data_6jc2_residue ############################ # Computer software used # ############################ 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 6jc2 _Structure_validation_residue.Date_analyzed 2019-09-07 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 ' H' H ' 1' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 121.59 0.71 . . . . 105.95 111.304 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 t -88.75 120.2 37.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.918 -1.141 . . . . 86.66 107.918 175.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -127.13 142.79 51.42 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.847 0.356 . . . . 102.52 110.285 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 18.1 mt -119.44 127.62 53.25 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.946 -1.131 . . . . 61.93 107.946 171.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -126.33 124.68 66.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 109.037 -0.727 . . . . 70.11 109.037 -172.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -110.07 146.05 36.05 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.62 0.768 . . . . 82.71 110.529 -173.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -132.16 -25.49 2.0 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 115.897 1.814 . . . . 88.43 115.897 -166.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 8' ' ' GLY . . . . . . . . . . . . . . . -90.04 7.23 82.01 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 119.358 2.503 . . . . 72.04 119.358 -159.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.21 170.94 33.26 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 119.85 1.825 . . . . 81.58 113.626 -171.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.72 -172.56 40.47 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.816 -0.707 . . . . 66.46 112.074 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 11' ' ' VAL . . . . . . . . . . . . . 78.5 t -114.64 128.15 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 124.021 0.928 . . . . 53.09 108.501 -178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 12' ' ' VAL . . . . . . . . . . . . . 29.3 m -144.61 159.19 14.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 121.847 0.832 . . . . 53.04 110.013 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -76.88 155.46 82.92 Favored Pre-proline 0 N--CA 1.454 -0.266 0 CA-C-N 115.014 -0.994 . . . . 57.53 111.115 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 14' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.37 156.26 52.46 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 CA-C-O 121.98 0.742 . . . . 51.71 111.516 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.67 -2.83 77.44 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 114.917 -1.038 . . . . 52.3 115.693 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -96.36 -175.7 3.42 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.869 1.335 . . . . 71.71 111.475 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' SER . . . . . . . . . . . . . 27.4 m -117.13 156.96 26.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.352 -0.84 . . . . 61.32 110.519 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -164.66 129.66 2.67 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.631 -1.248 . . . . 67.3 107.631 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' ARG . . . . . . . . . . . . . 25.0 ttp180 -109.91 123.78 50.2 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.192 0.307 . . . . 89.41 110.383 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 84.0 mt -96.12 145.53 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.723 -0.843 . . . . 50.55 108.723 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' SER . . . . . . . . . . . . . 3.4 p -129.11 148.33 51.05 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.877 -0.786 . . . . 75.22 108.877 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' CYS . . . . . . . . . . . . . 15.3 t -134.46 103.03 5.53 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 106.642 -1.614 . . . . 84.73 106.642 -179.83 170.126 130.364 63.111 107.471 2.052 106.003 173.166 56.968 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.2 131.49 34.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.466 -0.568 . . . . 76.92 109.466 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ALA . . . . . . . . . . . . . . . -120.57 143.28 48.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.287 -0.415 . . . . 68.09 110.349 -173.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 33.4 p -150.97 169.37 21.95 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.661 -0.866 . . . . 88.84 108.661 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.5 -0.3 88.32 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 115.691 1.037 . . . . 77.46 115.691 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -153.91 170.81 20.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.609 1.204 . . . . 78.45 108.717 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' THR . . . . . . . . . . . . . 32.0 m -78.57 104.86 9.46 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.999 -1.112 . . . . 81.71 107.999 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.27 -46.24 86.38 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.101 -0.499 . . . . 82.24 111.668 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' SER . . . . . . . . . . . . . 83.3 p -81.77 17.27 1.53 Allowed 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.2 0.815 . . . . 77.92 113.2 -169.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 1.1 m -107.28 -11.97 15.45 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.379 0.881 . . . . 