04 109.455 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.31 139.24 49.27 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 117.026 -1.516 . . . . 30.05 110.432 -164.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.5 p -66.45 171.93 4.51 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 114.716 -1.129 . . . . 26.41 111.627 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.59 -45.26 81.47 Favored 'General case' 0 C--O 1.259 1.569 0 C-N-CA 119.004 -1.078 . . . . 22.19 110.582 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -62.06 -42.56 99.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.4 -0.92 . . . . 35.6 110.171 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -64.72 -35.79 82.2 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 118.186 -1.406 . . . . 32.11 114.548 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.5 t -59.54 -45.15 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 123.764 0.665 . . . . 18.65 110.622 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.81 -46.85 74.57 Favored 'General case' 0 C--O 1.244 0.781 0 O-C-N 121.301 -0.874 . . . . 28.79 109.523 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.75 -42.66 95.1 Favored Glycine 0 N--CA 1.477 1.419 0 C-N-CA 118.792 -1.671 . . . . 18.49 111.543 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.55 -41.55 88.47 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 117.978 0.889 . . . . 21.16 110.514 -176.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 89.7 mtp -71.83 -35.54 69.93 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.192 -1.003 . . . . 15.88 110.787 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.23 93.53 Favored 'General case' 0 CA--C 1.561 1.37 0 O-C-N 120.151 -1.593 . . . . 18.56 112.114 173.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 46.8 ttt-85 -52.98 -51.52 61.26 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 116.685 -2.006 . . . . 18.1 111.472 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -54.35 -45.85 72.81 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.09 0.859 . . . . 14.35 111.409 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 42.3 mm -65.04 -40.02 87.58 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.843 0 C-N-CA 117.817 -1.553 . . . . 19.92 111.533 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -46.63 -50.56 17.42 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 117.387 -1.292 . . . . 27.18 111.789 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.06 -36.02 69.46 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 119.425 -0.91 . . . . 19.34 113.407 177.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 66.0 t -64.29 -43.82 97.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.854 0 N-CA-C 107.673 -1.232 . . . . 19.28 107.673 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 170' ' ' HOH . 38.7 t70 -59.33 -40.36 86.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 O-C-N 121.348 -0.845 . . . . 26.5 113.09 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.9 m -86.37 -22.8 7.05 Favored 'Isoleucine or valine' 0 C--O 1.284 2.912 0 C-N-CA 115.343 -2.543 . . . . 33.17 109.09 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.31 31.59 11.56 Favored Glycine 0 C--O 1.259 1.694 0 O-C-N 120.249 -1.532 . . . . 20.39 111.305 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -86.82 89.72 8.06 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 115.73 1.752 . . . . 19.61 115.73 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.97 -45.04 87.96 Favored 'Isoleucine or valine' 0 C--O 1.258 1.547 0 CA-C-N 113.508 -1.678 . . . . 22.25 110.478 -171.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -66.84 -34.64 78.24 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 120.295 -1.503 . . . . 34.04 111.773 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.18 -36.51 71.99 Favored 'General case' 0 CA--C 1.554 1.131 0 N-CA-C 109.148 -0.686 . . . . 18.03 109.148 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.59 -48.57 86.22 Favored 'Isoleucine or valine' 0 C--O 1.266 1.934 0 CA-C-O 123.513 1.625 . . . . 19.24 110.051 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.6 t -60.75 -36.02 68.18 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 O-C-N 120.299 -1.5 . . . . 20.13 114.523 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -65.51 -21.4 66.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 113.385 0.883 . . . . 32.71 113.385 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.5 mtp -70.57 -21.36 62.69 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 121.124 -0.985 . . . . 19.11 113.236 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -88.05 149.64 23.86 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 112.386 0.513 . . . . 17.16 112.386 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.88 153.09 34.4 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.995 -1.483 . . . . 20.45 106.995 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.85 -27.4 66.63 Favored 'General case' 0 C--O 1.255 1.345 0 C-N-CA 118.605 -1.238 . . . . 27.27 113.293 -174.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -113.97 28.07 9.04 Favored 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 124.887 1.275 . . . . 28.53 109.612 -177.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.66 163.26 14.16 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.13 -0.981 . . . . 17.47 110.793 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 64.9 p -118.23 151.71 37.11 Favored 'General case' 0 C--O 1.249 1.036 0 C-N-CA 117.892 -1.523 . . . . 24.26 114.178 165.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -126.14 128.11 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 124.551 1.14 . . . . 19.7 108.963 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -116.82 107.7 14.94 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 106.189 -1.782 . . . . 24.13 106.189 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -151.78 103.58 2.86 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 107.374 -1.343 . . . . 20.9 107.374 -172.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.88 153.69 93.61 Favored 'Cis proline' 0 CA--C 1.512 -0.58 0 C-N-CA 125.063 -0.807 . . . . 21.55 110.681 1.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -55.14 132.36 47.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.674 -0.694 . . . . 23.0 109.429 173.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.1 -20.84 16.31 Favored Glycine 0 C--O 1.247 0.925 0 O-C-N 123.78 0.675 . . . . 27.31 112.115 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -96.27 160.87 28.78 Favored Pre-proline 0 N--CA 1.439 -1.007 0 O-C-N 121.884 -0.774 . . . . 41.81 109.857 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -62.23 143.65 94.5 Favored 'Trans proline' 0 C--N 1.352 0.719 0 N-CA-C 113.462 0.524 . . . . 29.51 113.462 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -63.62 151.0 87.11 Favored 'Trans proline' 0 CA--C 1.499 -1.261 0 CA-C-O 122.559 0.983 . . . . 31.25 113.513 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.2 pt -105.26 145.07 13.97 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 CA-C-N 114.549 -1.205 . . . . 26.15 108.406 165.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -127.75 130.25 48.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.703 1.201 . . . . 23.44 110.974 -164.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.94 158.42 33.16 Favored Glycine 0 C--O 1.27 2.379 0 N-CA-C 115.146 0.818 . . . . 16.58 115.146 167.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -59.55 -37.67 79.04 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 116.06 1.874 . . . . 24.39 116.06 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -56.2 -52.09 65.66 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 116.251 -2.179 . . . . 18.79 111.741 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -72.68 -31.67 65.22 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 108.076 -1.083 . . . . 