data_3t4r_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 3t4r _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' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.18 -2.597 0 CA-C-O 117.327 -1.32 . . . . 62.640000000000001 111.093 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 tt -60.32 -52.77 57.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 CA-C-N 120.236 1.38 . . . . 58.450000000000003 111.826 -171.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' NH1' ' CG ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -56.42 -50.69 70.91 Favored 'General case' 0 CA--C 1.558 1.269 0 CA-C-O 121.819 0.819 . . . . 64.769999999999996 111.512 175.21 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -44.8 -49.48 10.71 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 108.82 -0.807 . . . . 51.509999999999998 108.82 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -73.38 -27.06 61.27 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 118.626 -1.229 . . . . 53.850000000000001 113.096 -175.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.12 -44.04 90.0 Favored 'General case' 0 CA--C 1.585 2.304 0 N-CA-C 113.67 0.989 . . . . 39.210000000000001 113.67 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -62.12 -38.35 88.6 Favored 'General case' 0 C--O 1.214 -0.781 0 C-N-CA 123.424 0.69 . . . . 55.130000000000003 110.395 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -69.9 -37.07 75.86 Favored 'General case' 0 C--O 1.193 -1.87 0 N-CA-C 108.137 -1.06 . . . . 50.329999999999998 108.137 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -47.92 78.19 Favored 'General case' 0 CA--C 1.481 -1.688 0 CA-C-N 119.078 0.854 . . . . 37.659999999999997 111.641 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.9 mt -53.96 -43.53 69.96 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 122.322 -0.236 . . . . 39.039999999999999 111.001 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.25 91.65 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.644 1.72 . . . . 38.810000000000002 115.644 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -71.15 -22.73 62.02 Favored 'General case' 0 CA--C 1.487 -1.481 0 N-CA-C 107.875 -1.158 . . . . 48.130000000000003 107.875 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.2 mt -95.31 11.38 32.81 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 112.978 0.733 . . . . 42.710000000000001 112.978 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 83.41 14.68 0.34 Allowed 'General case' 0 C--O 1.156 -3.864 0 N-CA-C 115.318 1.599 . . . . 52.369999999999997 115.318 169.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -67.24 147.05 53.54 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.721 -1.585 . . . . 57.920000000000002 106.721 168.563 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.58 144.85 35.16 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 104.93 -2.248 . . . . 67.879999999999995 104.93 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -39.08 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 C-N-CA 124.377 1.071 . . . . 46.880000000000003 109.077 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.09 72.23 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 115.267 0.867 . . . . 53.659999999999997 115.267 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.58 -36.89 51.53 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 116.176 1.917 . . . . 64.129999999999995 116.176 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mt -54.1 -39.57 42.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.25 0 CA-C-N 118.476 0.58 . . . . 40.299999999999997 112.129 169.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.42 -15.51 63.71 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.356 -0.538 . . . . 50.07 111.066 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -99.49 -8.5 24.57 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.08 -1.048 . . . . 57.399999999999999 113.21 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.89 141.03 57.52 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 118.725 0.693 . . . . 49.439999999999998 111.125 168.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.7 p -84.23 160.69 56.74 Favored Pre-proline 0 C--O 1.189 -2.096 0 N-CA-C 105.423 -2.066 . . . . 53.299999999999997 105.423 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.79 -39.13 68.09 Favored 'Trans proline' 0 C--O 1.201 -1.346 0 N-CA-C 115.594 1.344 . . . . 47.75 115.594 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.5 mt -66.5 -36.54 82.98 Favored 'General case' 0 C--O 1.206 -1.193 0 C-N-CA 123.773 0.829 . . . . 51.469999999999999 111.286 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.71 -46.05 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 CA-C-O 118.889 -0.577 . . . . 52.799999999999997 110.808 174.262 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -49.43 -50.77 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.598 0 CA-C-N 119.302 0.956 . . . . 