data_4hvr_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 4hvr _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.0 tpp . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 121.377 0.608 . . . . 137.77 112.493 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 14.0 mt -79.75 76.27 6.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 123.962 0.905 . . . . 113.31 108.914 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -45.59 -46.33 14.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.687 1.365 . . . . 82.96 114.687 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -95.38 21.4 8.12 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.726 0.774 . . . . 79.82 111.982 -177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.48 -164.76 54.7 Favored Glycine 0 N--CA 1.432 -1.574 0 CA-C-N 114.94 -1.027 . . . . 75.34 111.393 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.58 172.45 3.87 Favored Pre-proline 0 N--CA 1.451 -0.412 0 C-N-CA 126.168 1.787 . . . . 78.72 107.77 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -58.95 152.12 60.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 122.702 0.843 . . . . 81.93 112.686 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -144.27 160.64 40.65 Favored 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 123.994 0.809 . . . . 73.11 109.866 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -65.34 134.0 52.6 Favored 'General case' 0 CA--C 1.507 -0.676 0 O-C-N 124.063 0.852 . . . . 79.59 111.67 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -90.79 -53.04 0.3 Allowed Pre-proline 0 N--CA 1.442 -0.851 0 CA-C-N 114.495 -1.23 . . . . 92.7 112.576 -174.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -40.55 -56.8 1.45 Allowed 'Trans proline' 0 C--N 1.357 0.988 0 O-C-N 122.863 0.928 . . . . 85.88 114.469 173.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.3 mtm-85 -80.48 -2.64 46.81 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.777 1.029 . . . . 138.22 113.777 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 52.4 t90 -82.32 -42.55 18.62 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.661 0.743 . . . . 72.08 109.357 169.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mt -56.77 -49.09 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.124 -0.944 . . . . 72.54 110.609 173.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -59.36 -43.1 92.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 122.993 0.517 . . . . 89.27 112.226 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.36 -41.99 66.39 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 123.798 0.686 . . . . 131.07 112.731 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -97.19 1.85 50.29 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.341 1.237 . . . . 97.38 114.341 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.64 -32.17 2.25 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.365 0.876 . . . . 101.34 113.365 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -65.79 -26.08 67.54 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 114.525 1.306 . . . . 108.95 114.525 176.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.4 mt -94.3 -14.27 25.6 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.295 1.221 . . . . 113.27 114.295 172.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.5 mt -99.28 31.95 2.91 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-O 121.775 0.798 . . . . 159.03 110.55 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -145.29 126.38 7.55 Favored Pre-proline 0 C--O 1.242 0.681 0 N-CA-C 105.126 -2.175 . . . . 147.63 105.126 169.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -37.26 147.87 0.07 OUTLIER 'Trans proline' 0 CA--C 1.554 1.489 0 C-N-CA 122.432 2.088 . . . . 150.3 114.959 177.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -65.73 -30.66 3.59 Favored 'Cis proline' 0 N--CA 1.491 1.35 0 N-CA-C 117.145 1.94 . . . . 159.22 117.145 15.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.63 -69.97 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 O-C-N 123.994 0.809 . . . . 128.65 112.042 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.65 -30.66 7.16 Favored Glycine 0 N--CA 1.477 1.431 0 N-CA-C 118.198 2.039 . . . . 115.71 118.198 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -145.07 -171.27 3.61 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.52 1.674 . . . . 107.69 115.52 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 tpt85 -171.82 114.59 0.35 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.697 -0.668 . . . . 128.59 111.353 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -65.97 142.45 57.85 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 109.161 -0.681 . . . . 102.52 109.161 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -88.39 -54.53 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 120.001 -0.679 . . . . 69.7 109.914 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -110.13 154.73 22.89 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 109.452 -0.573 . . . . 71.68 109.452 174.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -101.13 153.33 19.67 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.794 -0.639 . . . . 107.03 110.619 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 59.3 34.24 22.85 Favored 'General case' 0 CA--C 1.561 1.368 0 N-CA-C 112.491 0.552 . . . . 111.54 112.491 167.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.4 p -116.95 145.25 43.75 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.38 1.252 . . . . 81.03 114.38 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -54.24 -41.16 68.43 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 121.321 0.581 . . . . 71.42 111.489 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -88.31 117.84 27.51 Favored 'General case' 0 CA--C 1.484 -1.585 0 N-CA-C 105.995 -1.854 . . . . 83.58 105.995 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . 0.447 ' N ' ' O ' ' A' ' 110' ' ' GLU . 3.7 mm -84.16 110.59 18.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 O-C-N 125.18 1.55 . . . . 62.41 108.306 170.206 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.2 t -119.21 116.83 52.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 CA-C-N 115.024 -0.989 . . . . 70.45 111.332 -175.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.94 147.03 47.9 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 123.675 0.79 . . . . 77.81 110.447 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.9 t -100.36 135.8 34.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.096 0.95 . . . . 73.3 109.092 164.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.2 t -119.9 124.94 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.325 0 N-CA-C 106.739 -1.578 . . . . 78.65 106.739 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.96 153.27 16.98 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.375 -0.83 . . . . 86.85 114.576 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.02 174.8 47.93 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 114.784 -0.708 . . . . 76.82 111.844 173.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -84.5 140.77 33.7 Favored 'Cis proline' 0 CA--C 1.511 -0.659 0 C-N-CA 122.692 -1.795 . . . . 73.62 109.965 -1.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -159.96 113.04 2.15 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 124.0 0.813 . . . . 120.47 109.587 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -102.05 151.67 21.87 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 108.045 -1.094 . . . . 76.87 108.045 167.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -146.06 163.54 34.95 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.346 0.593 . . . . 107.88 112.402 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.0 p -107.34 -11.49 15.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.773 1.027 . . . . 81.35 113.773 -165.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -97.38 171.51 8.35 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.92 1.081 . . . . 74.11 113.92 -169.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -123.89 124.79 43.42 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 108.952 -0.758 . . . . 82.36 108.952 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 20.0 t-160 -82.89 137.85 34.1 Favored 'General case' 0 CA--C 1.479 -1.759 0 N-CA-C 108.156 -1.053 . . . . 64.8 108.156 175.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -118.0 105.62 12.07 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 104.59 -2.374 . . . . 79.71 104.59 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 92' ' ' HIS . 6.0 t0 -96.0 134.03 24.42 Favored Pre-proline 0 C--O 1.218 -0.563 0 N-CA-C 109.006 -0.739 . . . . 76.49 109.006 -177.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.2 -6.32 16.44 Favored 'Trans proline' 0 CA--C 1.561 1.845 0 N-CA-C 114.273 0.836 . . . . 63.47 114.273 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.6 mt -128.98 -169.26 2.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.271 1.428 . . . . 68.64 108.59 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -92.8 154.05 18.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.53 -0.759 . . . . 74.01 110.733 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -123.48 136.31 54.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 124.828 1.33 . . . . 77.91 107.612 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -113.74 132.65 55.75 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.701 -1.222 . . . . 62.49 107.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.09 149.06 42.8 Favored 'General case' 0 CA--C 1.474 -1.967 0 O-C-N 123.308 0.38 . . . . 59.04 110.53 179.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -152.32 107.55 3.27 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.74 0.65 . . . . 75.98 109.386 172.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -77.84 95.57 4.75 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.732 0.777 . . . . 62.05 111.764 -173.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.1 mt -70.77 -40.4 72.65 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.75 -1.114 . . . . 68.71 110.719 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -140.19 143.11 35.92 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.558 1.161 . . . . 111.85 113.25 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.34 -173.99 10.53 Favored Glycine 0 N--CA 1.445 -0.725 0 O-C-N 124.356 1.035 . . . . 65.92 113.377 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -117.88 154.29 32.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.411 0.624 . . . . 82.15 111.463 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -151.88 -173.47 4.54 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 106.815 -1.55 . . . . 75.95 106.815 -178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -164.53 159.88 19.74 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 114.292 1.219 . . . . 78.64 114.292 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mt -121.39 116.38 24.68 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.791 0.805 . . . . 74.12 110.892 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.23 135.45 41.01 Favored 'General case' 0 N--CA 1.428 -1.556 0 C-N-CA 117.707 -1.597 . . . . 