27.93 108.076 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 97.7 mt -65.44 -42.21 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.659 -1.155 . . . . 16.98 110.634 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.1 88.22 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.255 -1.528 . . . . 16.95 111.476 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.11 96.31 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.314 -0.625 . . . . 19.97 109.314 -178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -60.0 -48.66 80.79 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 112.131 0.419 . . . . 26.16 112.131 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.88 -35.05 76.42 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 119.226 -0.989 . . . . 20.78 112.082 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . 1.156 ' NH1' ' O ' ' A' ' 196' ' ' HOH . 9.2 ttm180 -60.88 -44.64 96.81 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 118.664 -1.214 . . . . 28.38 108.994 -178.519 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -65.11 -39.61 93.36 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.679 0.792 . . . . 48.07 109.688 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.37 -32.12 29.04 Favored Glycine 0 C--O 1.261 1.82 0 CA-C-O 119.501 -0.611 . . . . 36.39 114.597 -174.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--O 1.269 2.081 0 C-N-CA 126.392 1.877 . . . . 42.34 113.079 -179.51 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 108.281 -1.007 . . . . 52.27 108.281 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . 0.736 ' O ' ' O ' ' A' ' 170' ' ' HOH . 53.0 t -132.1 140.0 48.91 Favored 'Isoleucine or valine' 0 C--O 1.259 1.573 0 N-CA-C 104.699 -2.334 . . . . 32.11 104.699 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -121.94 148.67 44.48 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 104.213 -2.514 . . . . 46.39 104.213 173.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -145.12 135.1 23.77 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 103.931 -2.618 . . . . 20.07 103.931 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 28.0 p -139.12 140.47 37.96 Favored 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 116.568 -2.053 . . . . 25.27 110.683 172.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.4 mt -62.36 141.02 58.52 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-N 113.926 -1.488 . . . . 20.3 110.185 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.4 p -116.72 14.46 15.33 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 118.831 0.742 . . . . 18.17 110.119 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -178.44 176.18 47.85 Favored Glycine 0 C--N 1.346 1.107 0 N-CA-C 106.507 -2.637 . . . . 15.55 106.507 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.91 153.62 77.32 Favored 'Trans proline' 0 C--O 1.261 1.648 0 N-CA-C 114.772 1.028 . . . . 19.11 114.772 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -67.2 135.48 28.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.398 -0.964 . . . . 16.94 108.398 166.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -104.56 111.37 24.02 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 106.7 -1.592 . . . . 20.5 106.7 172.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -105.9 154.99 19.79 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 118.337 -0.839 . . . . 25.67 110.638 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . 0.632 ' OG ' ' ND2' ' A' ' 79' ' ' ASN . 26.1 p -108.27 176.97 4.94 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.098 0.951 . . . . 24.2 109.937 171.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -95.58 16.34 17.45 Favored 'General case' 0 C--O 1.253 1.275 0 C-N-CA 124.289 1.036 . . . . 27.44 112.259 172.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . 0.632 ' ND2' ' OG ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -126.16 37.86 4.25 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.968 -1.093 . . . . 34.93 112.37 172.452 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.35 22.97 78.23 Favored Glycine 0 N--CA 1.468 0.823 0 CA-C-O 117.749 -1.584 . . . . 20.1 114.33 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 78.1 m -126.14 164.32 21.19 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 118.763 1.282 . . . . 19.37 109.976 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -165.0 172.77 40.76 Favored Glycine 0 C--N 1.309 -0.969 0 O-C-N 121.353 -0.842 . . . . 13.62 111.819 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.85 146.39 34.08 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 114.006 -1.097 . . . . 11.86 108.424 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -149.04 145.93 20.45 Favored Pre-proline 0 CA--C 1.502 -0.897 0 C-N-CA 117.336 -1.745 . . . . 15.92 111.24 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -99.49 139.5 0.32 Allowed 'Trans proline' 0 C--O 1.223 -0.265 0 C-N-CA 121.403 1.402 . . . . 12.52 112.364 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -154.62 170.01 22.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 123.39 1.567 . . . . 14.98 108.23 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -125.85 134.04 51.76 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.0 -1.454 . . . . 42.39 107.994 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.6 t -113.35 128.09 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 105.182 -2.155 . . . . 24.41 105.182 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -109.52 132.03 54.52 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.452 -0.944 . . . . 41.9 108.452 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.26 178.91 7.57 Favored 'General case' 0 CA--C 1.494 -1.176 0 C-N-CA 119.482 -0.887 . . . . 53.84 109.31 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 39.7 t -119.11 121.27 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 104.004 -2.591 . . . . 50.62 104.004 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TRP . . . . . 0.578 ' O ' ' N ' ' A' ' 95' ' ' GLN . 24.6 t90 -124.59 129.05 49.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.138 -1.43 . . . . 62.01 107.138 -175.866 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . 0.497 ' C ' ' O ' ' A' ' 92' ' ' TRP . 6.3 m120 34.22 61.71 0.51 Allowed 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.712 0.768 . . . . 62.36 108.984 -172.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.98 -2.58 0.08 OUTLIER Glycine 0 C--O 1.247 0.943 0 CA-C-N 115.026 -0.988 . . . . 57.35 112.684 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . 0.578 ' N ' ' O ' ' A' ' 92' ' ' TRP . 37.2 mt-30 -101.19 111.34 63.4 Favored Pre-proline 0 C--O 1.242 0.659 0 O-C-N 124.307 0.651 . . . . 59.18 109.778 176.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.57 143.02 98.67 Favored 'Trans proline' 0 CA--C 1.499 -1.249 0 C-N-CA 123.645 2.897 . . . . 47.63 107.024 174.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 9.5 p -141.68 164.05 31.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.649 -1.241 . . . . 38.08 107.649 173.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.42 147.15 52.53 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 105.82 -1.918 . . . . 24.55 105.82 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 56.4 tp -128.76 123.43 32.93 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.373 -0.973 . . . . 22.25 108.373 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -87.69 132.29 34.16 Favored 'General case' 0 C--O 1.251 1.162 0 O-C-N 123.65 0.594 . . . . 20.93 110.11 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.0 t -138.44 150.75 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 N-CA-C 108.57 -0.9 . . . . 15.51 108.57 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 34.2 mt -120.89 125.21 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 106.456 -1.683 . . . . 13.1 106.456 163.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -101.23 136.04 41.72 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-O 124.204 1.954 . . . . 