91.54 113.379 174.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -113.57 155.2 25.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.611 0.719 . . . . 79.76 110.625 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' THR . . . . . . . . . . . . . 69.5 p -93.0 154.57 18.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.368 -0.833 . . . . 61.17 109.659 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' MET . . . . . . . . . . . . . 84.3 mmm -126.76 155.25 43.08 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.508 0.671 . . . . 74.03 110.822 -169.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -132.83 159.05 40.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.021 -0.99 . . . . 58.93 110.676 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -112.88 132.97 55.08 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.915 -1.143 . . . . 54.14 107.915 160.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 90.4 t -130.75 133.18 63.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.614 -1.254 . . . . 60.43 107.614 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -122.08 156.36 33.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.976 0.893 . . . . 62.04 110.925 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -141.21 110.23 6.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.478 -1.237 . . . . 54.77 107.994 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.74 161.12 73.73 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 110.084 -0.339 . . . . 50.99 110.084 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.8 120.43 8.3 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 120.12 0.547 . . . . 64.04 112.208 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.19 10.35 73.8 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 115.203 0.841 . . . . 66.43 115.203 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -118.77 178.6 4.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.239 1.02 . . . . 98.76 109.785 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.81 -170.51 35.47 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-O 122.576 1.098 . . . . 79.95 112.967 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' LEU . . . . . . . . . . . . . 30.2 mt -92.33 147.69 22.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.489 -0.856 . . . . 58.22 110.352 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' GLU . . . . . 0.621 ' OE1' ' O ' ' H' ' 403' ' ' HOH . 31.4 tt0 -142.38 121.43 12.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.147 -0.686 . . . . 89.3 109.147 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' TRP . . . . . . . . . . . . . 69.6 t90 -63.18 138.12 58.44 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.18 0.514 . . . . 57.61 110.309 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 88.4 t -110.89 -58.96 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.816 -0.629 . . . . 52.89 111.207 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' THR . . . . . . . . . . . . . 4.7 t -157.41 156.92 33.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.479 0.657 . . . . 56.34 109.709 -172.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -132.74 145.09 50.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 114.853 -1.067 . . . . 59.82 109.075 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' ILE . . . . . . . . . . . . . 18.6 tt -139.5 140.33 37.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 108.753 -0.832 . . . . 65.15 108.753 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' SER . . . . . . . . . . . . . 12.5 p -82.78 -171.37 3.49 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.731 0.777 . . . . 74.13 109.344 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -53.69 7.3 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.685 -0.634 . . . . 84.03 110.366 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' ASP . . . . . 0.661 ' N ' ' OD1' ' H' ' 54' ' ' ASP . 0.0 OUTLIER -48.35 -51.4 26.44 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.015 0.436 . . . . 98.13 111.293 175.097 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . 111.05 1.15 28.46 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-O 119.3 -0.722 . . . . 86.11 113.364 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -94.12 1.73 56.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.042 0.921 . . . . 103.83 113.21 -172.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -134.34 108.73 8.36 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.371 -0.974 . . . . 91.45 108.371 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -120.82 131.41 54.43 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.325 -0.991 . . . . 82.49 108.325 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -126.73 145.8 50.46 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.291 -0.633 . . . . 103.26 109.291 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -135.94 138.05 41.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 115.995 -0.548 . . . . 61.72 109.815 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.57 152.67 25.52 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.128 -0.629 . . . . 63.2 109.61 168.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -62.82 -27.3 69.22 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.135 -0.626 . . . . 91.58 111.532 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m -56.0 -28.96 59.49 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.337 0.495 . . . . 76.39 112.337 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' VAL . . . . . . . . . . . . . 