68.24 107.405 169.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.1 mt -126.92 176.7 7.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.1 1.148 . . . . 67.6 114.1 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -127.17 122.45 34.16 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 105.339 -2.096 . . . . 109.67 105.339 171.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 84.2 t -141.32 118.48 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 124.254 0.971 . . . . 135.84 113.415 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 t70 58.39 6.11 0.52 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 111.717 0.265 . . . . 164.97 111.717 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.17 -30.96 5.28 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 115.026 0.77 . . . . 149.06 115.026 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . . . -80.45 162.92 24.18 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.686 0.794 . . . . 141.87 112.335 176.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.57 112.87 24.5 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.089 -0.382 . . . . 131.05 110.228 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -103.56 174.87 5.68 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.949 1.092 . . . . 133.28 113.949 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.4 ttp-105 -139.08 128.73 24.61 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.696 1.369 . . . . 136.08 114.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.98 127.23 46.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.485 -0.78 . . . . 83.65 110.595 172.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.79 126.42 41.04 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 120.672 -0.411 . . . . 109.7 111.076 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.9 mt -105.63 70.75 0.88 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.699 0.761 . . . . 63.49 110.637 170.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -64.0 160.54 17.69 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 104.494 -2.409 . . . . 99.6 104.494 174.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.54 140.23 57.43 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 118.12 0.418 . . . . 91.32 111.822 -174.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.04 -20.85 37.3 Favored Glycine 0 C--O 1.221 -0.694 0 N-CA-C 115.56 0.984 . . . . 59.51 115.56 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -71.55 146.47 48.44 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.77 0.785 . . . . 78.7 112.735 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 6.0 pt -121.42 166.54 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.735 -0.468 . . . . 69.73 109.735 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -169.93 141.29 2.18 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.203 -1.036 . . . . 67.21 108.203 -172.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 49.5 tp -120.46 115.26 23.12 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 122.254 1.026 . . . . 63.86 108.526 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 tp -87.98 128.64 53.18 Favored Pre-proline 0 N--CA 1.438 -1.03 0 N-CA-C 106.907 -1.516 . . . . 65.82 106.907 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -73.24 165.43 32.66 Favored 'Trans proline' 0 C--O 1.243 0.743 0 O-C-N 123.225 1.118 . . . . 64.47 110.84 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -69.34 159.92 51.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 115.369 -2.621 . . . . 69.87 114.7 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' A' ' 53' ' ' ASP . 40.1 m80 65.71 -1.95 0.96 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.04 1.336 . . . . 79.89 113.361 173.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -76.54 142.25 14.6 Favored 'Isoleucine or valine' 0 C--O 1.261 1.71 0 N-CA-C 109.085 -0.709 . . . . 75.82 109.085 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -98.16 121.44 40.09 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 115.279 -0.873 . . . . 69.44 111.836 -168.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 24.3 p-80 -135.52 139.7 44.17 Favored 'General case' 0 C--O 1.257 1.454 0 CA-C-N 115.345 -0.843 . . . . 58.68 112.642 -168.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.0 t -130.61 103.74 16.1 Favored Pre-proline 0 CA--C 1.499 -0.989 0 N-CA-C 106.811 -1.551 . . . . 62.49 106.811 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -85.76 121.1 2.1 Favored 'Trans proline' 0 CA--C 1.499 -1.238 0 C-N-CA 123.559 2.839 . . . . 64.87 111.108 -171.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -108.85 118.84 37.85 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 124.959 1.412 . . . . 63.06 110.06 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -114.89 84.08 10.13 Favored Pre-proline 0 CA--C 1.505 -0.76 0 N-CA-C 106.538 -1.653 . . . . 76.44 106.538 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.65 -42.04 64.38 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 O-C-N 123.667 1.351 . . . . 63.98 113.416 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -77.62 135.6 38.15 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 115.119 1.526 . . . . 107.83 115.119 -162.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.76 119.94 19.63 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-N 114.464 -1.244 . . . . 66.74 110.484 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 77.71 24.66 64.38 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.18 0.832 . . . . 72.84 115.18 -177.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 84.2 p -74.4 155.47 38.07 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.394 -1.706 . . . . 73.43 106.394 165.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.39 134.95 36.51 Favored 'General case' 0 CA--C 1.492 -1.273 0 N-CA-C 105.433 -2.062 . . . . 67.59 105.433 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 53.7 t -136.89 126.04 24.59 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.664 -1.153 . . . . 64.23 108.718 176.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.8 tp -79.08 124.84 28.68 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.867 -0.606 . . . . 68.32 111.602 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.4 t -124.08 120.37 59.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-N 116.413 -0.358 . . . . 57.12 110.765 -179.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 62.9 mt -112.65 148.43 15.68 Favored 'Isoleucine or valine' 0 C--O 1.249 1.046 0 N-CA-C 113.697 0.999 . . . . 53.55 113.697 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 37' ' ' ILE . 2.6 pt-20 -165.98 164.51 18.33 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 124.738 1.274 . . . . 89.32 110.161 -176.838 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -101.93 134.26 45.41 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 112.739 0.644 . . . . 68.09 112.739 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -41.39 123.06 2.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.329 -1.36 . . . . 124.89 107.329 165.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -73.26 131.72 82.81 Favored Pre-proline 0 N--CA 1.488 1.445 0 CA-C-O 121.051 0.453 . . . . 82.77 110.746 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.3 147.37 14.38 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.369 1.38 . . . . 85.31 111.791 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -39.26 136.46 0.87 Allowed 'General case' 0 CA--C 1.556 1.182 0 O-C-N 123.842 0.714 . . . . 79.65 111.964 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.39 -23.36 36.15 Favored Glycine 0 N--CA 1.485 1.951 0 CA-C-O 121.584 0.547 . . . . 81.87 113.544 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' MET . . . . . . . . . . . . . 8.7 ttm -104.21 113.63 27.32 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-O 121.58 0.705 . . . . 88.13 112.307 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.5 mt -111.94 147.76 35.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.22 -0.9 . . . . 69.52 112.894 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.58 150.93 19.8 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.409 -1.7 . . . . 71.54 106.409 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -108.67 151.44 17.07 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 109.746 -1.342 . . . . 64.85 109.746 173.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -125.94 141.86 51.78 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.466 0.65 . . . . 75.99 109.882 165.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . 0.557 ' OE2' ' NH1' ' A' ' 134' ' ' ARG . 88.2 mt-10 -147.72 133.61 19.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.474 -0.784 . . . . 74.31 110.918 -163.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -118.59 146.68 44.42 Favored 'General case' 0 CA--C 1.468 -2.191 0 O-C-N 125.06 1.475 . . . . 65.91 110.299 172.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -122.23 146.11 47.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 125.005 1.44 . . . . 91.83 112.654 -170.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' CYS . . . . . 0.529 ' SG ' ' O ' ' A' ' 304' ' ' HOH . 49.5 t -64.88 104.88 0.91 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-O 122.745 1.26 . . . . 95.11 113.319 175.875 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . 0.482 ' OD2' ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -29.01 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 112.261 -2.245 . . . . 131.03 115.733 162.535 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -114.61 -67.63 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.327 1.051 . . . . 103.13 111.79 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.16 -10.42 59.63 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 118.585 -1.246 . . . . 104.72 112.391 -178.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.1 10.0 50.1 Favored Glycine 0 N--CA 1.476 1.351 0 N-CA-C 118.062 1.985 . . . . 98.46 118.062 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -76.94 160.42 29.19 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.411 -2.07 . . . . 128.69 105.411 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.2 tp -69.27 114.15 7.26 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 109.406 -0.59 . . . . 84.64 109.406 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 40.8 t -64.85 -58.66 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 115.538 -0.755 . . . . 78.06 111.618 170.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -152.22 141.18 21.15 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 114.284 1.216 . . . . 80.67 114.284 -166.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ARG . . . . . 0.557 ' NH1' ' OE2' ' A' ' 122' ' ' GLU . 52.7 ttt85 -139.73 130.12 25.46 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.609 0.764 . . . . 72.89 112.733 -179.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 t -123.05 133.57 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 C-N-CA 123.394 0.678 . . . . 73.24 109.577 171.