39.979999999999997 111.917 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -57.77 -36.5 72.22 Favored 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 115.963 -0.562 . . . . 49.520000000000003 112.399 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . 0.663 ' C ' ' CD2' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -74.67 -39.28 62.12 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 122.164 0.983 . . . . 74.810000000000002 112.719 178.536 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -73.31 -38.07 65.95 Favored 'General case' 0 N--CA 1.417 -2.081 0 O-C-N 121.202 -0.936 . . . . 47.259999999999998 112.761 -178.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.7 t -122.19 76.49 42.14 Favored Pre-proline 0 C--O 1.199 -1.588 0 C-N-CA 124.942 1.297 . . . . 32.340000000000003 108.154 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.44 164.77 12.39 Favored 'Trans proline' 0 N--CA 1.436 -1.878 0 CA-C-O 117.462 -1.141 . . . . 38.93 109.485 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.92 -29.75 70.43 Favored 'General case' 0 C--O 1.199 -1.585 0 CA-C-N 119.809 1.186 . . . . 54.18 113.811 -175.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -72.89 -23.94 60.78 Favored 'General case' 0 C--O 1.203 -1.367 0 O-C-N 121.373 -0.83 . . . . 58.719999999999999 110.177 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.7 mt -77.43 -42.23 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 112.269 0.47 . . . . 51.409999999999997 112.269 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -43.06 73.85 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 115.976 -0.556 . . . . 49.670000000000002 110.232 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -27.33 68.86 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.578 1.151 . . . . 58.689999999999998 109.721 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' MSE . . . . . . . . . . . . . 41.7 mtt -59.67 -31.68 69.77 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-N 115.363 -0.835 . . . . 70.709999999999994 111.163 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.12 -2.0 57.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.065 -0.971 . . . . 71.390000000000001 111.911 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.11 -61.35 2.36 Favored 'General case' 0 C--O 1.249 1.05 0 O-C-N 123.941 0.776 . . . . 86.719999999999999 113.054 -167.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.64 18.81 0.7 Allowed 'General case' 0 C--O 1.282 2.779 0 CA-C-O 122.262 1.029 . . . . 112.34 110.747 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.85 165.77 26.05 Favored Glycine 0 C--O 1.28 3.023 0 CA-C-N 112.005 -2.361 . . . . 90.810000000000002 111.742 167.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . 0.62 ' CB ' ' CA ' ' A' ' 47' ' ' THR . 1.6 mt -92.39 -175.48 4.03 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 102.666 -3.087 . . . . 106.09 102.666 175.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . 0.83 ' N ' ' CD ' ' A' ' 48' ' ' PRO 0.776 . . -144.72 -8.99 0.0 OUTLIER Pre-proline 0 C--O 1.262 1.744 0 N-CA-C 105.062 -2.199 . . . . 99.670000000000002 105.062 6.026 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . 0.83 ' CD ' ' N ' ' A' ' 47' ' ' THR . 20.0 Cg_exo 20.87 -114.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.426 -2.491 0 O-C-N 124.662 1.875 . . . . 116.78 108.522 -177.211 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . 0.463 ' OE2' ' CA ' ' A' ' 49' ' ' GLU . 0.3 OUTLIER -129.48 37.89 3.94 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 105.872 -1.899 . . . . 110.61 105.872 151.97 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 20.2 tp -61.59 -37.32 83.44 Favored 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 102.507 -3.146 . . . . 87.870000000000005 102.507 159.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -52.11 -55.07 23.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.255 -1.339 . . . . 80.640000000000001 109.857 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -65.49 -36.42 83.81 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 118.36 -1.336 . . . . 101.17 110.521 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -56.33 -55.56 31.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.43 0.692 . . . . 79.129999999999995 112.337 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.38 -43.46 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 CA-C-N 115.25 -0.886 . . . . 49.490000000000002 113.307 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -54.34 -45.79 72.79 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.014 0.821 . . . . 62.079999999999998 109.103 175.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -57.18 -44.37 83.49 Favored 'General case' 0 CA--C 1.56 1.356 0 O-C-N 123.523 0.515 . . . . 67.209999999999994 111.354 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.02 -43.0 99.94 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.497 -0.481 . . . . 