25.1 m -128.13 -1.23 3.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 113.579 0.955 . . . . 61.71 113.579 -166.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LYS . . . . . . . . . . . . . 4.8 tptt -64.86 135.18 55.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.302 0.956 . . . . 87.29 110.344 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.57 -7.98 80.51 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-O 119.219 -0.767 . . . . 70.36 114.809 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . 0.531 ' NH1' ' O ' ' H' ' 402' ' ' HOH . 22.9 mtp180 -127.9 -27.24 2.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.135 0.967 . . . . 61.73 111.312 -176.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -111.96 141.06 46.08 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.747 -0.464 . . . . 70.75 109.747 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' THR . . . . . . . . . . . . . 16.0 m -128.8 113.06 14.83 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.391 -0.596 . . . . 82.32 109.391 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' ILE . . . . . . . . . . . . . 17.9 tt -87.06 143.6 11.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.524 -0.917 . . . . 65.46 108.524 173.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' SER . . . . . . . . . . . . . 54.8 p -156.04 161.4 40.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.434 -0.951 . . . . 64.31 108.434 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -142.11 144.48 33.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.582 -0.735 . . . . 80.7 109.262 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -121.41 106.67 11.65 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 107.27 -1.382 . . . . 107.81 107.27 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -73.39 -26.9 61.19 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.225 -0.59 . . . . 91.54 111.808 -177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' SER . . . . . . . . . . . . . 30.2 p -67.13 -17.34 64.82 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.307 -0.557 . . . . 91.55 112.364 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -115.85 0.81 13.24 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.008 0.744 . . . . 92.36 113.008 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 58.49 52.79 6.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.601 0.715 . . . . 78.2 111.094 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' THR . . . . . . . . . . . . . 18.5 m -136.85 134.48 36.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.038 -0.528 . . . . 76.56 110.331 -175.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' LEU . . . . . . . . . . . . . 18.9 tp -102.11 140.62 36.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.151 -0.685 . . . . 62.09 109.151 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.72 147.12 48.8 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.31 0.576 . . . . 81.2 111.376 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LEU . . . . . . . . . . . . . 49.6 tp -129.77 108.65 10.33 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.127 -1.064 . . . . 57.93 108.127 167.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -86.92 115.53 24.38 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.119 -1.067 . . . . 65.02 108.119 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' MET . . . . . . . . . . . . . 6.6 mtm -103.79 123.87 47.86 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.288 -0.634 . . . . 63.27 109.288 -179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 57.0 m-20 -124.7 162.45 24.16 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.544 -0.539 . . . . 61.31 109.544 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' SER . . . . . . . . . . . . . 62.1 m 47.28 52.47 12.08 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.889 0.852 . . . . 67.08 110.901 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.53 145.18 56.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.397 -0.819 . . . . 57.14 111.177 -172.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' H' ' 405' ' ' HOH . 98.0 mtt180 -122.34 157.44 31.78 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.163 0.985 . . . . 83.1 109.45 178.573 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.05 -39.99 69.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.569 -0.741 . . . . 54.04 111.294 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -63.29 -13.14 35.18 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.913 0.709 . . . . 105.68 112.913 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ASP . . . . . 0.709 ' OD1' ' O ' ' H' ' 402' ' ' HOH . 65.3 m-20 -76.7 -2.84 34.93 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.14 0.793 . . . . 86.51 113.14 174.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' THR . . . . . . . . . . . . . 16.5 m -67.11 115.04 6.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 118.052 0.387 . . . . 57.11 110.027 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' ALA . . . . . . . . . . . . . . . -168.68 167.21 11.45 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.125 -0.694 . . . . 53.61 109.125 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 89.3 mt -81.88 129.99 36.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.965 -1.124 . . . . 52.53 107.965 163.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -107.85 125.22 51.19 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.541 -0.54 . . . . 50.93 109.541 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -109.22 139.8 43.67 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.12 0.968 . . . . 