15.15 108.319 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.5 t -112.29 124.54 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-N 112.527 -2.124 . . . . 18.02 106.619 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.6 mtt -125.98 143.85 50.93 Favored 'General case' 0 CA--C 1.466 -2.288 0 O-C-N 121.379 -0.826 . . . . 17.76 112.807 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -118.32 124.67 48.35 Favored 'General case' 0 C--O 1.257 1.5 0 N-CA-C 105.726 -1.953 . . . . 34.13 105.726 170.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -97.32 154.67 17.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.207 0.527 . . . . 24.81 110.417 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -96.93 -176.97 3.72 Favored 'General case' 0 C--O 1.263 1.805 0 CA-C-O 124.393 2.044 . . . . 29.7 106.507 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . 0.725 ' OE2' ' NE2' ' A' ' 110' ' ' HIS . 4.4 mp0 -74.34 0.81 13.21 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 110.668 -2.969 . . . . 38.59 113.138 -173.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HIS . . . . . 0.725 ' NE2' ' OE2' ' A' ' 109' ' ' GLU . 35.8 m-70 -109.46 7.72 24.97 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 113.884 1.068 . . . . 47.56 113.884 173.448 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 84.16 14.61 71.42 Favored Glycine 0 C--O 1.203 -1.822 0 C-N-CA 116.908 -2.568 . . . . 28.18 115.567 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -110.84 157.2 20.09 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.867 -1.161 . . . . 32.83 107.867 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 52.5 mt -71.72 117.22 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.947 -1.501 . . . . 17.19 106.947 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -86.15 -40.19 15.9 Favored 'General case' 0 N--CA 1.414 -2.248 0 N-CA-C 115.252 1.575 . . . . 31.14 115.252 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 52.6 p -138.09 139.52 39.53 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 108.975 -0.75 . . . . 22.85 108.975 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.76 130.93 53.4 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 115.409 -2.234 . . . . 21.99 105.261 177.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLN . . . . . 0.805 ' OE1' ' O ' ' A' ' 166' ' ' HOH . 92.4 mt-30 -125.08 114.36 18.96 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.523 -1.658 . . . . 19.13 106.523 168.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -103.37 108.62 19.93 Favored 'General case' 0 CA--C 1.512 -0.503 0 O-C-N 121.424 -0.797 . . . . 15.14 109.53 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -87.67 121.3 29.92 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.591 0.557 . . . . 20.02 111.169 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -176.12 158.29 1.94 Allowed 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.044 -1.465 . . . . 20.97 107.044 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 87.4 p -144.43 -175.38 4.62 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 107.892 -1.151 . . . . 21.45 107.892 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.8 pm0 -63.31 -24.37 67.83 Favored 'General case' 0 C--O 1.28 2.704 0 N-CA-C 113.111 0.782 . . . . 25.15 113.111 -176.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . 0.486 ' O ' ' CG1' ' A' ' 123' ' ' VAL . 55.3 t -57.79 -18.16 9.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 124.677 1.191 . . . . 33.32 112.923 174.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -100.68 7.15 44.07 Favored 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 113.488 0.921 . . . . 19.87 113.488 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 55.4 tp -98.96 142.05 30.95 Favored 'General case' 0 C--O 1.202 -1.403 0 N-CA-C 107.53 -1.285 . . . . 30.83 107.53 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 m -134.35 125.22 27.15 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.291 -1.003 . . . . 29.64 108.291 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 C--O 1.248 1.002 0 N-CA-C 107.04 -1.467 . . . . 43.27 107.04 178.912 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' FP2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . 0.805 ' O ' ' OE1' ' A' ' 117' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . 0.736 ' O ' ' O ' ' A' ' 66' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . 1.156 ' O ' ' NH1' ' A' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.4 tp . . . . . 0 N--CA 1.531 3.585 0 N-CA-C 109.455 -0.572 . . . . 35.04 109.455 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.31 139.24 49.27 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 117.026 -1.516 . . . . 30.05 110.432 -164.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.5 p -66.45 171.93 4.51 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 114.716 -1.129 . . . . 26.41 111.627 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.59 -45.26 81.47 Favored 'General case' 0 C--O 1.259 1.569 0 C-N-CA 119.004 -1.078 . . . . 22.19 110.582 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -62.06 -42.56 99.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.4 -0.92 . . . . 35.6 110.171 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -64.72 -35.79 82.2 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 118.186 -1.406 . . . . 32.11 114.548 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.5 t -59.54 -45.15 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 123.764 0.665 . . . . 18.65 110.622 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.81 -46.85 74.57 Favored 'General case' 0 C--O 1.244 0.781 0 O-C-N 121.301 -0.874 . . . . 28.79 109.523 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.75 -42.66 95.1 Favored Glycine 0 N--CA 1.477 1.419 0 C-N-CA 118.792 -1.671 . . . . 18.49 111.543 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.55 -41.55 88.47 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 117.978 0.889 . . . . 21.16 110.514 -176.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 89.7 mtp -71.83 -35.54 69.93 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.192 -1.003 . . . . 15.88 110.787 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.23 93.53 Favored 'General case' 0 CA--C 1.561 1.37 0 O-C-N 120.151 -1.593 . . . . 18.56 112.114 173.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 18' ' ' GLU . 46.8 ttt-85 -52.98 -51.52 61.26 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 116.685 -2.006 . . . . 20.26 111.472 178.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -54.35 -45.85 72.81 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.09 0.859 . . . . 14.35 111.409 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 42.3 mm -65.04 -40.02 87.58 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.843 0 C-N-CA 117.817 -1.553 . . . . 19.92 111.533 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 43.6 mm-40 -46.63 -50.56 17.42 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 117.387 -1.292 . . . . 27.18 111.789 175.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.06 -36.02 69.46 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 119.425 -0.91 . . . . 19.34 113.407 177.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 66.0 t -64.29 -43.82 97.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.854 0 N-CA-C 107.673 -1.232 . . . . 19.28 107.673 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 170' ' ' HOH . 38.7 t70 -59.33 -40.36 86.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 O-C-N 121.348 -0.845 . . . . 26.5 113.09 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 149' ' ' HOH . 35.9 m -86.37 -22.8 7.05 Favored 'Isoleucine or valine' 0 C--O 1.284 2.912 0 C-N-CA 115.343 -2.543 . . . . 33.17 109.09 179.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.31 31.59 11.56 Favored Glycine 0 C--O 1.259 1.694 0 O-C-N 120.249 -1.532 . . . . 