80.920000000000002 110.846 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 52.6 mt -68.87 -42.73 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 CA-C-O 121.917 0.865 . . . . 42.899999999999999 111.08 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.6 mt -56.55 -40.55 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 C-N-CA 123.515 0.726 . . . . 54.600000000000001 111.821 172.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.88 -38.99 80.09 Favored 'General case' 0 C--O 1.215 -0.73 0 C-N-CA 119.742 -0.783 . . . . 88.170000000000002 112.77 173.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -76.14 -36.4 58.82 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 106.869 -1.53 . . . . 46.189999999999998 106.869 -176.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -68.75 -32.76 72.75 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 119.549 -0.86 . . . . 88.640000000000001 110.501 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 12.3 mt -63.4 -49.94 80.7 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.081 0 C-N-CA 125.116 1.366 . . . . 71.049999999999997 107.45 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -49.55 -47.09 49.37 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 123.642 0.588 . . . . 51.869999999999997 111.885 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -48.86 66.53 Favored 'General case' 0 CA--C 1.481 -1.706 0 C-N-CA 123.62 0.768 . . . . 72.310000000000002 109.195 -173.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' MSE . . . . . . . . . . . . . 67.5 mtm -56.47 -46.59 80.33 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 124.416 1.073 . . . . 75.319999999999993 111.226 178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.95 -41.81 83.61 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 121.049 0.452 . . . . 55.140000000000001 110.47 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -39.36 90.04 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 125.099 1.36 . . . . 67.989999999999995 110.673 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -60.0 -46.13 90.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.698 -0.401 . . . . 72.859999999999999 110.357 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -65.1 -45.81 83.65 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 118.163 2.653 . . . . 82.739999999999995 118.163 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . 0.493 ' CE1' ' O ' ' A' ' 101' ' ' HOH . 1.7 t80 -58.03 -47.66 82.42 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 116.16 1.911 . . . . 110.59999999999999 116.16 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.7 m -45.95 -43.8 14.31 Favored 'General case' 0 C--O 1.277 2.511 0 N-CA-C 115.949 1.833 . . . . 96.739999999999995 115.949 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.9 p -76.21 -49.37 17.33 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 113.793 -1.549 . . . . 96.159999999999997 112.244 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.605 3.065 0 N-CA-C 103.433 -2.803 . . . . 88.25 103.433 -171.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . 0.493 ' O ' ' CE1' ' A' ' 71' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' A' ' 6' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.18 -2.597 0 CA-C-O 117.327 -1.32 . . . . 62.640000000000001 111.093 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . 0.458 HG23 ' H ' ' A' ' 5' ' ' ARG . 1.7 tt -60.32 -52.77 57.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 CA-C-N 120.236 1.38 . . . . 58.450000000000003 111.826 -171.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 0.85 ' HG2' HH11 ' A' ' 5' ' ' ARG . 0.0 OUTLIER -56.42 -50.69 70.91 Favored 'General case' 0 CA--C 1.558 1.269 0 CA-C-O 121.819 0.819 . . . . 64.769999999999996 111.512 175.21 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HIS . . . . . 0.464 ' HB3' ' O ' ' A' ' 3' ' ' ARG . 53.1 t60 -44.8 -49.48 10.71 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 108.82 -0.807 . . . . 51.509999999999998 108.82 172.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -73.38 -27.06 61.27 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 118.626 -1.229 . . . . 53.850000000000001 113.096 -175.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.12 -44.04 90.0 Favored 'General case' 0 CA--C 1.585 2.304 0 N-CA-C 113.67 0.989 . . . . 39.210000000000001 113.67 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -62.12 -38.35 88.6 Favored 'General case' 0 C--O 1.214 -0.781 0 C-N-CA 123.424 0.69 . . . . 55.130000000000003 110.395 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -69.9 -37.07 75.86 Favored 'General case' 0 C--O 1.193 -1.87 0 N-CA-C 108.137 -1.06 . . . . 50.329999999999998 108.137 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -47.92 78.19 Favored 'General case' 0 CA--C 1.481 -1.688 0 CA-C-N 119.078 0.854 . . . . 37.659999999999997 111.641 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.9 mt -53.96 -43.53 69.96 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 122.322 -0.236 . . . . 