58.08 110.143 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' CYS . . . . . . . . . . . . . 24.7 p -90.22 147.1 23.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.109 -1.071 . . . . 80.04 108.109 160.474 56.968 173.166 63.111 106.003 2.052 107.471 130.364 170.126 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.25 147.64 32.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.962 -0.563 . . . . 58.07 109.67 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -106.37 140.5 39.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.406 -0.816 . . . . 80.32 109.703 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' THR . . . . . . . . . . . . . 1.3 p -91.55 114.63 27.21 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.735 -0.839 . . . . 87.87 108.735 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' GLY . . . . . . . . . . . . . . . -56.87 164.48 5.85 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.051 -1.071 . . . . 65.5 111.422 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -54.59 -33.5 60.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.94 -0.704 . . . . 109.02 110.972 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.01 -21.19 33.95 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.127 0.788 . . . . 82.16 113.127 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' GLY . . . . . 0.762 ' O ' ' O ' ' H' ' 401' ' ' HOH . . . 135.21 -33.61 2.42 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 119.661 2.624 . . . . 63.8 119.661 168.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.03 -179.99 5.96 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 CA-C-N 119.683 1.741 . . . . 65.04 111.49 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -89.14 92.94 9.4 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 107.466 -1.309 . . . . 61.16 107.466 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.62 -23.35 29.6 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.841 1.052 . . . . 77.79 113.841 -170.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -137.44 130.78 31.0 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.914 0.779 . . . . 65.05 109.923 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -117.66 145.06 44.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.208 0.528 . . . . 53.22 110.368 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.02 -179.92 30.44 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 122.59 1.106 . . . . 55.26 110.756 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 pm0 -85.77 -23.15 27.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.836 -0.746 . . . . 55.47 112.806 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' GLY . . . . . . . . . . . . . . . 100.06 121.19 4.62 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 118.182 0.446 . . . . 64.54 114.047 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' THR . . . . . . . . . . . . . 1.4 p -102.77 138.94 39.0 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.175 -0.676 . . . . 71.88 109.175 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' LEU . . . . . . . . . . . . . 60.0 tp -86.96 135.65 33.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.921 -0.581 . . . . 53.75 109.819 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' VAL . . . . . . . . . . . . . 98.5 t -126.92 120.91 56.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.637 -1.246 . . . . 48.37 107.637 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' THR . . . . . . . . . . . . . 42.2 m -117.22 129.91 56.24 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.765 -0.828 . . . . 58.41 108.765 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' VAL . . . . . . . . . . . . . 38.4 t -120.37 109.2 24.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 106.776 -1.564 . . . . 45.53 106.776 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' SER . . . . . . . . . . . . . 25.7 t -147.89 151.17 35.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.782 -0.821 . . . . 52.29 108.782 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' SER . . . . . . . . . . . . . 91.4 p -88.21 -1.65 58.14 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.652 -0.703 . . . . 51.45 112.316 176.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.77 160.47 31.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.95 0.881 . . . . 57.97 110.651 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' SER . . . . . . . . . . . . . 32.3 m -107.24 155.17 20.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.148 -0.933 . . . . 55.77 109.01 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' THR . . . . . . . . . . . . . 6.6 m -53.11 129.89 32.44 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.774 -0.648 . . . . 52.53 110.01 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -147.28 128.3 14.57 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.079 -0.51 . . . . 73.56 109.684 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.39 156.96 50.49 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.791 -0.923 . . . . 44.45 110.791 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -84.57 164.03 12.45 Favored 'Trans proline' 0 C--N 1.326 -0.619 0 CA-C-O 122.355 0.898 . . . . 54.87 112.452 -173.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' SER . . . . . . . . . . . . . 48.3 m -101.98 130.63 48.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.443 -1.253 . . . . 63.66 108.044 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' VAL . . . . . . . . . . . . . 75.8 t -114.75 122.82 69.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 51.57 108.523 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -124.63 144.9 47.72 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-N 116.199 -0.455 . . . . 