20.39 111.305 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -86.82 89.72 8.06 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 115.73 1.752 . . . . 19.61 115.73 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.547 HD13 ' HG2' ' A' ' 58' ' ' ARG . 20.9 mm -57.97 -45.04 87.96 Favored 'Isoleucine or valine' 0 C--O 1.258 1.547 0 CA-C-N 113.508 -1.678 . . . . 25.12 110.478 -171.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -66.84 -34.64 78.24 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 120.295 -1.503 . . . . 34.04 111.773 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.18 -36.51 71.99 Favored 'General case' 0 CA--C 1.554 1.131 0 N-CA-C 109.148 -0.686 . . . . 18.03 109.148 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.59 -48.57 86.22 Favored 'Isoleucine or valine' 0 C--O 1.266 1.934 0 CA-C-O 123.513 1.625 . . . . 19.24 110.051 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.6 t -60.75 -36.02 68.18 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 O-C-N 120.299 -1.5 . . . . 20.13 114.523 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -65.51 -21.4 66.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 113.385 0.883 . . . . 32.71 113.385 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.5 mtp -70.57 -21.36 62.69 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 121.124 -0.985 . . . . 19.11 113.236 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -88.05 149.64 23.86 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 112.386 0.513 . . . . 17.16 112.386 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.88 153.09 34.4 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.995 -1.483 . . . . 20.45 106.995 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.85 -27.4 66.63 Favored 'General case' 0 C--O 1.255 1.345 0 C-N-CA 118.605 -1.238 . . . . 27.27 113.293 -174.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -113.97 28.07 9.04 Favored 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 124.887 1.275 . . . . 28.53 109.612 -177.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.66 163.26 14.16 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.13 -0.981 . . . . 17.47 110.793 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 64.9 p -118.23 151.71 37.11 Favored 'General case' 0 C--O 1.249 1.036 0 C-N-CA 117.892 -1.523 . . . . 24.26 114.178 165.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -126.14 128.11 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 124.551 1.14 . . . . 19.7 108.963 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -116.82 107.7 14.94 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 106.189 -1.782 . . . . 24.13 106.189 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -151.78 103.58 2.86 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 107.374 -1.343 . . . . 20.9 107.374 -172.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.88 153.69 93.61 Favored 'Cis proline' 0 CA--C 1.512 -0.58 0 C-N-CA 125.063 -0.807 . . . . 21.55 110.681 1.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -55.14 132.36 47.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.674 -0.694 . . . . 23.0 109.429 173.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.1 -20.84 16.31 Favored Glycine 0 C--O 1.247 0.925 0 O-C-N 123.78 0.675 . . . . 27.31 112.115 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -96.27 160.87 28.78 Favored Pre-proline 0 N--CA 1.439 -1.007 0 O-C-N 121.884 -0.774 . . . . 41.81 109.857 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -62.23 143.65 94.5 Favored 'Trans proline' 0 C--N 1.352 0.719 0 N-CA-C 113.462 0.524 . . . . 29.51 113.462 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -63.62 151.0 87.11 Favored 'Trans proline' 0 CA--C 1.499 -1.261 0 CA-C-O 122.559 0.983 . . . . 31.25 113.513 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.2 pt -105.26 145.07 13.97 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 CA-C-N 114.549 -1.205 . . . . 26.15 108.406 165.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -127.75 130.25 48.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.703 1.201 . . . . 23.44 110.974 -164.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.94 158.42 33.16 Favored Glycine 0 C--O 1.27 2.379 0 N-CA-C 115.146 0.818 . . . . 16.58 115.146 167.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -59.55 -37.67 79.04 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 116.06 1.874 . . . . 24.39 116.06 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -56.2 -52.09 65.66 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 116.251 -2.179 . . . . 18.92 111.741 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -72.68 -31.67 65.22 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 108.076 -1.083 . . . . 29.0 108.076 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 97.7 mt -65.44 -42.21 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.659 -1.155 . . . . 16.98 110.634 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.1 88.22 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.255 -1.528 . . . . 16.95 111.476 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.11 96.31 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.314 -0.625 . . . . 19.97 109.314 -178.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -60.0 -48.66 80.79 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 112.131 0.419 . . . . 26.16 112.131 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.88 -35.05 76.42 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 119.226 -0.989 . . . . 20.78 112.082 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . 0.585 ' NH1' ' O ' ' A' ' 196' ' ' HOH . 9.2 ttm180 -60.88 -44.64 96.81 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 118.664 -1.214 . . . . 34.16 108.994 -178.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -65.11 -39.61 93.36 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.679 0.792 . . . . 48.07 109.688 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.37 -32.12 29.04 Favored Glycine 0 C--O 1.261 1.82 0 CA-C-O 119.501 -0.611 . . . . 36.39 114.597 -174.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--O 1.269 2.081 0 C-N-CA 126.392 1.877 . . . . 42.34 113.079 -179.51 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 108.281 -1.007 . . . . 52.27 108.281 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . 0.736 ' O ' ' O ' ' A' ' 170' ' ' HOH . 53.0 t -132.1 140.0 48.91 Favored 'Isoleucine or valine' 0 C--O 1.259 1.573 0 N-CA-C 104.699 -2.334 . . . . 32.11 104.699 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -121.94 148.67 44.48 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 104.213 -2.514 . . . . 46.39 104.213 173.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -145.12 135.1 23.77 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 103.931 -2.618 . . . . 20.07 103.931 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 28.0 p -139.12 140.47 37.96 Favored 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 116.568 -2.053 . . . . 25.27 110.683 172.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.4 mt -62.36 141.02 58.52 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-N 113.926 -1.488 . . . . 20.3 110.185 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.4 p -116.72 14.46 15.33 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 118.831 0.742 . . . . 18.17 110.119 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -178.44 176.18 47.85 Favored Glycine 0 C--N 1.346 1.107 0 N-CA-C 106.507 -2.637 . . . . 15.55 106.507 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.91 153.62 77.32 Favored 'Trans proline' 0 C--O 1.261 1.648 0 N-CA-C 114.772 1.028 . . . . 19.11 114.772 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -67.2 135.48 28.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.398 -0.964 . . . . 16.94 108.398 166.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -104.56 111.37 24.02 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 106.7 -1.592 . . . . 20.5 106.7 172.