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -104.12 145.39 30.25 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.011 -1.107 . . . . 97.86 108.011 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 1.6 p -153.45 127.49 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.287 -0.87 . . . . 70.76 111.325 -166.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -75.71 101.52 5.05 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.428 -1.693 . . . . 92.25 106.428 171.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.5 tp -79.74 109.9 14.58 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.144 -0.935 . . . . 97.71 111.653 -174.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 23.9 ttpt -104.84 -48.2 3.82 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.762 0.791 . . . . 100.35 112.467 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.5 t -135.44 111.83 9.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.483 -0.78 . . . . 120.75 109.531 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 45.5 mt -42.5 -50.65 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.39 0.676 . . . . 135.65 111.626 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 1.9 t -54.52 -63.87 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 113.768 1.025 . . . . 117.6 113.768 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 82.5 p -74.08 -42.66 59.82 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.269 0.47 . . . . 108.9 112.269 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -72.17 -23.54 61.29 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 115.686 1.736 . . . . 108.2 115.686 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 8.8 tp -107.05 -46.41 0.12 Allowed Pre-proline 0 CA--C 1.553 1.09 0 N-CA-C 120.576 3.547 . . . . 114.52 120.576 -164.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -49.27 -57.95 2.04 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 117.585 -1.143 . . . . 105.08 114.089 174.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -45.92 -39.57 19.49 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 122.226 1.951 . . . . 104.77 114.867 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.55 -42.92 83.91 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.649 0.593 . . . . 108.71 110.955 175.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -69.75 -44.05 71.01 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.924 0.49 . . . . 108.81 111.861 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -52.49 -52.4 54.6 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 119.207 -0.425 . . . . 152.94 111.573 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.8 p -56.08 -36.96 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.794 0.27 . . . . 95.74 111.401 -173.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -75.1 -48.23 24.84 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 119.015 -0.517 . . . . 80.75 110.799 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -65.27 -32.09 73.57 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.291 0.849 . . . . 103.74 113.291 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -95.49 20.18 9.89 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.689 1.737 . . . . 111.52 115.689 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.0 t -142.78 100.59 3.7 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.856 1.428 . . . . 99.03 114.856 -174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -54.79 -23.1 16.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.693 -1.14 . . . . 162.67 110.151 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.46 -44.68 62.0 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.361 -1.29 . . . . 136.94 113.25 -172.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -74.46 -37.66 63.17 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.547 -0.538 . . . . 89.8 109.547 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -69.8 1.92 3.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 114.045 1.128 . . . . 103.98 114.045 -179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 10.1 ttm105 -85.27 121.67 28.35 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.668 -0.864 . . . . 111.3 108.668 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' CYS . . . . . 0.898 ' CB ' ' O ' ' A' ' 304' ' ' HOH . 29.8 t -67.17 129.84 93.8 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 115.325 1.602 . . . . 87.19 115.325 177.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -83.37 25.5 0.68 Allowed 'Trans proline' 0 C--O 1.246 0.91 0 C-N-CA 120.601 0.867 . . . . 106.43 110.396 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -132.31 -76.19 0.5 Allowed 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 115.383 -0.826 . . . . 134.01 110.937 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' CYS . . . . . 0.406 ' O ' ' N ' ' A' ' 167' ' ' GLN . 1.4 p -92.28 17.35 9.86 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.637 -0.825 . . . . 120.0 113.107 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 47.35 10.11 0.06 OUTLIER Glycine 0 N--CA 1.48 1.582 0 N-CA-C 116.296 1.278 . . . . 108.57 116.296 173.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 165' ' ' CYS . 0.0 OUTLIER -72.05 138.14 47.66 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.717 0.807 . . . . 113.97 110.308 175.2 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.6 t -93.91 109.62 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 112.748 0.647 . . . . 97.35 112.748 -172.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -58.36 132.86 84.94 Favored Pre-proline 0 N--CA 1.443 -0.776 0 CA-C-N 114.709 -1.132 . . . . 83.4 108.662 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -57.04 -36.75 99.4 Favored 'Trans proline' 0 C--N 1.348 0.516 1 C-N-CA 130.495 7.463 . . . . 89.89 117.261 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 74.75 -58.46 2.58 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 114.551 0.581 . . . . 131.85 114.551 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -58.36 -76.5 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.717 1.006 . . . . 165.56 113.717 -179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -152.82 -154.43 0.53 Allowed 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 116.379 -0.373 . . . . 185.28 111.6 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.644 0.777 . . . . 204.62 112.853 -179.508 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.898 ' O ' ' CB ' ' A' ' 162' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.0 tpp . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 121.377 0.608 . . . . 137.77 112.493 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 14.0 mt -79.75 76.27 6.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 123.962 0.905 . . . . 113.31 108.914 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -45.59 -46.33 14.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.687 1.365 . . . . 82.96 114.687 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TYR . . . . . 0.567 ' HB3' ' CD1' ' A' ' 31' ' ' TRP . 21.3 m-85 -95.38 21.4 8.12 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.726 0.774 . . . . 79.82 111.982 -177.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.48 -164.76 54.7 Favored Glycine 0 N--CA 1.432 -1.574 0 CA-C-N 114.94 -1.027 . . . . 75.34 111.393 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.58 172.45 3.87 Favored Pre-proline 0 N--CA 1.451 -0.412 0 C-N-CA 126.168 1.787 . . . . 78.72 107.77 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -58.95 152.12 60.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 122.702 0.843 . . . . 81.93 112.686 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -144.27 160.64 40.65 Favored 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 123.994 0.809 . . . . 73.11 109.866 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -65.34 134.0 52.6 Favored 'General case' 0 CA--C 1.507 -0.676 0 O-C-N 124.063 0.852 . . . . 79.59 111.67 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HB3' ' HD3' ' A' ' 11' ' ' PRO . 2.4 t80 -90.79 -53.04 0.3 Allowed Pre-proline 0 N--CA 1.442 -0.851 0 CA-C-N 114.495 -1.23 . . . . 92.7 112.576 -174.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD3' ' HB3' ' A' ' 10' ' ' PHE . 9.0 Cg_exo -40.55 -56.8 1.45 Allowed 'Trans proline' 0 C--N 1.357 0.988 0 O-C-N 122.863 0.928 . . . . 85.88 114.469 173.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.3 mtm-85 -80.48 -2.64 46.81 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.777 1.029 . . . . 138.22 113.777 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 52.4 t90 -82.32 -42.55 18.62 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.661 0.743 . . . . 72.08 109.357 169.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mt -56.77 -49.09 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.124 -0.944 . . . . 72.54 110.609 173.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -59.36 -43.1 92.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 122.993 0.517 . . . . 89.27 112.226 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.36 -41.99 66.39 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 123.798 0.686 . . . . 131.07 112.731 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -97.19 1.85 50.29 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.341 1.237 . . . . 97.38 114.341 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.64 -32.17 2.25 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.365 0.876 . . . . 101.34 113.365 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HIS . . . . . 0.572 ' CE1' ' HG ' ' A' ' 20' ' ' LEU . 34.1 p80 -65.79 -26.08 67.54 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 114.525 1.306 . . . . 108.95 114.525 176.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 19' ' ' HIS . 25.4 mt -94.3 -14.27 25.6 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.295 1.221 . . . . 113.27 114.295 172.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.5 mt -99.28 31.95 2.91 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-O 121.775 0.798 . . . . 159.03 110.55 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -145.29 126.38 7.55 Favored Pre-proline 0 C--O 1.242 0.681 0 N-CA-C 105.126 -2.175 . . . . 147.63 105.126 169.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . 0.478 ' HG2' ' O ' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -37.26 147.87 0.07 OUTLIER 'Trans proline' 0 CA--C 1.554 1.489 0 C-N-CA 122.432 2.088 . . . . 150.3 114.959 177.001 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -65.73 -30.66 3.59 Favored 'Cis proline' 0 N--CA 1.491 1.35 0 N-CA-C 117.145 1.94 . . . . 159.22 117.145 15.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.63 -69.97 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 O-C-N 123.994 0.809 . . . . 128.65 112.042 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.65 -30.66 7.16 Favored Glycine 0 N--CA 1.477 1.431 0 N-CA-C 118.198 2.039 . . . . 115.71 118.198 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -145.07 -171.27 3.61 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.52 1.674 . . . . 107.69 115.52 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 tpt85 -171.82 114.59 0.35 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.697 -0.668 . . . . 