39.039999999999999 111.001 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.25 91.65 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.644 1.72 . . . . 38.810000000000002 115.644 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -71.15 -22.73 62.02 Favored 'General case' 0 CA--C 1.487 -1.481 0 N-CA-C 107.875 -1.158 . . . . 48.130000000000003 107.875 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.2 mt -95.31 11.38 32.81 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 112.978 0.733 . . . . 42.710000000000001 112.978 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 83.41 14.68 0.34 Allowed 'General case' 0 C--O 1.156 -3.864 0 N-CA-C 115.318 1.599 . . . . 52.369999999999997 115.318 169.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -67.24 147.05 53.54 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.721 -1.585 . . . . 57.920000000000002 106.721 168.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.58 144.85 35.16 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 104.93 -2.248 . . . . 67.879999999999995 104.93 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -39.08 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 C-N-CA 124.377 1.071 . . . . 46.880000000000003 109.077 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.09 72.23 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 115.267 0.867 . . . . 53.659999999999997 115.267 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.58 -36.89 51.53 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 116.176 1.917 . . . . 64.129999999999995 116.176 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mt -54.1 -39.57 42.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.25 0 CA-C-N 118.476 0.58 . . . . 40.299999999999997 112.129 169.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.42 -15.51 63.71 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.356 -0.538 . . . . 50.07 111.066 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -99.49 -8.5 24.57 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.08 -1.048 . . . . 57.399999999999999 113.21 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.89 141.03 57.52 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 118.725 0.693 . . . . 49.439999999999998 111.125 168.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.628 ' OG1' HG13 ' A' ' 29' ' ' ILE . 26.7 p -84.23 160.69 56.74 Favored Pre-proline 0 C--O 1.189 -2.096 0 N-CA-C 105.423 -2.066 . . . . 53.299999999999997 105.423 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.79 -39.13 68.09 Favored 'Trans proline' 0 C--O 1.201 -1.346 0 N-CA-C 115.594 1.344 . . . . 47.75 115.594 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.5 mt -66.5 -36.54 82.98 Favored 'General case' 0 C--O 1.206 -1.193 0 C-N-CA 123.773 0.829 . . . . 51.469999999999999 111.286 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . 0.628 HG13 ' OG1' ' A' ' 26' ' ' THR . 0.9 OUTLIER -69.71 -46.05 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 CA-C-O 118.889 -0.577 . . . . 52.799999999999997 110.808 174.262 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -49.43 -50.77 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.598 0 CA-C-N 119.302 0.956 . . . . 39.979999999999997 111.917 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -57.77 -36.5 72.22 Favored 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 115.963 -0.562 . . . . 49.520000000000003 112.399 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . 0.663 ' C ' ' CD2' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -74.67 -39.28 62.12 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 122.164 0.983 . . . . 74.810000000000002 112.719 178.536 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -73.31 -38.07 65.95 Favored 'General case' 0 N--CA 1.417 -2.081 0 O-C-N 121.202 -0.936 . . . . 47.259999999999998 112.761 -178.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.7 t -122.19 76.49 42.14 Favored Pre-proline 0 C--O 1.199 -1.588 0 C-N-CA 124.942 1.297 . . . . 32.340000000000003 108.154 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . 0.647 ' HD2' HD12 ' A' ' 38' ' ' ILE . 31.8 Cg_exo -60.44 164.77 12.39 Favored 'Trans proline' 0 N--CA 1.436 -1.878 0 CA-C-O 117.462 -1.141 . . . . 38.93 109.485 173.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.92 -29.75 70.43 Favored 'General case' 0 C--O 1.199 -1.585 0 CA-C-N 119.809 1.186 . . . . 54.18 113.811 -175.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . 0.455 ' OD2' ' HB2' ' A' ' 35' ' ' PRO . 12.2 p-10 -72.89 -23.94 60.78 Favored 'General case' 0 C--O 1.203 -1.367 0 O-C-N 121.373 -0.83 . . . . 58.719999999999999 110.177 177.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.647 HD12 ' HD2' ' A' ' 35' ' ' PRO . 47.7 mt -77.43 -42.23 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 112.269 0.47 . . . . 51.409999999999997 112.269 179.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -43.06 73.85 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 115.976 -0.556 . . . . 