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -105.9 154.99 19.79 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 118.337 -0.839 . . . . 25.67 110.638 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 26.1 p -108.27 176.97 4.94 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.098 0.951 . . . . 24.2 109.937 171.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -95.58 16.34 17.45 Favored 'General case' 0 C--O 1.253 1.275 0 C-N-CA 124.289 1.036 . . . . 27.44 112.259 172.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -126.16 37.86 4.25 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.968 -1.093 . . . . 34.93 112.37 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.35 22.97 78.23 Favored Glycine 0 N--CA 1.468 0.823 0 CA-C-O 117.749 -1.584 . . . . 20.1 114.33 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 78.1 m -126.14 164.32 21.19 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 118.763 1.282 . . . . 19.37 109.976 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -165.0 172.77 40.76 Favored Glycine 0 C--N 1.309 -0.969 0 O-C-N 121.353 -0.842 . . . . 13.62 111.819 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.85 146.39 34.08 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 114.006 -1.097 . . . . 11.86 108.424 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -149.04 145.93 20.45 Favored Pre-proline 0 CA--C 1.502 -0.897 0 C-N-CA 117.336 -1.745 . . . . 15.92 111.24 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -99.49 139.5 0.32 Allowed 'Trans proline' 0 C--O 1.223 -0.265 0 C-N-CA 121.403 1.402 . . . . 12.52 112.364 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -154.62 170.01 22.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 123.39 1.567 . . . . 14.98 108.23 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -125.85 134.04 51.76 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.0 -1.454 . . . . 42.39 107.994 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.6 t -113.35 128.09 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 105.182 -2.155 . . . . 24.41 105.182 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -109.52 132.03 54.52 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.452 -0.944 . . . . 41.9 108.452 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' MET . . . . . 0.504 ' HG2' ' SG ' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -144.26 178.91 7.57 Favored 'General case' 0 CA--C 1.494 -1.176 0 C-N-CA 119.482 -0.887 . . . . 53.84 109.31 -178.859 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 39.7 t -119.11 121.27 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 104.004 -2.591 . . . . 50.62 104.004 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TRP . . . . . 0.57 ' O ' ' N ' ' A' ' 95' ' ' GLN . 24.6 t90 -124.59 129.05 49.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.138 -1.43 . . . . 62.01 107.138 -175.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . 0.573 ' C ' ' H ' ' A' ' 95' ' ' GLN . 91.1 m-20 34.22 61.71 0.51 Allowed 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.712 0.768 . . . . 62.36 108.984 -172.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.98 -2.58 0.08 OUTLIER Glycine 0 C--O 1.247 0.943 0 CA-C-N 115.026 -0.988 . . . . 57.35 112.684 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . 0.573 ' H ' ' C ' ' A' ' 93' ' ' ASN . 37.2 mt-30 -101.19 111.34 63.4 Favored Pre-proline 0 C--O 1.242 0.659 0 O-C-N 124.307 0.651 . . . . 59.18 109.778 176.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 17.9 Cg_endo -58.57 143.02 98.67 Favored 'Trans proline' 0 CA--C 1.499 -1.249 0 C-N-CA 123.645 2.897 . . . . 47.63 107.024 174.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 127' ' ' VAL . 9.5 p -141.68 164.05 31.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.649 -1.241 . . . . 38.08 107.649 173.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.42 147.15 52.53 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 105.82 -1.918 . . . . 24.55 105.82 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 56.4 tp -128.76 123.43 32.93 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.373 -0.973 . . . . 22.25 108.373 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -87.69 132.29 34.16 Favored 'General case' 0 C--O 1.251 1.162 0 O-C-N 123.65 0.594 . . . . 20.93 110.11 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.0 t -138.44 150.75 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 N-CA-C 108.57 -0.9 . . . . 15.51 108.57 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 34.2 mt -120.89 125.21 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 106.456 -1.683 . . . . 13.1 106.456 163.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . 0.664 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 76.1 m-20 -101.23 136.04 41.72 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-O 124.204 1.954 . . . . 15.15 108.319 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.5 t -112.29 124.54 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-N 112.527 -2.124 . . . . 18.02 106.619 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.6 mtt -125.98 143.85 50.93 Favored 'General case' 0 CA--C 1.466 -2.288 0 O-C-N 121.379 -0.826 . . . . 17.76 112.807 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -118.32 124.67 48.35 Favored 'General case' 0 C--O 1.257 1.5 0 N-CA-C 105.726 -1.953 . . . . 34.13 105.726 170.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -97.32 154.67 17.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.207 0.527 . . . . 24.81 110.417 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -96.93 -176.97 3.72 Favored 'General case' 0 C--O 1.263 1.805 0 CA-C-O 124.393 2.044 . . . . 29.7 106.507 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.725 ' OE2' ' NE2' ' A' ' 110' ' ' HIS . 4.4 mp0 -74.34 0.81 13.21 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 110.668 -2.969 . . . . 38.61 113.138 -173.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HIS . . . . . 0.725 ' NE2' ' OE2' ' A' ' 109' ' ' GLU . 35.8 m-70 -109.46 7.72 24.97 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 113.884 1.068 . . . . 47.56 113.884 173.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 84.16 14.61 71.42 Favored Glycine 0 C--O 1.203 -1.822 0 C-N-CA 116.908 -2.568 . . . . 28.18 115.567 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -110.84 157.2 20.09 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.867 -1.161 . . . . 32.83 107.867 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 52.5 mt -71.72 117.22 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.947 -1.501 . . . . 17.19 106.947 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 62.2 tp60 -86.15 -40.19 15.9 Favored 'General case' 0 N--CA 1.414 -2.248 0 N-CA-C 115.252 1.575 . . . . 31.14 115.252 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 52.6 p -138.09 139.52 39.53 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 108.975 -0.75 . . . . 22.85 108.975 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . 0.694 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 0.0 OUTLIER -123.76 130.93 53.4 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 115.409 -2.234 . . . . 21.99 105.261 177.781 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLN . . . . . 0.937 ' NE2' ' O ' ' A' ' 166' ' ' HOH . 92.4 mt-30 -125.08 114.36 18.96 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.523 -1.658 . . . . 31.46 106.523 168.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -103.37 108.62 19.93 Favored 'General case' 0 CA--C 1.512 -0.503 0 O-C-N 121.424 -0.797 . . . . 15.14 109.53 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -87.67 121.3 29.92 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.591 0.557 . . . . 20.02 111.169 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -176.12 158.29 1.94 Allowed 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.044 -1.465 . . . . 20.97 107.044 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 87.4 p -144.43 -175.38 4.62 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 107.892 -1.151 . . . . 