128.59 111.353 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -65.97 142.45 57.85 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 109.161 -0.681 . . . . 102.52 109.161 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -88.39 -54.53 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 120.001 -0.679 . . . . 69.7 109.914 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . 0.567 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 22.6 m-90 -110.13 154.73 22.89 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 109.452 -0.573 . . . . 71.68 109.452 174.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -101.13 153.33 19.67 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.794 -0.639 . . . . 107.03 110.619 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 59.3 34.24 22.85 Favored 'General case' 0 CA--C 1.561 1.368 0 N-CA-C 112.491 0.552 . . . . 111.54 112.491 167.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.4 p -116.95 145.25 43.75 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.38 1.252 . . . . 81.03 114.38 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -54.24 -41.16 68.43 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 121.321 0.581 . . . . 71.42 111.489 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -88.31 117.84 27.51 Favored 'General case' 0 CA--C 1.484 -1.585 0 N-CA-C 105.995 -1.854 . . . . 83.58 105.995 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . 0.436 ' N ' HD13 ' A' ' 37' ' ' ILE . 3.7 mm -84.16 110.59 18.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 O-C-N 125.18 1.55 . . . . 62.41 108.306 170.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.2 t -119.21 116.83 52.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 CA-C-N 115.024 -0.989 . . . . 70.45 111.332 -175.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.94 147.03 47.9 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 123.675 0.79 . . . . 77.81 110.447 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.9 t -100.36 135.8 34.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.096 0.95 . . . . 73.3 109.092 164.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.2 t -119.9 124.94 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.325 0 N-CA-C 106.739 -1.578 . . . . 78.65 106.739 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.96 153.27 16.98 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.375 -0.83 . . . . 86.85 114.576 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.02 174.8 47.93 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 114.784 -0.708 . . . . 76.82 111.844 173.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . 0.478 ' O ' ' HG2' ' A' ' 23' ' ' PRO . 16.9 Cg_exo -84.5 140.77 33.7 Favored 'Cis proline' 0 CA--C 1.511 -0.659 0 C-N-CA 122.692 -1.795 . . . . 73.62 109.965 -1.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -159.96 113.04 2.15 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 124.0 0.813 . . . . 120.47 109.587 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -102.05 151.67 21.87 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 108.045 -1.094 . . . . 76.87 108.045 167.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -146.06 163.54 34.95 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.346 0.593 . . . . 107.88 112.402 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . 0.416 ' HG1' ' HD1' ' A' ' 123' ' ' TRP . 2.0 p -107.34 -11.49 15.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.773 1.027 . . . . 81.35 113.773 -165.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -97.38 171.51 8.35 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.92 1.081 . . . . 74.11 113.92 -169.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -123.89 124.79 43.42 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 108.952 -0.758 . . . . 82.36 108.952 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HIS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 20.0 t-160 -82.89 137.85 34.1 Favored 'General case' 0 CA--C 1.479 -1.759 0 N-CA-C 108.156 -1.053 . . . . 64.8 108.156 175.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.418 ' HB2' ' HD3' ' A' ' 94' ' ' ARG . 1.5 t0 -118.0 105.62 12.07 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 104.59 -2.374 . . . . 79.71 104.59 169.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.55 ' OD1' ' HD2' ' A' ' 54' ' ' PRO . 6.0 t0 -96.0 134.03 24.42 Favored Pre-proline 0 C--O 1.218 -0.563 0 N-CA-C 109.006 -0.739 . . . . 76.49 109.006 -177.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . 0.55 ' HD2' ' OD1' ' A' ' 53' ' ' ASP . 72.6 Cg_endo -77.2 -6.32 16.44 Favored 'Trans proline' 0 CA--C 1.561 1.845 0 N-CA-C 114.273 0.836 . . . . 63.47 114.273 178.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.6 mt -128.98 -169.26 2.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.271 1.428 . . . . 68.64 108.59 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -92.8 154.05 18.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.53 -0.759 . . . . 74.01 110.733 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -123.48 136.31 54.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 124.828 1.33 . . . . 77.91 107.612 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -113.74 132.65 55.75 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.701 -1.222 . . . . 62.49 107.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.09 149.06 42.8 Favored 'General case' 0 CA--C 1.474 -1.967 0 O-C-N 123.308 0.38 . . . . 59.04 110.53 179.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HB2' HG22 ' A' ' 86' ' ' ILE . 6.3 t80 -152.32 107.55 3.27 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.74 0.65 . . . . 75.98 109.386 172.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -77.84 95.57 4.75 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.732 0.777 . . . . 62.05 111.764 -173.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.1 mt -70.77 -40.4 72.65 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.75 -1.114 . . . . 68.71 110.719 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -140.19 143.11 35.92 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.558 1.161 . . . . 111.85 113.25 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.34 -173.99 10.53 Favored Glycine 0 N--CA 1.445 -0.725 0 O-C-N 124.356 1.035 . . . . 65.92 113.377 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -117.88 154.29 32.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.411 0.624 . . . . 82.15 111.463 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -151.88 -173.47 4.54 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 106.815 -1.55 . . . . 75.95 106.815 -178.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -164.53 159.88 19.74 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 114.292 1.219 . . . . 78.64 114.292 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mt -121.39 116.38 24.68 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.791 0.805 . . . . 74.12 110.892 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.23 135.45 41.01 Favored 'General case' 0 N--CA 1.428 -1.556 0 C-N-CA 117.707 -1.597 . . . . 68.24 107.405 169.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.1 mt -126.92 176.7 7.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.1 1.148 . . . . 67.6 114.1 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -127.17 122.45 34.16 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 105.339 -2.096 . . . . 109.67 105.339 171.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 84.2 t -141.32 118.48 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 124.254 0.971 . . . . 135.84 113.415 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 t70 58.39 6.11 0.52 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 111.717 0.265 . . . . 164.97 111.717 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.17 -30.96 5.28 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 115.026 0.77 . . . . 149.06 115.026 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . . . -80.45 162.92 24.18 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.686 0.794 . . . . 141.87 112.335 176.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.57 112.87 24.5 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.089 -0.382 . . . . 131.05 110.228 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -103.56 174.87 5.68 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.949 1.092 . . . . 133.28 113.949 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.4 ttp-105 -139.08 128.73 24.61 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.696 1.369 . . . . 136.08 114.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.98 127.23 46.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.485 -0.78 . . . . 83.65 110.595 172.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.79 126.42 41.04 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 120.672 -0.411 . . . . 109.7 111.076 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.9 mt -105.63 70.75 0.88 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.699 0.761 . . . . 63.49 110.637 170.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 4.0 mtmm -64.0 160.54 17.69 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 104.494 -2.409 . . . . 99.6 104.494 174.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.54 140.23 57.43 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 118.12 0.418 . . . . 91.32 111.822 -174.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.04 -20.85 37.3 Favored Glycine 0 C--O 1.221 -0.694 0 N-CA-C 115.56 0.984 . . . . 59.51 115.56 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -71.55 146.47 48.44 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.77 0.785 . . . . 78.7 112.735 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . 0.553 HG22 ' HB2' ' A' ' 60' ' ' TYR . 6.0 pt -121.42 166.54 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.735 -0.468 . . . . 69.73 109.735 166.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -169.93 141.29 2.18 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.203 -1.036 . . . . 67.21 108.203 -172.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 49.5 tp -120.46 115.26 23.12 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 122.254 1.026 . . . . 63.86 108.526 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 tp -87.98 128.64 53.18 Favored Pre-proline 0 N--CA 1.438 -1.03 0 N-CA-C 106.907 -1.516 . . . . 65.82 106.907 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -73.24 165.43 32.66 Favored 'Trans proline' 0 C--O 1.243 0.743 0 O-C-N 123.225 1.118 . . . . 64.47 110.84 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -69.34 159.92 51.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 115.369 -2.621 . . . . 69.87 114.7 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 40.1 m80 65.71 -1.95 0.96 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.04 1.336 . . . . 79.89 113.361 173.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -76.54 142.25 14.6 Favored 'Isoleucine or valine' 0 C--O 1.261 1.71 0 N-CA-C 109.085 -0.709 . . . . 75.82 109.085 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' HB2' ' A' ' 52' ' ' ASP . 