49.670000000000002 110.232 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -27.33 68.86 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.578 1.151 . . . . 58.689999999999998 109.721 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' MSE . . . . . 0.455 ' HE1' ' OE2' ' A' ' 57' ' ' GLU . 41.7 mtt -59.67 -31.68 69.77 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-N 115.363 -0.835 . . . . 70.709999999999994 111.163 178.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.12 -2.0 57.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.065 -0.971 . . . . 71.390000000000001 111.911 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.11 -61.35 2.36 Favored 'General case' 0 C--O 1.249 1.05 0 O-C-N 123.941 0.776 . . . . 86.719999999999999 113.054 -167.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.64 18.81 0.7 Allowed 'General case' 0 C--O 1.282 2.779 0 CA-C-O 122.262 1.029 . . . . 112.34 110.747 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.85 165.77 26.05 Favored Glycine 0 C--O 1.28 3.023 0 CA-C-N 112.005 -2.361 . . . . 90.810000000000002 111.742 167.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . 0.888 ' HB3' ' CA ' ' A' ' 47' ' ' THR . 1.6 mt -92.39 -175.48 4.03 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 102.666 -3.087 . . . . 106.09 102.666 175.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 1.037 ' N ' ' HD2' ' A' ' 48' ' ' PRO 0.776 . . -144.72 -8.99 0.0 OUTLIER Pre-proline 0 C--O 1.262 1.744 0 N-CA-C 105.062 -2.199 . . . . 99.670000000000002 105.062 6.026 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . 1.037 ' HD2' ' N ' ' A' ' 47' ' ' THR . 20.0 Cg_exo 20.87 -114.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.426 -2.491 0 O-C-N 124.662 1.875 . . . . 116.78 108.522 -177.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . 0.905 ' HG3' ' HB2' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -129.48 37.89 3.94 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 105.872 -1.899 . . . . 110.61 105.872 151.97 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.583 ' HB2' ' HG2' ' A' ' 48' ' ' PRO . 20.2 tp -61.59 -37.32 83.44 Favored 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 102.507 -3.146 . . . . 87.870000000000005 102.507 159.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -52.11 -55.07 23.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.255 -1.339 . . . . 80.640000000000001 109.857 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.905 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 2.0 tt0 -65.49 -36.42 83.81 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 118.36 -1.336 . . . . 101.17 110.521 -177.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -56.33 -55.56 31.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.43 0.692 . . . . 79.129999999999995 112.337 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.38 -43.46 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 CA-C-N 115.25 -0.886 . . . . 49.490000000000002 113.307 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' HG13 ' A' ' 59' ' ' ILE . 86.7 mt-30 -54.34 -45.79 72.79 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.014 0.821 . . . . 62.079999999999998 109.103 175.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -57.18 -44.37 83.49 Favored 'General case' 0 CA--C 1.56 1.356 0 O-C-N 123.523 0.515 . . . . 67.209999999999994 111.354 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' OE2' ' HE1' ' A' ' 41' ' ' MSE . 3.9 mm-40 -63.02 -43.0 99.94 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.497 -0.481 . . . . 80.920000000000002 110.846 -179.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 52.6 mt -68.87 -42.73 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 CA-C-O 121.917 0.865 . . . . 42.899999999999999 111.08 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 55' ' ' GLN . 18.6 mt -56.55 -40.55 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 C-N-CA 123.515 0.726 . . . . 54.600000000000001 111.821 172.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.88 -38.99 80.09 Favored 'General case' 0 C--O 1.215 -0.73 0 C-N-CA 119.742 -0.783 . . . . 88.170000000000002 112.77 173.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -76.14 -36.4 58.82 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 106.869 -1.53 . . . . 46.189999999999998 106.869 -176.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -68.75 -32.76 72.75 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 119.549 -0.86 . . . . 88.640000000000001 110.501 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . 0.756 ' HA ' ' HE3' ' A' ' 66' ' ' MSE . 12.3 mt -63.4 -49.94 80.7 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.081 0 C-N-CA 125.116 1.366 . . . . 71.049999999999997 107.45 178.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -49.55 -47.09 49.37 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 123.642 0.588 . . . . 