51.08 109.981 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -81.49 143.36 13.62 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 CA-C-O 121.548 0.562 . . . . 60.2 111.892 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' LEU . . . . . . . . . . . . . 80.2 mt -102.41 94.91 5.93 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.274 -1.75 . . . . 52.28 106.274 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.89 145.42 81.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.776 -0.647 . . . . 66.0 110.805 -170.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -85.24 163.34 11.35 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 C-N-CA 121.352 1.368 . . . . 92.61 112.321 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 114.852 -1.067 . . . . 111.79 111.274 175.509 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 113.492 0.157 . . . . 88.31 113.492 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' THR . . . . . . . . . . . . . 1.4 t -114.54 146.26 40.95 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.376 0.608 . . . . 78.66 110.664 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.58 166.75 21.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.374 -0.83 . . . . 70.5 108.957 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' ALA . . . . . . . . . . . . . . . -134.13 144.27 48.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.744 -0.662 . . . . 60.76 109.57 -178.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 pp -150.01 153.72 36.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.503 -1.295 . . . . 68.77 107.503 175.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' GLY . . . . . . . . . . . . . . . -156.75 -167.92 18.66 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 118.431 -1.842 . . . . 52.78 114.255 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' CYS . . . . . . . . . . . . . 1.2 m -136.96 128.33 28.26 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 124.558 1.143 . . . . 92.27 111.339 -174.999 -97.939 173.054 -167.073 103.816 1.967 96.391 149.165 -155.384 1 1 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' LEU . . . . . . . . . . . . . 4.8 tp -96.63 111.73 23.76 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 107.532 -1.285 . . . . 56.2 107.532 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 147' ' ' VAL . . . . . . . . . . . . . 94.9 t -105.42 103.61 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 105.963 -1.866 . . . . 52.13 105.963 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 148' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -120.96 140.62 51.62 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.014 0.526 . . . . 58.56 112.069 -162.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 149' ' ' ASP . . . . . 0.436 ' OD1' ' NE2' ' H' ' 176' ' ' GLN . 69.7 m-20 58.97 63.03 1.72 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.32 1.048 . . . . 80.25 112.607 168.237 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -123.47 161.15 25.41 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.529 -0.76 . . . . 55.17 110.323 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -162.86 135.61 4.27 Favored Pre-proline 0 C--O 1.239 0.525 0 N-CA-C 108.14 -1.059 . . . . 53.5 108.14 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -97.0 -171.98 2.77 Favored 'Cis proline' 0 N--CA 1.462 -0.373 0 C-N-CA 123.113 -1.62 . . . . 55.63 111.44 -0.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -63.41 156.84 68.21 Favored Pre-proline 0 N--CA 1.448 -0.571 0 N-CA-C 109.355 -0.609 . . . . 78.62 109.355 167.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -101.71 -172.58 1.66 Allowed 'Cis proline' 0 N--CA 1.462 -0.377 0 CA-C-O 122.531 0.971 . . . . 45.82 114.424 -4.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' VAL . . . . . . . . . . . . . 2.5 t -141.1 136.73 33.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 113.462 -1.699 . . . . 61.58 107.553 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' THR . . . . . . . . . . . . . 26.9 m -106.37 121.18 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.856 -0.794 . . . . 54.85 108.856 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 20.5 t -112.99 130.88 66.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.315 -0.995 . . . . 56.29 108.315 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' SER . . . . . . . . . . . . . 14.8 p -138.07 157.73 45.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.953 -1.129 . . . . 57.08 107.953 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -117.16 130.4 56.58 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.852 -0.613 . . . . 61.46 109.577 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 49.41 43.66 23.52 Favored 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.789 0.68 . . . . 61.2 110.903 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' SER . . . . . . . . . . . . . 19.0 m 60.26 40.97 17.22 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.623 -0.717 . . . . 59.65 111.537 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' GLY . . . . . . . . . . . . . . . 81.28 -3.17 78.83 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 115.263 0.865 . . . . 61.01 115.263 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.92 -7.88 54.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.55 1.175 . . . . 63.76 112.994 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' LEU . . . . . . . . . . . . . 40.2 tp -131.11 110.54 11.26 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.816 -1.179 . . . . 