34.7 mmt-85 -98.16 121.44 40.09 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 115.279 -0.873 . . . . 69.44 111.836 -168.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HIS . . . . . 0.456 ' CE1' ' HB3' ' A' ' 51' ' ' HIS . 24.3 p-80 -135.52 139.7 44.17 Favored 'General case' 0 C--O 1.257 1.454 0 CA-C-N 115.345 -0.843 . . . . 58.68 112.642 -168.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.0 t -130.61 103.74 16.1 Favored Pre-proline 0 CA--C 1.499 -0.989 0 N-CA-C 106.811 -1.551 . . . . 62.49 106.811 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . 1.106 ' HG3' ' H3 ' ' A' ' 203' ' ' SAL . 44.5 Cg_endo -85.76 121.1 2.1 Favored 'Trans proline' 0 CA--C 1.499 -1.238 0 C-N-CA 123.559 2.839 . . . . 64.87 111.108 -171.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -108.85 118.84 37.85 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 124.959 1.412 . . . . 63.06 110.06 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -114.89 84.08 10.13 Favored Pre-proline 0 CA--C 1.505 -0.76 0 N-CA-C 106.538 -1.653 . . . . 76.44 106.538 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.65 -42.04 64.38 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 O-C-N 123.667 1.351 . . . . 63.98 113.416 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -77.62 135.6 38.15 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 115.119 1.526 . . . . 107.83 115.119 -162.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.76 119.94 19.63 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-N 114.464 -1.244 . . . . 66.74 110.484 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 77.71 24.66 64.38 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.18 0.832 . . . . 72.84 115.18 -177.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 84.2 p -74.4 155.47 38.07 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.394 -1.706 . . . . 73.43 106.394 165.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.39 134.95 36.51 Favored 'General case' 0 CA--C 1.492 -1.273 0 N-CA-C 105.433 -2.062 . . . . 67.59 105.433 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 53.7 t -136.89 126.04 24.59 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.664 -1.153 . . . . 64.23 108.718 176.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.8 tp -79.08 124.84 28.68 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.867 -0.606 . . . . 68.32 111.602 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.4 t -124.08 120.37 59.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-N 116.413 -0.358 . . . . 57.12 110.765 -179.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 62.9 mt -112.65 148.43 15.68 Favored 'Isoleucine or valine' 0 C--O 1.249 1.046 0 N-CA-C 113.697 0.999 . . . . 53.55 113.697 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -165.98 164.51 18.33 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 124.738 1.274 . . . . 89.32 110.161 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -101.93 134.26 45.41 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 112.739 0.644 . . . . 68.09 112.739 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -41.39 123.06 2.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.329 -1.36 . . . . 124.89 107.329 165.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -73.26 131.72 82.81 Favored Pre-proline 0 N--CA 1.488 1.445 0 CA-C-O 121.051 0.453 . . . . 82.77 110.746 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.3 147.37 14.38 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.369 1.38 . . . . 85.31 111.791 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -39.26 136.46 0.87 Allowed 'General case' 0 CA--C 1.556 1.182 0 O-C-N 123.842 0.714 . . . . 79.65 111.964 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.39 -23.36 36.15 Favored Glycine 0 N--CA 1.485 1.951 0 CA-C-O 121.584 0.547 . . . . 81.87 113.544 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' MET . . . . . . . . . . . . . 8.7 ttm -104.21 113.63 27.32 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-O 121.58 0.705 . . . . 88.13 112.307 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.5 mt -111.94 147.76 35.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.22 -0.9 . . . . 69.52 112.894 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.58 150.93 19.8 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.409 -1.7 . . . . 71.54 106.409 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -108.67 151.44 17.07 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 109.746 -1.342 . . . . 64.85 109.746 173.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -125.94 141.86 51.78 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.466 0.65 . . . . 75.99 109.882 165.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . 0.526 ' OE2' ' NH1' ' A' ' 134' ' ' ARG . 88.2 mt-10 -147.72 133.61 19.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.474 -0.784 . . . . 74.31 110.918 -163.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.416 ' HD1' ' HG1' ' A' ' 48' ' ' THR . 8.7 m-90 -118.59 146.68 44.42 Favored 'General case' 0 CA--C 1.468 -2.191 0 O-C-N 125.06 1.475 . . . . 65.91 110.299 172.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -122.23 146.11 47.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 125.005 1.44 . . . . 91.83 112.654 -170.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' CYS . . . . . 0.529 ' SG ' ' O ' ' A' ' 304' ' ' HOH . 49.5 t -64.88 104.88 0.91 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-O 122.745 1.26 . . . . 95.11 113.319 175.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . 0.482 ' OD2' ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -29.01 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 112.261 -2.245 . . . . 131.03 115.733 162.535 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -114.61 -67.63 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.327 1.051 . . . . 103.13 111.79 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' CYS . . . . . 0.609 ' HB3' ' SG ' ' A' ' 165' ' ' CYS . 0.5 OUTLIER -78.16 -10.42 59.63 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 118.585 -1.246 . . . . 104.72 112.391 -178.196 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.1 10.0 50.1 Favored Glycine 0 N--CA 1.476 1.351 0 N-CA-C 118.062 1.985 . . . . 98.46 118.062 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -76.94 160.42 29.19 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.411 -2.07 . . . . 128.69 105.411 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.2 tp -69.27 114.15 7.26 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 109.406 -0.59 . . . . 84.64 109.406 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 40.8 t -64.85 -58.66 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 115.538 -0.755 . . . . 78.06 111.618 170.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -152.22 141.18 21.15 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 114.284 1.216 . . . . 80.67 114.284 -166.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ARG . . . . . 0.526 ' NH1' ' OE2' ' A' ' 122' ' ' GLU . 52.7 ttt85 -139.73 130.12 25.46 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.609 0.764 . . . . 72.89 112.733 -179.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 t -123.05 133.57 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 C-N-CA 123.394 0.678 . . . . 73.24 109.577 171.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -104.12 145.39 30.25 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.011 -1.107 . . . . 97.86 108.011 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 1.6 p -153.45 127.49 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.287 -0.87 . . . . 70.76 111.325 -166.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -75.71 101.52 5.05 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.428 -1.693 . . . . 92.25 106.428 171.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.5 tp -79.74 109.9 14.58 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.144 -0.935 . . . . 97.71 111.653 -174.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 23.9 ttpt -104.84 -48.2 3.82 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.762 0.791 . . . . 100.35 112.467 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.5 t -135.44 111.83 9.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.483 -0.78 . . . . 120.75 109.531 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 45.5 mt -42.5 -50.65 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.39 0.676 . . . . 135.65 111.626 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' VAL . . . . . 0.486 ' O ' ' HD2' ' A' ' 147' ' ' PRO . 1.9 t -54.52 -63.87 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 113.768 1.025 . . . . 117.6 113.768 -179.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 82.5 p -74.08 -42.66 59.82 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.269 0.47 . . . . 108.9 112.269 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -72.17 -23.54 61.29 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 115.686 1.736 . . . . 108.2 115.686 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 8.8 tp -107.05 -46.41 0.12 Allowed Pre-proline 0 CA--C 1.553 1.09 0 N-CA-C 120.576 3.547 . . . . 114.52 120.576 -164.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PRO . . . . . 0.731 ' HB2' ' HD3' ' A' ' 148' ' ' PRO . 84.2 Cg_exo -49.27 -57.95 2.04 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 117.585 -1.143 . . . . 105.08 114.089 174.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 147' ' ' PRO . 82.8 Cg_exo -45.92 -39.57 19.49 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 122.226 1.951 . . . . 104.77 114.867 -178.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.55 -42.92 83.91 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.649 0.593 . . . . 108.71 110.955 175.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -69.75 -44.05 71.01 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.924 0.49 . . . . 108.81 111.861 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -52.49 -52.4 54.6 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 119.207 -0.425 . . . . 152.94 111.573 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.8 p -56.08 -36.96 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.794 0.27 . . . . 95.74 111.401 -173.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -75.1 -48.23 24.84 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 119.015 -0.517 . . . . 80.75 110.799 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -65.27 -32.09 73.57 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.291 0.849 . . . . 103.74 113.291 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -95.49 20.18 9.89 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.689 1.737 . . . . 111.52 115.689 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.0 t -142.78 100.59 3.7 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.856 1.428 . . . . 99.03 114.856 -174.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -54.79 -23.1 16.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.693 -1.14 . . . . 162.67 110.151 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.46 -44.68 62.0 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.361 -1.29 . . . . 