21.45 107.892 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.8 pm0 -63.31 -24.37 67.83 Favored 'General case' 0 C--O 1.28 2.704 0 N-CA-C 113.111 0.782 . . . . 25.15 113.111 -176.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . 0.548 HG12 ' O ' ' A' ' 123' ' ' VAL . 55.3 t -57.79 -18.16 9.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 124.677 1.191 . . . . 33.32 112.923 174.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -100.68 7.15 44.07 Favored 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 113.488 0.921 . . . . 19.87 113.488 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 55.4 tp -98.96 142.05 30.95 Favored 'General case' 0 C--O 1.202 -1.403 0 N-CA-C 107.53 -1.285 . . . . 30.83 107.53 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 m -134.35 125.22 27.15 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.291 -1.003 . . . . 29.64 108.291 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . 0.653 HG22 ' SG ' ' A' ' 97' ' ' CYS . 89.2 t . . . . . 0 C--O 1.248 1.002 0 N-CA-C 107.04 -1.467 . . . . 43.27 107.04 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' FP2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . 0.485 ' O ' HG12 ' A' ' 22' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . 0.937 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . 0.736 ' O ' ' O ' ' A' ' 66' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . 0.585 ' O ' ' NH1' ' A' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.4 tp . . . . . 0 N--CA 1.531 3.585 0 N-CA-C 109.455 -0.572 . . . . 35.039999999999999 109.455 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -67.31 139.24 49.27 Favored 'Trans proline' 0 N--CA 1.423 -2.657 0 C-N-CA 117.026 -1.516 . . . . 30.050000000000001 110.432 -164.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.5 p -66.45 171.93 4.51 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-N 114.716 -1.129 . . . . 26.41 111.627 166.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.59 -45.26 81.47 Favored 'General case' 0 C--O 1.259 1.569 0 C-N-CA 119.004 -1.078 . . . . 22.190000000000001 110.582 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -62.06 -42.56 99.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.4 -0.92 . . . . 35.600000000000001 110.171 179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -64.72 -35.79 82.2 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 118.186 -1.406 . . . . 32.109999999999999 114.548 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 51.5 t -59.54 -45.15 94.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 O-C-N 123.764 0.665 . . . . 18.649999999999999 110.622 171.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.81 -46.85 74.57 Favored 'General case' 0 C--O 1.244 0.781 0 O-C-N 121.301 -0.874 . . . . 28.789999999999999 109.523 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.75 -42.66 95.1 Favored Glycine 0 N--CA 1.477 1.419 0 C-N-CA 118.792 -1.671 . . . . 18.489999999999998 111.543 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 36.3 mt -66.55 -41.55 88.47 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 117.978 0.889 . . . . 21.16 110.514 -176.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 89.7 mtp -71.83 -35.54 69.93 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.192 -1.003 . . . . 15.880000000000001 110.787 -176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.25 -39.23 93.53 Favored 'General case' 0 CA--C 1.561 1.37 0 O-C-N 120.151 -1.593 . . . . 18.559999999999999 112.114 173.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HB3' ' A' ' 18' ' ' GLU . 46.8 ttt-85 -52.98 -51.52 61.26 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 116.685 -2.006 . . . . 20.260000000000002 111.472 178.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -54.35 -45.85 72.81 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.09 0.859 . . . . 14.35 111.409 172.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 42.3 mm -65.04 -40.02 87.58 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.843 0 C-N-CA 117.817 -1.553 . . . . 19.920000000000002 111.533 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 43.6 mm-40 -46.63 -50.56 17.42 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 117.387 -1.292 . . . . 27.18 111.789 175.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.06 -36.02 69.46 Favored 'General case' 0 C--O 1.258 1.532 0 C-N-CA 119.425 -0.91 . . . . 19.34 113.407 177.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 66.0 t -64.29 -43.82 97.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.854 0 N-CA-C 107.673 -1.232 . . . . 19.280000000000001 107.673 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 170' ' ' HOH . 38.7 t70 -59.33 -40.36 86.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 O-C-N 121.348 -0.845 . . . . 26.5 113.09 -178.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 149' ' ' HOH . 35.9 m -86.37 -22.8 7.05 Favored 'Isoleucine or valine' 0 C--O 1.284 2.912 0 C-N-CA 115.343 -2.543 . . . . 33.170000000000002 109.09 179.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.31 31.59 11.56 Favored Glycine 0 C--O 1.259 1.694 0 O-C-N 120.249 -1.532 . . . . 20.390000000000001 111.305 175.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -86.82 89.72 8.06 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 115.73 1.752 . . . . 19.609999999999999 115.73 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.547 HD13 ' HG2' ' A' ' 58' ' ' ARG . 20.9 mm -57.97 -45.04 87.96 Favored 'Isoleucine or valine' 0 C--O 1.258 1.547 0 CA-C-N 113.508 -1.678 . . . . 25.120000000000001 110.478 -171.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -66.84 -34.64 78.24 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 120.295 -1.503 . . . . 34.039999999999999 111.773 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.18 -36.51 71.99 Favored 'General case' 0 CA--C 1.554 1.131 0 N-CA-C 109.148 -0.686 . . . . 18.030000000000001 109.148 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.59 -48.57 86.22 Favored 'Isoleucine or valine' 0 C--O 1.266 1.934 0 CA-C-O 123.513 1.625 . . . . 19.239999999999998 110.051 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.6 t -60.75 -36.02 68.18 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 O-C-N 120.299 -1.5 . . . . 20.129999999999999 114.523 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 51.3 tp60 -65.51 -21.4 66.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 113.385 0.883 . . . . 32.710000000000001 113.385 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.5 mtp -70.57 -21.36 62.69 Favored 'General case' 0 C--O 1.243 0.751 0 O-C-N 121.124 -0.985 . . . . 19.109999999999999 113.236 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 -88.05 149.64 23.86 Favored 'General case' 0 C--O 1.253 1.268 0 N-CA-C 112.386 0.513 . . . . 17.16 112.386 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -62.88 153.09 34.4 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 106.995 -1.483 . . . . 20.449999999999999 106.995 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.85 -27.4 66.63 Favored 'General case' 0 C--O 1.255 1.345 0 C-N-CA 118.605 -1.238 . . . . 27.27 113.293 -174.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -113.97 28.07 9.04 Favored 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 124.887 1.275 . . . . 28.530000000000001 109.612 -177.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.66 163.26 14.16 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 121.13 -0.981 . . . . 17.469999999999999 110.793 -175.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 64.9 p -118.23 151.71 37.11 Favored 'General case' 0 C--O 1.249 1.036 0 C-N-CA 117.892 -1.523 . . . . 24.260000000000002 114.178 165.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 25.6 t -126.14 128.11 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 124.551 1.14 . . . . 