65.32 107.816 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' THR . . . . . . . . . . . . . 70.8 p -123.39 -37.08 2.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.972 0.73 . . . . 69.4 112.972 -177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' SER . . . . . . . . . . . . . 6.2 t -63.17 122.57 16.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.828 0.347 . . . . 85.74 110.538 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' GLY . . . . . . . . . . . . . . . 94.8 1.33 63.58 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 115.382 0.913 . . . . 63.74 115.382 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' VAL . . . . . . . . . . . . . 69.0 t -86.8 129.29 38.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.706 1.253 . . . . 59.24 109.676 -173.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -123.32 114.31 20.03 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.182 -1.044 . . . . 66.77 108.182 172.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' THR . . . . . . . . . . . . . 98.1 m -106.36 112.51 25.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.587 -1.634 . . . . 55.34 106.587 171.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -77.96 152.07 79.55 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.062 -0.517 . . . . 53.01 111.037 -174.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.34 149.19 91.64 Favored 'Trans proline' 0 C--N 1.331 -0.359 0 CA-C-O 121.435 0.514 . . . . 51.8 110.82 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ALA . . . . . . . . . . . . . . . -76.46 134.85 39.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.663 -0.698 . . . . 53.63 110.507 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' VAL . . . . . . . . . . . . . 30.9 m -92.99 139.82 17.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.322 -0.992 . . . . 67.31 108.322 169.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' LEU . . . . . . . . . . . . . 6.3 tt -83.34 128.5 34.56 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.971 -0.751 . . . . 79.13 108.971 175.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' GLN . . . . . 0.436 ' NE2' ' OD1' ' H' ' 149' ' ' ASP . 30.5 mt-30 -94.52 167.71 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.805 0.812 . . . . 94.33 110.64 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' SER . . . . . . . . . . . . . 2.7 t -58.0 -24.57 58.7 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.713 -0.676 . . . . 78.95 112.585 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' SER . . . . . . . . . . . . . 44.3 p -74.73 -18.91 60.43 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.262 0.838 . . . . 77.18 113.262 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' GLY . . . . . . . . . . . . . . . 103.61 -14.8 53.57 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 118.747 0.703 . . . . 59.48 113.733 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' LEU . . . . . . . . . . . . . 14.1 mt -92.2 147.49 22.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.724 0.809 . . . . 47.58 110.94 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -88.93 160.02 17.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.274 -0.875 . . . . 48.09 110.332 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -145.52 150.9 37.28 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 107.511 -1.292 . . . . 70.03 107.511 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' LEU . . . . . . . . . . . . . 8.0 tt -154.89 156.34 35.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.142 -0.688 . . . . 55.68 109.142 -165.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' SER . . . . . . . . . . . . . 9.3 t -133.56 138.21 45.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.282 -0.872 . . . . 67.26 109.625 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' SER . . . . . . . . . . . . . 28.0 t -125.63 136.37 53.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.258 -1.016 . . . . 49.04 108.258 171.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' VAL . . . . . . . . . . . . . 29.4 m -135.35 166.99 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-O 121.815 0.817 . . . . 56.41 109.007 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' VAL . . . . . . . . . . . . . 7.3 p -155.27 136.11 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 107.526 -1.287 . . . . 58.11 107.526 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' THR . . . . . . . . . . . . . 13.4 p -92.77 146.7 23.44 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.293 -0.632 . . . . 52.56 109.293 172.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' VAL . . . . . . . . . . . . . 31.6 m -143.9 156.89 58.72 Favored Pre-proline 0 C--O 1.242 0.704 0 N-CA-C 108.886 -0.783 . . . . 67.31 108.886 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -53.87 120.75 8.4 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.558 -0.593 . . . . 83.51 110.558 167.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' SER . . . . . . . . . . . . . 23.4 t -59.57 -22.77 62.22 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.463 0.542 . . . . 93.52 112.463 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' SER . . . . . 0.476 ' N ' ' O ' ' H' ' 404' ' ' HOH . 77.8 p -65.86 -6.86 13.47 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.288 0.847 . . . . 72.62 113.288 176.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' SER . . . . . . . . . . . . . 81.0 p -102.31 -7.32 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.275 0.843 . . . . 73.89 113.275 -177.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.32 -25.72 67.32 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.409 0.55 . . . . 