51.869999999999997 111.885 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -48.86 66.53 Favored 'General case' 0 CA--C 1.481 -1.706 0 C-N-CA 123.62 0.768 . . . . 72.310000000000002 109.195 -173.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' MSE . . . . . 0.756 ' HE3' ' HA ' ' A' ' 63' ' ' ILE . 67.5 mtm -56.47 -46.59 80.33 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 124.416 1.073 . . . . 75.319999999999993 111.226 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.95 -41.81 83.61 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 121.049 0.452 . . . . 55.140000000000001 110.47 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -39.36 90.04 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 125.099 1.36 . . . . 67.989999999999995 110.673 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -60.0 -46.13 90.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.698 -0.401 . . . . 72.859999999999999 110.357 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -65.1 -45.81 83.65 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 118.163 2.653 . . . . 82.739999999999995 118.163 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . 0.481 ' CE1' ' O ' ' A' ' 101' ' ' HOH . 1.7 t80 -58.03 -47.66 82.42 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 116.16 1.911 . . . . 110.59999999999999 116.16 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.7 m -45.95 -43.8 14.31 Favored 'General case' 0 C--O 1.277 2.511 0 N-CA-C 115.949 1.833 . . . . 96.739999999999995 115.949 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.9 p -76.21 -49.37 17.33 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 113.793 -1.549 . . . . 96.159999999999997 112.244 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.605 3.065 0 N-CA-C 103.433 -2.803 . . . . 88.25 103.433 -171.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . 0.481 ' O ' ' CE1' ' A' ' 71' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' A' ' 6' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.18 -2.597 0 CA-C-O 117.327 -1.32 . . . . 62.64 111.093 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.458 HG23 ' H ' ' A' ' 5' ' ' ARG . 1.7 tt -60.32 -52.77 57.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.73 0 CA-C-N 120.236 1.38 . . . . 58.45 111.826 -171.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.85 HH11 ' HG2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -56.42 -50.69 70.91 Favored 'General case' 0 CA--C 1.558 1.269 0 CA-C-O 121.819 0.819 . . . . 64.77 111.512 175.21 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.464 ' HB3' ' O ' ' A' ' 3' ' ' ARG . 53.1 t60 -44.8 -49.48 10.71 Favored 'General case' 0 N--CA 1.428 -1.526 0 N-CA-C 108.82 -0.807 . . . . 51.51 108.82 172.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -73.38 -27.06 61.27 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 118.626 -1.229 . . . . 53.85 113.096 -175.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.12 -44.04 90.0 Favored 'General case' 0 CA--C 1.585 2.304 0 N-CA-C 113.67 0.989 . . . . 39.21 113.67 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -62.12 -38.35 88.6 Favored 'General case' 0 C--O 1.214 -0.781 0 C-N-CA 123.424 0.69 . . . . 55.13 110.395 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -69.9 -37.07 75.86 Favored 'General case' 0 C--O 1.193 -1.87 0 N-CA-C 108.137 -1.06 . . . . 50.33 108.137 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.09 -47.92 78.19 Favored 'General case' 0 CA--C 1.481 -1.688 0 CA-C-N 119.078 0.854 . . . . 37.66 111.641 176.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.9 mt -53.96 -43.53 69.96 Favored 'General case' 0 CA--C 1.558 1.26 0 O-C-N 122.322 -0.236 . . . . 39.04 111.001 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.02 -39.25 91.65 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.644 1.72 . . . . 38.81 115.644 172.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.0 m-20 -71.15 -22.73 62.02 Favored 'General case' 0 CA--C 1.487 -1.481 0 N-CA-C 107.875 -1.158 . . . . 48.13 107.875 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.2 mt -95.31 11.38 32.81 Favored 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 112.978 0.733 . . . . 42.71 112.978 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 83.41 14.68 0.34 Allowed 'General case' 0 C--O 1.156 -3.864 0 N-CA-C 115.318 1.599 . . . . 52.37 115.318 169.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -67.24 147.05 53.54 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.721 -1.585 . . . . 57.92 106.721 168.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -78.58 144.85 35.16 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 104.93 -2.248 . . . . 67.88 104.93 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -60.23 -39.08 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 C-N-CA 124.377 1.071 . . . . 46.88 109.077 178.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.09 72.23 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 115.267 0.867 . . . . 