19.699999999999999 108.963 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -116.82 107.7 14.94 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 106.189 -1.782 . . . . 24.129999999999999 106.189 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -151.78 103.58 2.86 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 107.374 -1.343 . . . . 20.899999999999999 107.374 -172.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.88 153.69 93.61 Favored 'Cis proline' 0 CA--C 1.512 -0.58 0 C-N-CA 125.063 -0.807 . . . . 21.550000000000001 110.681 1.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -55.14 132.36 47.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.674 -0.694 . . . . 23.0 109.429 173.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.1 -20.84 16.31 Favored Glycine 0 C--O 1.247 0.925 0 O-C-N 123.78 0.675 . . . . 27.309999999999999 112.115 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 84.4 mm-40 -96.27 160.87 28.78 Favored Pre-proline 0 N--CA 1.439 -1.007 0 O-C-N 121.884 -0.774 . . . . 41.810000000000002 109.857 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -62.23 143.65 94.5 Favored 'Trans proline' 0 C--N 1.352 0.719 0 N-CA-C 113.462 0.524 . . . . 29.510000000000002 113.462 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -63.62 151.0 87.11 Favored 'Trans proline' 0 CA--C 1.499 -1.261 0 CA-C-O 122.559 0.983 . . . . 31.25 113.513 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 44.2 pt -105.26 145.07 13.97 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 CA-C-N 114.549 -1.205 . . . . 26.149999999999999 108.406 165.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -127.75 130.25 48.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.703 1.201 . . . . 23.440000000000001 110.974 -164.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.94 158.42 33.16 Favored Glycine 0 C--O 1.27 2.379 0 N-CA-C 115.146 0.818 . . . . 16.579999999999998 115.146 167.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -59.55 -37.67 79.04 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 116.06 1.874 . . . . 24.390000000000001 116.06 -174.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -56.2 -52.09 65.66 Favored 'General case' 0 C--N 1.364 1.216 0 C-N-CA 116.251 -2.179 . . . . 18.920000000000002 111.741 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -72.68 -31.67 65.22 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 108.076 -1.083 . . . . 29.0 108.076 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 97.7 mt -65.44 -42.21 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.659 -1.155 . . . . 16.98 110.634 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.1 88.22 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 120.255 -1.528 . . . . 16.949999999999999 111.476 175.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.11 96.31 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.314 -0.625 . . . . 19.969999999999999 109.314 -178.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -60.0 -48.66 80.79 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 112.131 0.419 . . . . 26.16 112.131 177.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.88 -35.05 76.42 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 119.226 -0.989 . . . . 20.780000000000001 112.082 179.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.585 ' NH1' ' O ' ' A' ' 196' ' ' HOH . 9.2 ttm180 -60.88 -44.64 96.81 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 118.664 -1.214 . . . . 34.159999999999997 108.994 -178.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -65.11 -39.61 93.36 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.679 0.792 . . . . 48.07 109.688 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.37 -32.12 29.04 Favored Glycine 0 C--O 1.261 1.82 0 CA-C-O 119.501 -0.611 . . . . 36.390000000000001 114.597 -174.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--O 1.269 2.081 0 C-N-CA 126.392 1.877 . . . . 42.340000000000003 113.079 -179.51 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 108.281 -1.007 . . . . 52.270000000000003 108.281 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.736 ' O ' ' O ' ' A' ' 170' ' ' HOH . 53.0 t -132.1 140.0 48.91 Favored 'Isoleucine or valine' 0 C--O 1.259 1.573 0 N-CA-C 104.699 -2.334 . . . . 32.109999999999999 104.699 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -121.94 148.67 44.48 Favored 'General case' 0 C--O 1.25 1.111 0 N-CA-C 104.213 -2.514 . . . . 46.390000000000001 104.213 173.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -145.12 135.1 23.77 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 103.931 -2.618 . . . . 20.07 103.931 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 28.0 p -139.12 140.47 37.96 Favored 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 116.568 -2.053 . . . . 25.27 110.683 172.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.4 mt -62.36 141.02 58.52 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-N 113.926 -1.488 . . . . 20.300000000000001 110.185 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.4 p -116.72 14.46 15.33 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 118.831 0.742 . . . . 18.170000000000002 110.119 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -178.44 176.18 47.85 Favored Glycine 0 C--N 1.346 1.107 0 N-CA-C 106.507 -2.637 . . . . 15.550000000000001 106.507 168.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.91 153.62 77.32 Favored 'Trans proline' 0 C--O 1.261 1.648 0 N-CA-C 114.772 1.028 . . . . 19.109999999999999 114.772 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -67.2 135.48 28.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.398 -0.964 . . . . 16.940000000000001 108.398 166.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -104.56 111.37 24.02 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 106.7 -1.592 . . . . 20.5 106.7 172.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -105.9 154.99 19.79 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 118.337 -0.839 . . . . 25.670000000000002 110.638 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . 0.632 ' OG ' ' ND2' ' A' ' 79' ' ' ASN . 26.1 p -108.27 176.97 4.94 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 122.098 0.951 . . . . 24.199999999999999 109.937 171.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -95.58 16.34 17.45 Favored 'General case' 0 C--O 1.253 1.275 0 C-N-CA 124.289 1.036 . . . . 27.440000000000001 112.259 172.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.632 ' ND2' ' OG ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -126.16 37.86 4.25 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.968 -1.093 . . . . 34.93 112.37 172.452 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 73.35 22.97 78.23 Favored Glycine 0 N--CA 1.468 0.823 0 CA-C-O 117.749 -1.584 . . . . 20.100000000000001 114.33 172.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 78.1 m -126.14 164.32 21.19 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 118.763 1.282 . . . . 19.370000000000001 109.976 -179.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -165.0 172.77 40.76 Favored Glycine 0 C--N 1.309 -0.969 0 O-C-N 121.353 -0.842 . . . . 13.619999999999999 111.819 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.85 146.39 34.08 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 114.006 -1.097 . . . . 11.859999999999999 108.424 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 13.8 ptt? -149.04 145.93 20.45 Favored Pre-proline 0 CA--C 1.502 -0.897 0 C-N-CA 117.336 -1.745 . . . . 15.92 111.24 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -99.49 139.5 0.32 Allowed 'Trans proline' 0 C--O 1.223 -0.265 0 C-N-CA 121.403 1.402 . . . . 12.52 112.364 174.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -154.62 170.01 22.52 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-O 123.39 1.567 . . . . 14.98 108.23 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.8 ttm180 -125.85 134.04 51.76 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.0 -1.454 . . . . 