136.94 113.25 -172.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -74.46 -37.66 63.17 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.547 -0.538 . . . . 89.8 109.547 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -69.8 1.92 3.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 114.045 1.128 . . . . 103.98 114.045 -179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 10.1 ttm105 -85.27 121.67 28.35 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.668 -0.864 . . . . 111.3 108.668 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' CYS . . . . . 1.024 ' HB2' ' O ' ' A' ' 304' ' ' HOH . 29.8 t -67.17 129.84 93.8 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 115.325 1.602 . . . . 87.19 115.325 177.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -83.37 25.5 0.68 Allowed 'Trans proline' 0 C--O 1.246 0.91 0 C-N-CA 120.601 0.867 . . . . 106.43 110.396 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HIS . . . . . 0.588 ' HB3' ' SG ' ' A' ' 128' ' ' CYS . 21.0 t-80 -132.31 -76.19 0.5 Allowed 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 115.383 -0.826 . . . . 134.01 110.937 174.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' CYS . . . . . 0.609 ' SG ' ' HB3' ' A' ' 128' ' ' CYS . 1.4 p -92.28 17.35 9.86 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.637 -0.825 . . . . 120.0 113.107 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 47.35 10.11 0.06 OUTLIER Glycine 0 N--CA 1.48 1.582 0 N-CA-C 116.296 1.278 . . . . 108.57 116.296 173.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 165' ' ' CYS . 0.0 OUTLIER -72.05 138.14 47.66 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.717 0.807 . . . . 113.97 110.308 175.2 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.6 t -93.91 109.62 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 112.748 0.647 . . . . 97.35 112.748 -172.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -58.36 132.86 84.94 Favored Pre-proline 0 N--CA 1.443 -0.776 0 CA-C-N 114.709 -1.132 . . . . 83.4 108.662 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -57.04 -36.75 99.4 Favored 'Trans proline' 0 C--N 1.348 0.516 1 C-N-CA 130.495 7.463 . . . . 89.89 117.261 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 74.75 -58.46 2.58 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 114.551 0.581 . . . . 131.85 114.551 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ARG . . . . . 0.499 ' NH1' ' HA ' ' A' ' 172' ' ' ARG . 1.3 tpp180 -58.36 -76.5 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.717 1.006 . . . . 165.56 113.717 -179.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -152.82 -154.43 0.53 Allowed 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 116.379 -0.373 . . . . 185.28 111.6 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.644 0.777 . . . . 204.62 112.853 -179.508 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SAL . . . . . 1.106 ' H3 ' ' HG3' ' A' ' 97' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . 1.024 ' O ' ' HB2' ' A' ' 162' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.0 tpp . . . . . 0 N--CA 1.5 2.027 0 CA-C-O 121.377 0.608 . . . . 137.77 112.493 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 14.0 mt -79.75 76.27 6.42 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 123.962 0.905 . . . . 113.31 108.914 174.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -45.59 -46.33 14.22 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.687 1.365 . . . . 82.96 114.687 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.567 ' HB3' ' CD1' ' A' ' 31' ' ' TRP . 21.3 m-85 -95.38 21.4 8.12 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 121.726 0.774 . . . . 79.82 111.982 -177.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 74.48 -164.76 54.7 Favored Glycine 0 N--CA 1.432 -1.574 0 CA-C-N 114.94 -1.027 . . . . 75.34 111.393 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.58 172.45 3.87 Favored Pre-proline 0 N--CA 1.451 -0.412 0 C-N-CA 126.168 1.787 . . . . 78.72 107.77 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -58.95 152.12 60.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 122.702 0.843 . . . . 81.93 112.686 178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -144.27 160.64 40.65 Favored 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 123.994 0.809 . . . . 73.11 109.866 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -65.34 134.0 52.6 Favored 'General case' 0 CA--C 1.507 -0.676 0 O-C-N 124.063 0.852 . . . . 79.59 111.67 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HB3' ' HD3' ' A' ' 11' ' ' PRO . 2.4 t80 -90.79 -53.04 0.3 Allowed Pre-proline 0 N--CA 1.442 -0.851 0 CA-C-N 114.495 -1.23 . . . . 92.7 112.576 -174.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD3' ' HB3' ' A' ' 10' ' ' PHE . 9.0 Cg_exo -40.55 -56.8 1.45 Allowed 'Trans proline' 0 C--N 1.357 0.988 0 O-C-N 122.863 0.928 . . . . 85.88 114.469 173.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.3 mtm-85 -80.48 -2.64 46.81 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.777 1.029 . . . . 138.22 113.777 -176.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 52.4 t90 -82.32 -42.55 18.62 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-O 121.661 0.743 . . . . 72.08 109.357 169.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mt -56.77 -49.09 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 CA-C-N 115.124 -0.944 . . . . 72.54 110.609 173.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -59.36 -43.1 92.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 122.993 0.517 . . . . 89.27 112.226 -177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.36 -41.99 66.39 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 123.798 0.686 . . . . 131.07 112.731 171.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -97.19 1.85 50.29 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.341 1.237 . . . . 97.38 114.341 -174.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.64 -32.17 2.25 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.365 0.876 . . . . 101.34 113.365 -177.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.572 ' CE1' ' HG ' ' A' ' 20' ' ' LEU . 34.1 p80 -65.79 -26.08 67.54 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 114.525 1.306 . . . . 108.95 114.525 176.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 19' ' ' HIS . 25.4 mt -94.3 -14.27 25.6 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 114.295 1.221 . . . . 113.27 114.295 172.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.5 mt -99.28 31.95 2.91 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-O 121.775 0.798 . . . . 159.03 110.55 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -145.29 126.38 7.55 Favored Pre-proline 0 C--O 1.242 0.681 0 N-CA-C 105.126 -2.175 . . . . 147.63 105.126 169.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.478 ' HG2' ' O ' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -37.26 147.87 0.07 OUTLIER 'Trans proline' 0 CA--C 1.554 1.489 0 C-N-CA 122.432 2.088 . . . . 150.3 114.959 177.001 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -65.73 -30.66 3.59 Favored 'Cis proline' 0 N--CA 1.491 1.35 0 N-CA-C 117.145 1.94 . . . . 159.22 117.145 15.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.6 t -64.63 -69.97 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 O-C-N 123.994 0.809 . . . . 128.65 112.042 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.65 -30.66 7.16 Favored Glycine 0 N--CA 1.477 1.431 0 N-CA-C 118.198 2.039 . . . . 115.71 118.198 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -145.07 -171.27 3.61 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.52 1.674 . . . . 107.69 115.52 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 tpt85 -171.82 114.59 0.35 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.697 -0.668 . . . . 128.59 111.353 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -65.97 142.45 57.85 Favored 'General case' 0 C--O 1.25 1.085 0 N-CA-C 109.161 -0.681 . . . . 102.52 109.161 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.2 t -88.39 -54.53 7.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 120.001 -0.679 . . . . 69.7 109.914 -178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.567 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 22.6 m-90 -110.13 154.73 22.89 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 109.452 -0.573 . . . . 71.68 109.452 174.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -101.13 153.33 19.67 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.794 -0.639 . . . . 107.03 110.619 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 59.3 34.24 22.85 Favored 'General case' 0 CA--C 1.561 1.368 0 N-CA-C 112.491 0.552 . . . . 111.54 112.491 167.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.4 p -116.95 145.25 43.75 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.38 1.252 . . . . 81.03 114.38 -177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -54.24 -41.16 68.43 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 121.321 0.581 . . . . 71.42 111.489 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -88.31 117.84 27.51 Favored 'General case' 0 CA--C 1.484 -1.585 0 N-CA-C 105.995 -1.854 . . . . 83.58 105.995 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.436 ' N ' HD13 ' A' ' 37' ' ' ILE . 3.7 mm -84.16 110.59 18.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 O-C-N 125.18 1.55 . . . . 62.41 108.306 170.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.2 t -119.21 116.83 52.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 CA-C-N 115.024 -0.989 . . . . 70.45 111.332 -175.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.94 147.03 47.9 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 123.675 0.79 . . . . 77.81 110.447 -173.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.9 t -100.36 135.8 34.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.096 0.95 . . . . 73.3 109.092 164.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 11.2 t -119.9 124.94 73.73 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.325 0 N-CA-C 106.739 -1.578 . . . . 78.65 106.739 -176.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -118.96 153.27 16.98 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.375 -0.83 . . . . 86.85 114.576 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -86.02 174.8 47.93 Favored Glycine 0 CA--C 1.521 0.445 0 CA-C-N 114.784 -0.708 . . . . 76.82 111.844 173.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.478 ' O ' ' HG2' ' A' ' 23' ' ' PRO . 16.9 Cg_exo -84.5 140.77 33.7 Favored 'Cis proline' 0 CA--C 1.511 -0.659 0 C-N-CA 122.692 -1.795 . . . . 73.62 109.965 -1.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -159.96 113.04 2.15 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 124.0 0.813 . . . . 120.47 109.587 173.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -102.05 151.67 21.87 Favored 'General case' 0 C--O 1.25 1.116 0 N-CA-C 108.045 -1.094 . . . . 76.87 108.045 167.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -146.06 163.54 34.95 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.346 0.593 . . . . 107.88 112.402 174.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . 0.416 ' HG1' ' HD1' ' A' ' 123' ' ' TRP . 2.0 p -107.34 -11.49 15.54 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 113.773 1.027 . . . . 81.35 113.773 -165.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -97.38 171.51 8.35 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.92 1.081 . . . . 74.11 113.92 -169.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -123.89 124.79 43.42 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 108.952 -0.758 . . . . 82.36 108.952 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.456 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 20.0 t-160 -82.89 137.85 34.1 Favored 'General case' 0 CA--C 1.479 -1.759 0 N-CA-C 108.156 -1.053 . . . . 64.8 108.156 175.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.418 ' HB2' ' HD3' ' A' ' 94' ' ' ARG . 1.5 t0 -118.0 105.62 12.07 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 104.59 -2.374 . . . . 79.71 104.59 169.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.55 ' OD1' ' HD2' ' A' ' 54' ' ' PRO . 6.0 t0 -96.0 134.03 24.42 Favored Pre-proline 0 C--O 1.218 -0.563 0 N-CA-C 109.006 -0.739 . . . . 76.49 109.006 -177.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.55 ' HD2' ' OD1' ' A' ' 53' ' ' ASP . 72.6 Cg_endo -77.2 -6.32 16.44 Favored 'Trans proline' 0 CA--C 1.561 1.845 0 N-CA-C 114.273 0.836 . . . . 63.47 114.273 178.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.6 mt -128.98 -169.26 2.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.271 1.428 . . . . 68.64 108.59 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -92.8 154.05 18.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.53 -0.759 . . . . 74.01 110.733 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -123.48 136.31 54.52 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 124.828 1.33 . . . . 77.91 107.612 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -113.74 132.65 55.75 Favored 'General case' 0 C--O 1.256 1.42 0 N-CA-C 107.701 -1.222 . . . . 62.49 107.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -120.09 149.06 42.8 Favored 'General case' 0 CA--C 1.474 -1.967 0 O-C-N 123.308 0.38 . . . . 59.04 110.53 179.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.553 ' HB2' HG22 ' A' ' 86' ' ' ILE . 6.3 t80 -152.32 107.55 3.27 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.74 0.65 . . . . 75.98 109.386 172.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -77.84 95.57 4.75 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.732 0.777 . . . . 62.05 111.764 -173.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.1 mt -70.77 -40.4 72.65 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 114.75 -1.114 . . . . 68.71 110.719 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -140.19 143.11 35.92 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 124.558 1.161 . . . . 111.85 113.25 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.34 -173.99 10.53 Favored Glycine 0 N--CA 1.445 -0.725 0 O-C-N 124.356 1.035 . . . . 65.92 113.377 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -117.88 154.29 32.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 121.411 0.624 . . . . 82.15 111.463 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -151.88 -173.47 4.54 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 106.815 -1.55 . . . . 75.95 106.815 -178.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -164.53 159.88 19.74 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 114.292 1.219 . . . . 78.64 114.292 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mt -121.39 116.38 24.68 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.791 0.805 . . . . 74.12 110.892 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -75.23 135.45 41.01 Favored 'General case' 0 N--CA 1.428 -1.556 0 C-N-CA 117.707 -1.597 . . . . 68.24 107.405 169.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.1 mt -126.92 176.7 7.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.1 1.148 . . . . 67.6 114.1 -177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -127.17 122.45 34.16 Favored 'General case' 0 CA--C 1.49 -1.331 0 N-CA-C 105.339 -2.096 . . . . 109.67 105.339 171.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 84.2 t -141.32 118.48 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 124.254 0.971 . . . . 135.84 113.415 -173.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.6 t70 58.39 6.11 0.52 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 111.717 0.265 . . . . 164.97 111.717 176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.17 -30.96 5.28 Favored Glycine 0 N--CA 1.467 0.733 0 N-CA-C 115.026 0.77 . . . . 149.06 115.026 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . . . -80.45 162.92 24.18 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.686 0.794 . . . . 141.87 112.335 176.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -95.57 112.87 24.5 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 122.089 -0.382 . . . . 131.05 110.228 169.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -103.56 174.87 5.68 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.949 1.092 . . . . 133.28 113.949 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 37.4 ttp-105 -139.08 128.73 24.61 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.696 1.369 . . . . 136.08 114.696 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.98 127.23 46.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.485 -0.78 . . . . 83.65 110.595 172.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.79 126.42 41.04 Favored 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 120.672 -0.411 . . . . 109.7 111.076 177.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.9 mt -105.63 70.75 0.88 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.699 0.761 . . . . 63.49 110.637 170.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HE2' ' HB2' ' A' ' 82' ' ' LYS . 4.0 mtmm -64.0 160.54 17.69 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 104.494 -2.409 . . . . 99.6 104.494 174.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.54 140.23 57.43 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-N 118.12 0.418 . . . . 91.32 111.822 -174.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.04 -20.85 37.3 Favored Glycine 0 C--O 1.221 -0.694 0 N-CA-C 115.56 0.984 . . . . 59.51 115.56 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -71.55 146.47 48.44 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.77 0.785 . . . . 78.7 112.735 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.553 HG22 ' HB2' ' A' ' 60' ' ' TYR . 6.0 pt -121.42 166.54 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.735 -0.468 . . . . 69.73 109.735 166.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -169.93 141.29 2.18 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.203 -1.036 . . . . 67.21 108.203 -172.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 49.5 tp -120.46 115.26 23.12 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 122.254 1.026 . . . . 63.86 108.526 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.9 tp -87.98 128.64 53.18 Favored Pre-proline 0 N--CA 1.438 -1.03 0 N-CA-C 106.907 -1.516 . . . . 65.82 106.907 -177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -73.24 165.43 32.66 Favored 'Trans proline' 0 C--O 1.243 0.743 0 O-C-N 123.225 1.118 . . . . 64.47 110.84 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -69.34 159.92 51.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 115.369 -2.621 . . . . 69.87 114.7 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 40.1 m80 65.71 -1.95 0.96 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.04 1.336 . . . . 79.89 113.361 173.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -76.54 142.25 14.6 Favored 'Isoleucine or valine' 0 C--O 1.261 1.71 0 N-CA-C 109.085 -0.709 . . . . 75.82 109.085 173.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' HB2' ' A' ' 52' ' ' ASP . 34.7 mmt-85 -98.16 121.44 40.09 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 115.279 -0.873 . . . . 69.44 111.836 -168.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.456 ' CE1' ' HB3' ' A' ' 51' ' ' HIS . 24.3 p-80 -135.52 139.7 44.17 Favored 'General case' 0 C--O 1.257 1.454 0 CA-C-N 115.345 -0.843 . . . . 58.68 112.642 -168.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.0 t -130.61 103.74 16.1 Favored Pre-proline 0 CA--C 1.499 -0.989 0 N-CA-C 106.811 -1.551 . . . . 62.49 106.811 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . 1.106 ' HG3' ' H3 ' ' A' ' 203' ' ' SAL . 44.5 Cg_endo -85.76 121.1 2.1 Favored 'Trans proline' 0 CA--C 1.499 -1.238 0 C-N-CA 123.559 2.839 . . . . 64.87 111.108 -171.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mm-40 -108.85 118.84 37.85 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 124.959 1.412 . . . . 63.06 110.06 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -114.89 84.08 10.13 Favored Pre-proline 0 CA--C 1.505 -0.76 0 N-CA-C 106.538 -1.653 . . . . 76.44 106.538 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.65 -42.04 64.38 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 O-C-N 123.667 1.351 . . . . 63.98 113.416 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -77.62 135.6 38.15 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 115.119 1.526 . . . . 107.83 115.119 -162.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.76 119.94 19.63 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-N 114.464 -1.244 . . . . 66.74 110.484 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 77.71 24.66 64.38 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 115.18 0.832 . . . . 72.84 115.18 -177.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 84.2 p -74.4 155.47 38.07 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 106.394 -1.706 . . . . 73.43 106.394 165.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.39 134.95 36.51 Favored 'General case' 0 CA--C 1.492 -1.273 0 N-CA-C 105.433 -2.062 . . . . 67.59 105.433 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 53.7 t -136.89 126.04 24.59 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 114.664 -1.153 . . . . 64.23 108.718 176.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 5.8 tp -79.08 124.84 28.68 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.867 -0.606 . . . . 68.32 111.602 171.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.4 t -124.08 120.37 59.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-N 116.413 -0.358 . . . . 57.12 110.765 -179.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 62.9 mt -112.65 148.43 15.68 Favored 'Isoleucine or valine' 0 C--O 1.249 1.046 0 N-CA-C 113.697 0.999 . . . . 53.55 113.697 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -165.98 164.51 18.33 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 124.738 1.274 . . . . 89.32 110.161 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -101.93 134.26 45.41 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 112.739 0.644 . . . . 68.09 112.739 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -41.39 123.06 2.04 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 107.329 -1.36 . . . . 124.89 107.329 165.