76.37 112.273 -173.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' GLY . . . . . . . . . . . . . . . -89.32 -19.24 50.57 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.669 -0.777 . . . . 94.38 113.941 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' THR . . . . . . . . . . . . . 41.8 p -114.88 -41.37 3.37 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.874 1.064 . . . . 93.32 113.874 -172.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -86.45 136.67 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.445 0.566 . . . . 79.67 110.206 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' THR . . . . . . . . . . . . . 9.0 m -93.77 135.05 35.47 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.155 -0.683 . . . . 68.2 109.155 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -120.49 110.17 16.16 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.825 -0.805 . . . . 60.34 108.825 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' ILE . . . . . . . . . . . . . 22.3 mt -114.52 121.49 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 121.515 0.674 . . . . 63.37 109.281 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.41 132.71 46.02 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.782 -1.099 . . . . 83.0 110.807 171.294 -155.384 149.165 -167.073 96.391 1.967 103.816 173.054 -97.939 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -118.36 121.93 41.58 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.397 -0.964 . . . . 51.42 108.397 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' VAL . . . . . . . . . . . . . 59.9 t -126.98 121.58 58.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 108.638 -0.875 . . . . 55.7 108.638 -175.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -121.0 127.94 52.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.742 0.817 . . . . 54.71 109.094 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -125.21 91.78 3.49 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 106.395 -1.705 . . . . 44.07 106.395 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -57.96 -37.93 61.14 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.528 1.307 . . . . 78.44 114.528 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -66.53 -23.52 49.98 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.033 1.762 . . . . 46.18 114.366 -175.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' SER . . . . . . . . . . . . . 92.5 p -101.58 -6.06 24.32 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.309 0.959 . . . . 53.6 113.215 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' ASN . . . . . . . . . . . . . 64.7 t30 65.37 44.55 3.13 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.553 0.692 . . . . 54.35 111.524 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' THR . . . . . . . . . . . . . 11.1 p -130.85 128.37 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.779 -0.823 . . . . 57.05 108.779 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' LYS . . . . . 0.462 ' NZ ' ' OD1' ' H' ' 213' ' ' ASP . 5.6 tptp -130.17 129.9 44.04 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.939 -1.504 . . . . 67.11 106.939 168.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' VAL . . . . . . . . . . . . . 25.4 m -134.99 153.91 35.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 121.461 0.648 . . . . 49.21 109.715 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' ASP . . . . . 0.462 ' OD1' ' NZ ' ' H' ' 211' ' ' LYS . 66.9 m-20 -118.93 134.55 55.11 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.336 -0.847 . . . . 65.16 108.963 174.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -125.78 113.8 17.77 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.088 -0.708 . . . . 54.92 109.088 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.35 136.15 47.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.114 0.483 . . . . 67.26 110.095 172.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' VAL . . . . . . . . . . . . . 49.1 t -112.53 125.05 69.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.427 -0.953 . . . . 56.62 108.427 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -141.07 154.79 68.49 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 116.218 -0.446 . . . . 99.82 110.075 -168.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 218' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--N 1.343 0.238 0 C-N-CA 123.187 2.591 . . . . 83.62 112.727 173.218 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 108.551 -0.907 . . . . 120.74 108.551 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 tt -75.57 136.55 24.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 118.587 -1.245 . . . . 77.43 109.251 172.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' VAL . . . . . . . . . . . . . 19.9 t -119.25 119.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.335 -0.987 . . . . 64.88 108.335 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 32.7 mt -94.29 122.29 36.69 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.438 -0.949 . . . . 64.74 108.438 170.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' THR . . . . . . . . . . . . . 91.6 m -111.46 115.43 29.21 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.366 -0.605 . . . . 59.99 109.366 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -94.12 145.02 24.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.984 0.421 . . . . 57.6 110.111 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' SER . . . . . . . . . . . . . 3.0 p -147.18 144.67 20.05 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 108.264 -1.013 . . . . 