53.66 115.267 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -77.58 -36.89 51.53 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 116.176 1.917 . . . . 64.13 116.176 176.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.0 mt -54.1 -39.57 42.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.25 0 CA-C-N 118.476 0.58 . . . . 40.3 112.129 169.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.42 -15.51 63.71 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 120.356 -0.538 . . . . 50.07 111.066 -175.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -99.49 -8.5 24.57 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.08 -1.048 . . . . 57.4 113.21 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -60.89 141.03 57.52 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 118.725 0.693 . . . . 49.44 111.125 168.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.628 ' OG1' HG13 ' A' ' 29' ' ' ILE . 26.7 p -84.23 160.69 56.74 Favored Pre-proline 0 C--O 1.189 -2.096 0 N-CA-C 105.423 -2.066 . . . . 53.3 105.423 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.79 -39.13 68.09 Favored 'Trans proline' 0 C--O 1.201 -1.346 0 N-CA-C 115.594 1.344 . . . . 47.75 115.594 174.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.5 mt -66.5 -36.54 82.98 Favored 'General case' 0 C--O 1.206 -1.193 0 C-N-CA 123.773 0.829 . . . . 51.47 111.286 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.628 HG13 ' OG1' ' A' ' 26' ' ' THR . 0.9 OUTLIER -69.71 -46.05 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 CA-C-O 118.889 -0.577 . . . . 52.8 110.808 174.262 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 71.8 t -49.43 -50.77 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.598 0 CA-C-N 119.302 0.956 . . . . 39.98 111.917 172.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -57.77 -36.5 72.22 Favored 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 115.963 -0.562 . . . . 49.52 112.399 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.663 ' C ' ' CD2' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -74.67 -39.28 62.12 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 122.164 0.983 . . . . 74.81 112.719 178.536 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -73.31 -38.07 65.95 Favored 'General case' 0 N--CA 1.417 -2.081 0 O-C-N 121.202 -0.936 . . . . 47.26 112.761 -178.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.7 t -122.19 76.49 42.14 Favored Pre-proline 0 C--O 1.199 -1.588 0 C-N-CA 124.942 1.297 . . . . 32.34 108.154 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.647 ' HD2' HD12 ' A' ' 38' ' ' ILE . 31.8 Cg_exo -60.44 164.77 12.39 Favored 'Trans proline' 0 N--CA 1.436 -1.878 0 CA-C-O 117.462 -1.141 . . . . 38.93 109.485 173.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.92 -29.75 70.43 Favored 'General case' 0 C--O 1.199 -1.585 0 CA-C-N 119.809 1.186 . . . . 54.18 113.811 -175.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.455 ' OD2' ' HB2' ' A' ' 35' ' ' PRO . 12.2 p-10 -72.89 -23.94 60.78 Favored 'General case' 0 C--O 1.203 -1.367 0 O-C-N 121.373 -0.83 . . . . 58.72 110.177 177.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.647 HD12 ' HD2' ' A' ' 35' ' ' PRO . 47.7 mt -77.43 -42.23 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 112.269 0.47 . . . . 51.41 112.269 179.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -43.06 73.85 Favored 'General case' 0 C--O 1.196 -1.74 0 CA-C-N 115.976 -0.556 . . . . 49.67 110.232 172.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -27.33 68.86 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 124.578 1.151 . . . . 58.69 109.721 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' MSE . . . . . 0.455 ' HE1' ' OE2' ' A' ' 57' ' ' GLU . 41.7 mtt -59.67 -31.68 69.77 Favored 'General case' 0 C--O 1.248 0.994 0 CA-C-N 115.363 -0.835 . . . . 70.71 111.163 178.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.12 -2.0 57.65 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.065 -0.971 . . . . 71.39 111.911 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -54.11 -61.35 2.36 Favored 'General case' 0 C--O 1.249 1.05 0 O-C-N 123.941 0.776 . . . . 86.72 113.054 -167.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -79.64 18.81 0.7 Allowed 'General case' 0 C--O 1.282 2.779 0 CA-C-O 122.262 1.029 . . . . 112.34 110.747 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.85 165.77 26.05 Favored Glycine 0 C--O 1.28 3.023 0 CA-C-N 112.005 -2.361 . . . . 90.81 111.742 167.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.888 ' HB3' ' CA ' ' A' ' 47' ' ' THR . 1.6 mt -92.39 -175.48 4.03 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 102.666 -3.087 . . . . 106.09 102.666 175.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 1.037 ' N ' ' HD2' ' A' ' 48' ' ' PRO 0.776 . . -144.72 -8.99 0.0 OUTLIER Pre-proline 0 C--O 1.262 1.744 0 N-CA-C 105.062 -2.199 . . . . 99.67 105.062 6.026 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . 1.037 ' HD2' ' N ' ' A' ' 47' ' ' THR . 