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -73.26 131.72 82.81 Favored Pre-proline 0 N--CA 1.488 1.445 0 CA-C-O 121.051 0.453 . . . . 82.77 110.746 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.3 147.37 14.38 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.369 1.38 . . . . 85.31 111.791 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -39.26 136.46 0.87 Allowed 'General case' 0 CA--C 1.556 1.182 0 O-C-N 123.842 0.714 . . . . 79.65 111.964 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.39 -23.36 36.15 Favored Glycine 0 N--CA 1.485 1.951 0 CA-C-O 121.584 0.547 . . . . 81.87 113.544 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' MET . . . . . . . . . . . . . 8.7 ttm -104.21 113.63 27.32 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-O 121.58 0.705 . . . . 88.13 112.307 -174.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.5 mt -111.94 147.76 35.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.22 -0.9 . . . . 69.52 112.894 -177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -95.58 150.93 19.8 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 106.409 -1.7 . . . . 71.54 106.409 174.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -108.67 151.44 17.07 Favored Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 109.746 -1.342 . . . . 64.85 109.746 173.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -125.94 141.86 51.78 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.466 0.65 . . . . 75.99 109.882 165.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.526 ' OE2' ' NH1' ' A' ' 134' ' ' ARG . 88.2 mt-10 -147.72 133.61 19.1 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-N 115.474 -0.784 . . . . 74.31 110.918 -163.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.416 ' HD1' ' HG1' ' A' ' 48' ' ' THR . 8.7 m-90 -118.59 146.68 44.42 Favored 'General case' 0 CA--C 1.468 -2.191 0 O-C-N 125.06 1.475 . . . . 65.91 110.299 172.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -122.23 146.11 47.58 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 125.005 1.44 . . . . 91.83 112.654 -170.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' CYS . . . . . 0.529 ' SG ' ' O ' ' A' ' 304' ' ' HOH . 49.5 t -64.88 104.88 0.91 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-O 122.745 1.26 . . . . 95.11 113.319 175.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.482 ' OD2' ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -29.01 -32.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 112.261 -2.245 . . . . 131.03 115.733 162.535 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -114.61 -67.63 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.327 1.051 . . . . 103.13 111.79 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.609 ' HB3' ' SG ' ' A' ' 165' ' ' CYS . 0.5 OUTLIER -78.16 -10.42 59.63 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 118.585 -1.246 . . . . 104.72 112.391 -178.196 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.1 10.0 50.1 Favored Glycine 0 N--CA 1.476 1.351 0 N-CA-C 118.062 1.985 . . . . 98.46 118.062 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -76.94 160.42 29.19 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 105.411 -2.07 . . . . 128.69 105.411 175.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.2 tp -69.27 114.15 7.26 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 109.406 -0.59 . . . . 84.64 109.406 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 40.8 t -64.85 -58.66 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 115.538 -0.755 . . . . 78.06 111.618 170.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -152.22 141.18 21.15 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 114.284 1.216 . . . . 80.67 114.284 -166.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.526 ' NH1' ' OE2' ' A' ' 122' ' ' GLU . 52.7 ttt85 -139.73 130.12 25.46 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.609 0.764 . . . . 72.89 112.733 -179.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.5 t -123.05 133.57 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 C-N-CA 123.394 0.678 . . . . 73.24 109.577 171.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -104.12 145.39 30.25 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.011 -1.107 . . . . 97.86 108.011 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 1.6 p -153.45 127.49 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.003 0 CA-C-N 115.287 -0.87 . . . . 70.76 111.325 -166.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -75.71 101.52 5.05 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.428 -1.693 . . . . 92.25 106.428 171.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.5 tp -79.74 109.9 14.58 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.144 -0.935 . . . . 97.71 111.653 -174.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 23.9 ttpt -104.84 -48.2 3.82 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.762 0.791 . . . . 100.35 112.467 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 47.5 t -135.44 111.83 9.83 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.483 -0.78 . . . . 120.75 109.531 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 45.5 mt -42.5 -50.65 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.39 0.676 . . . . 135.65 111.626 176.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.486 ' O ' ' HD2' ' A' ' 147' ' ' PRO . 1.9 t -54.52 -63.87 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 113.768 1.025 . . . . 117.6 113.768 -179.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 82.5 p -74.08 -42.66 59.82 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.269 0.47 . . . . 108.9 112.269 -173.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -72.17 -23.54 61.29 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 115.686 1.736 . . . . 108.2 115.686 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 8.8 tp -107.05 -46.41 0.12 Allowed Pre-proline 0 CA--C 1.553 1.09 0 N-CA-C 120.576 3.547 . . . . 114.52 120.576 -164.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.731 ' HB2' ' HD3' ' A' ' 148' ' ' PRO . 84.2 Cg_exo -49.27 -57.95 2.04 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 117.585 -1.143 . . . . 105.08 114.089 174.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 147' ' ' PRO . 82.8 Cg_exo -45.92 -39.57 19.49 Favored 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 122.226 1.951 . . . . 104.77 114.867 -178.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 tt -57.55 -42.92 83.91 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 123.649 0.593 . . . . 108.71 110.955 175.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -69.75 -44.05 71.01 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.924 0.49 . . . . 108.81 111.861 -177.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -52.49 -52.4 54.6 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 119.207 -0.425 . . . . 152.94 111.573 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 1.8 p -56.08 -36.96 68.69 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.794 0.27 . . . . 95.74 111.401 -173.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -75.1 -48.23 24.84 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-O 119.015 -0.517 . . . . 80.75 110.799 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -65.27 -32.09 73.57 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.291 0.849 . . . . 103.74 113.291 -173.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -95.49 20.18 9.89 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.689 1.737 . . . . 111.52 115.689 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 11.0 t -142.78 100.59 3.7 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.856 1.428 . . . . 99.03 114.856 -174.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -54.79 -23.1 16.54 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.693 -1.14 . . . . 162.67 110.151 -178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.46 -44.68 62.0 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.361 -1.29 . . . . 136.94 113.25 -172.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -74.46 -37.66 63.17 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 109.547 -0.538 . . . . 89.8 109.547 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -69.8 1.92 3.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 114.045 1.128 . . . . 103.98 114.045 -179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 10.1 ttm105 -85.27 121.67 28.35 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.668 -0.864 . . . . 111.3 108.668 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' CYS . . . . . 1.024 ' HB2' ' O ' ' A' ' 304' ' ' HOH . 29.8 t -67.17 129.84 93.8 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 115.325 1.602 . . . . 87.19 115.325 177.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -83.37 25.5 0.68 Allowed 'Trans proline' 0 C--O 1.246 0.91 0 C-N-CA 120.601 0.867 . . . . 106.43 110.396 -176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.588 ' HB3' ' SG ' ' A' ' 128' ' ' CYS . 21.0 t-80 -132.31 -76.19 0.5 Allowed 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 115.383 -0.826 . . . . 134.01 110.937 174.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' CYS . . . . . 0.609 ' SG ' ' HB3' ' A' ' 128' ' ' CYS . 1.4 p -92.28 17.35 9.86 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 119.637 -0.825 . . . . 120.0 113.107 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 47.35 10.11 0.06 OUTLIER Glycine 0 N--CA 1.48 1.582 0 N-CA-C 116.296 1.278 . . . . 108.57 116.296 173.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 165' ' ' CYS . 0.0 OUTLIER -72.05 138.14 47.66 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.717 0.807 . . . . 113.97 110.308 175.2 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.6 t -93.91 109.62 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 112.748 0.647 . . . . 97.35 112.748 -172.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -58.36 132.86 84.94 Favored Pre-proline 0 N--CA 1.443 -0.776 0 CA-C-N 114.709 -1.132 . . . . 83.4 108.662 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -57.04 -36.75 99.4 Favored 'Trans proline' 0 C--N 1.348 0.516 1 C-N-CA 130.495 7.463 . . . . 89.89 117.261 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 74.75 -58.46 2.58 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 114.551 0.581 . . . . 131.85 114.551 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ARG . . . . . 0.499 ' NH1' ' HA ' ' A' ' 172' ' ' ARG . 1.3 tpp180 -58.36 -76.5 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.717 1.006 . . . . 165.56 113.717 -179.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ALA . . . . . . . . . . . . . . . -152.82 -154.43 0.53 Allowed 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 116.379 -0.373 . . . . 185.28 111.6 -177.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.644 0.777 . . . . 204.62 112.853 -179.508 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' FE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SAL . . . . . 1.106 ' H3 ' ' HG3' ' A' ' 97' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . 1.024 ' O ' ' HB2' ' A' ' 162' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_