42.390000000000001 107.994 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.6 t -113.35 128.09 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 105.182 -2.155 . . . . 24.41 105.182 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -109.52 132.03 54.52 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.452 -0.944 . . . . 41.899999999999999 108.452 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' MET . . . . . 0.504 ' HG2' ' SG ' ' A' ' 97' ' ' CYS . 0.0 OUTLIER -144.26 178.91 7.57 Favored 'General case' 0 CA--C 1.494 -1.176 0 C-N-CA 119.482 -0.887 . . . . 53.840000000000003 109.31 -178.859 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 39.7 t -119.11 121.27 66.3 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 104.004 -2.591 . . . . 50.619999999999997 104.004 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.57 ' O ' ' N ' ' A' ' 95' ' ' GLN . 24.6 t90 -124.59 129.05 49.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.138 -1.43 . . . . 62.009999999999998 107.138 -175.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.573 ' C ' ' H ' ' A' ' 95' ' ' GLN . 6.3 m120 34.22 61.71 0.51 Allowed 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.712 0.768 . . . . 62.359999999999999 108.984 -172.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.98 -2.58 0.08 OUTLIER Glycine 0 C--O 1.247 0.943 0 CA-C-N 115.026 -0.988 . . . . 57.350000000000001 112.684 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.573 ' H ' ' C ' ' A' ' 93' ' ' ASN . 37.2 mt-30 -101.19 111.34 63.4 Favored Pre-proline 0 C--O 1.242 0.659 0 O-C-N 124.307 0.651 . . . . 59.18 109.778 176.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 95' ' ' GLN . 17.9 Cg_endo -58.57 143.02 98.67 Favored 'Trans proline' 0 CA--C 1.499 -1.249 0 C-N-CA 123.645 2.897 . . . . 47.630000000000003 107.024 174.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 127' ' ' VAL . 9.5 p -141.68 164.05 31.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.649 -1.241 . . . . 38.079999999999998 107.649 173.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -131.42 147.15 52.53 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 105.82 -1.918 . . . . 24.550000000000001 105.82 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 56.4 tp -128.76 123.43 32.93 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.373 -0.973 . . . . 22.25 108.373 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -87.69 132.29 34.16 Favored 'General case' 0 C--O 1.251 1.162 0 O-C-N 123.65 0.594 . . . . 20.93 110.11 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 57.0 t -138.44 150.75 24.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 N-CA-C 108.57 -0.9 . . . . 15.51 108.57 -171.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 34.2 mt -120.89 125.21 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 N-CA-C 106.456 -1.683 . . . . 13.1 106.456 163.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.664 ' HB3' ' HE1' ' A' ' 116' ' ' MET . 76.1 m-20 -101.23 136.04 41.72 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-O 124.204 1.954 . . . . 15.15 108.319 172.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 86.5 t -112.29 124.54 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 CA-C-N 112.527 -2.124 . . . . 18.02 106.619 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 56.6 mtt -125.98 143.85 50.93 Favored 'General case' 0 CA--C 1.466 -2.288 0 O-C-N 121.379 -0.826 . . . . 17.760000000000002 112.807 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -118.32 124.67 48.35 Favored 'General case' 0 C--O 1.257 1.5 0 N-CA-C 105.726 -1.953 . . . . 34.130000000000003 105.726 170.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -97.32 154.67 17.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.207 0.527 . . . . 24.809999999999999 110.417 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 42.6 p30 -96.93 -176.97 3.72 Favored 'General case' 0 C--O 1.263 1.805 0 CA-C-O 124.393 2.044 . . . . 29.699999999999999 106.507 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.725 ' OE2' ' NE2' ' A' ' 110' ' ' HIS . 4.4 mp0 -74.34 0.81 13.21 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 110.668 -2.969 . . . . 38.609999999999999 113.138 -173.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HIS . . . . . 0.725 ' NE2' ' OE2' ' A' ' 109' ' ' GLU . 35.8 m-70 -109.46 7.72 24.97 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 113.884 1.068 . . . . 47.560000000000002 113.884 173.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 84.16 14.61 71.42 Favored Glycine 0 C--O 1.203 -1.822 0 C-N-CA 116.908 -2.568 . . . . 28.18 115.567 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -110.84 157.2 20.09 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.867 -1.161 . . . . 32.829999999999998 107.867 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 52.5 mt -71.72 117.22 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 106.947 -1.501 . . . . 17.190000000000001 106.947 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -86.15 -40.19 15.9 Favored 'General case' 0 N--CA 1.414 -2.248 0 N-CA-C 115.252 1.575 . . . . 31.140000000000001 115.252 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 52.6 p -138.09 139.52 39.53 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 108.975 -0.75 . . . . 22.850000000000001 108.975 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . 0.694 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -123.76 130.93 53.4 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 115.409 -2.234 . . . . 21.989999999999998 105.261 177.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.805 ' OE1' ' O ' ' A' ' 166' ' ' HOH . 92.4 mt-30 -125.08 114.36 18.96 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.523 -1.658 . . . . 31.460000000000001 106.523 168.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -103.37 108.62 19.93 Favored 'General case' 0 CA--C 1.512 -0.503 0 O-C-N 121.424 -0.797 . . . . 15.140000000000001 109.53 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -87.67 121.3 29.92 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 123.591 0.557 . . . . 20.02 111.169 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 68.5 p-90 -176.12 158.29 1.94 Allowed 'General case' 0 C--O 1.244 0.765 0 N-CA-C 107.044 -1.465 . . . . 20.969999999999999 107.044 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 87.4 p -144.43 -175.38 4.62 Favored 'General case' 0 CA--C 1.484 -1.568 0 N-CA-C 107.892 -1.151 . . . . 21.449999999999999 107.892 168.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.8 pm0 -63.31 -24.37 67.83 Favored 'General case' 0 C--O 1.28 2.704 0 N-CA-C 113.111 0.782 . . . . 25.149999999999999 113.111 -176.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 123' ' ' VAL . 55.3 t -57.79 -18.16 9.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 124.677 1.191 . . . . 33.32 112.923 174.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -100.68 7.15 44.07 Favored 'General case' 0 CA--C 1.494 -1.195 0 N-CA-C 113.488 0.921 . . . . 19.870000000000001 113.488 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 55.4 tp -98.96 142.05 30.95 Favored 'General case' 0 C--O 1.202 -1.403 0 N-CA-C 107.53 -1.285 . . . . 30.829999999999998 107.53 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.2 m -134.35 125.22 27.15 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.291 -1.003 . . . . 29.640000000000001 108.291 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.653 HG22 ' SG ' ' A' ' 97' ' ' CYS . 89.2 t . . . . . 0 C--O 1.248 1.002 0 N-CA-C 107.04 -1.467 . . . . 43.270000000000003 107.04 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' FP2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . 0.485 ' O ' HG12 ' A' ' 22' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . 0.805 ' O ' ' OE1' ' A' ' 117' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . 0.736 ' O ' ' O ' ' A' ' 66' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . 0.585 ' O ' ' NH1' ' A' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_