20.0 Cg_exo 20.87 -114.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.426 -2.491 0 O-C-N 124.662 1.875 . . . . 116.78 108.522 -177.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.905 ' HG3' ' HB2' ' A' ' 52' ' ' GLU . 0.3 OUTLIER -129.48 37.89 3.94 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 105.872 -1.899 . . . . 110.61 105.872 151.97 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.583 ' HB2' ' HG2' ' A' ' 48' ' ' PRO . 20.2 tp -61.59 -37.32 83.44 Favored 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 102.507 -3.146 . . . . 87.87 102.507 159.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 61.2 tttt -52.11 -55.07 23.14 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 114.255 -1.339 . . . . 80.64 109.857 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.905 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 2.0 tt0 -65.49 -36.42 83.81 Favored 'General case' 0 C--O 1.2 -1.548 0 C-N-CA 118.36 -1.336 . . . . 101.17 110.521 -177.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 6.0 tttp -56.33 -55.56 31.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.43 0.692 . . . . 79.13 112.337 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.38 -43.46 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 CA-C-N 115.25 -0.886 . . . . 49.49 113.307 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' HG13 ' A' ' 59' ' ' ILE . 86.7 mt-30 -54.34 -45.79 72.79 Favored 'General case' 0 N--CA 1.464 0.234 0 O-C-N 124.014 0.821 . . . . 62.08 109.103 175.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -57.18 -44.37 83.49 Favored 'General case' 0 CA--C 1.56 1.356 0 O-C-N 123.523 0.515 . . . . 67.21 111.354 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' OE2' ' HE1' ' A' ' 41' ' ' MSE . 3.9 mm-40 -63.02 -43.0 99.94 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 120.497 -0.481 . . . . 80.92 110.846 -179.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 52.6 mt -68.87 -42.73 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 CA-C-O 121.917 0.865 . . . . 42.9 111.08 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 55' ' ' GLN . 18.6 mt -56.55 -40.55 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 C-N-CA 123.515 0.726 . . . . 54.6 111.821 172.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.88 -38.99 80.09 Favored 'General case' 0 C--O 1.215 -0.73 0 C-N-CA 119.742 -0.783 . . . . 88.17 112.77 173.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -76.14 -36.4 58.82 Favored 'General case' 0 C--O 1.182 -2.46 0 N-CA-C 106.869 -1.53 . . . . 46.19 106.869 -176.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.426 ' HD2' ' HG3' ' A' ' 66' ' ' MSE . 3.5 t-160 -68.75 -32.76 72.75 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 119.549 -0.86 . . . . 88.64 110.501 179.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.756 ' HA ' ' HE3' ' A' ' 66' ' ' MSE . 12.3 mt -63.4 -49.94 80.7 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.081 0 C-N-CA 125.116 1.366 . . . . 71.05 107.45 178.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -49.55 -47.09 49.37 Favored 'General case' 0 C--O 1.215 -0.723 0 O-C-N 123.642 0.588 . . . . 51.87 111.885 174.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -48.86 66.53 Favored 'General case' 0 CA--C 1.481 -1.706 0 C-N-CA 123.62 0.768 . . . . 72.31 109.195 -173.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' MSE . . . . . 0.756 ' HE3' ' HA ' ' A' ' 63' ' ' ILE . 67.5 mtm -56.47 -46.59 80.33 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 124.416 1.073 . . . . 75.32 111.226 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.95 -41.81 83.61 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 121.049 0.452 . . . . 55.14 110.47 -175.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -39.36 90.04 Favored 'General case' 0 C--O 1.21 -1.002 0 C-N-CA 125.099 1.36 . . . . 67.99 110.673 -178.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -60.0 -46.13 90.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.698 -0.401 . . . . 72.86 110.357 172.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -65.1 -45.81 83.65 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 118.163 2.653 . . . . 82.74 118.163 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.481 ' CE1' ' O ' ' A' ' 101' ' ' HOH . 1.7 t80 -58.03 -47.66 82.42 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 116.16 1.911 . . . . 110.6 116.16 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.7 m -45.95 -43.8 14.31 Favored 'General case' 0 C--O 1.277 2.511 0 N-CA-C 115.949 1.833 . . . . 96.74 115.949 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.9 p -76.21 -49.37 17.33 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 113.793 -1.549 . . . . 96.16 112.244 -177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.605 3.065 0 N-CA-C 103.433 -2.803 . . . . 88.25 103.433 -171.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . 0.481 ' O ' ' CE1' ' A' ' 71' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_