68.73 108.264 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.13 172.45 62.99 Favored 'Cis proline' 0 N--CA 1.464 -0.25 0 C-N-CA 123.58 -1.425 . . . . 67.23 110.182 -7.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.86 -41.97 99.77 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 119.476 -1.345 . . . . 67.47 112.086 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' THR . . . . . . . . . . . . . 52.2 m -133.94 137.57 44.95 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.278 -1.008 . . . . 67.99 108.278 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' LEU . . . . . . . . . . . . . 60.6 tp -124.17 124.0 41.52 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.864 -1.162 . . . . 69.78 107.864 -177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -117.41 104.01 10.68 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.634 -0.506 . . . . 67.97 109.634 -168.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 mp -131.44 162.12 30.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.912 0.863 . . . . 65.24 110.484 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' SER . . . . . . . . . . . . . 27.1 t -80.66 153.35 73.21 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 114.516 -1.22 . . . . 75.21 110.563 173.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 15' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -66.0 139.11 55.04 Favored 'Trans proline' 0 C--N 1.332 -0.298 0 CA-C-O 121.329 0.471 . . . . 68.65 111.621 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.91 -16.14 61.46 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.612 -0.722 . . . . 69.65 114.215 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 17' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -87.4 157.98 19.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.367 1.467 . . . . 112.09 109.893 -176.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 18' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -85.62 141.61 29.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.867 -0.606 . . . . 86.03 110.789 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 19' ' ' ALA . . . . . . . . . . . . . . . -114.48 135.52 54.02 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.063 -0.517 . . . . 51.0 110.037 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 20' ' ' THR . . . . . 0.705 ' N ' ' O ' ' L' ' 404' ' ' HOH . 1.7 m -123.52 120.87 34.15 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.068 -0.716 . . . . 61.2 109.068 176.342 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.15 140.18 51.5 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.795 -0.817 . . . . 47.66 108.795 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 22' ' ' SER . . . . . . . . . . . . . 1.3 t -120.85 147.7 45.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.383 0.611 . . . . 61.76 111.08 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 23' ' ' CYS . . . . . . . . . . . . . 51.3 t -136.8 112.83 9.69 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.702 -1.592 . . . . 79.19 106.702 179.58 -178.216 114.167 71.018 106.078 2.055 106.576 157.761 62.081 1 1 . 1 . 001 ecloud orig full ' L' L ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -108.12 133.18 52.76 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.784 -0.821 . . . . 73.97 108.784 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.07 145.18 29.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.311 0.577 . . . . 67.09 110.657 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -65.21 -36.4 84.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.59 -0.732 . . . . 70.23 111.061 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -131.77 170.8 14.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.896 -0.779 . . . . 87.26 108.896 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 28' ' ' SER . . . . . . . . . . . . . 42.6 t -76.12 133.41 40.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.858 -0.61 . . . . 77.07 111.218 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 t -89.33 84.94 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 105.684 -1.969 . . . . 76.6 105.684 171.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.21 74.77 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.377 -0.916 . . . . 62.96 113.546 -173.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 31' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -14.32 59.81 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.117 0.784 . . . . 71.68 113.117 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 32' ' ' SER . . . . . . . . . . . . . 3.1 m 61.32 25.78 15.7 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.573 0.749 . . . . 52.48 111.373 -170.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 33' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.59 68.01 2.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 122.451 1.119 . . . . 66.36 108.985 173.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.72 131.8 54.72 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.109 -0.95 . . . . 69.85 109.528 179.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 35' ' ' ALA . . . . . . . . . . . . . . . -119.37 152.59 36.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.007 0.523 . . . . 47.17 110.342 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 36' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -118.79 137.63 53.25 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.082 -0.71 . . . . 50.75 109.082 170.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -125.81 144.51 50.62 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.916 0.389 . . . . 57.03 110.234 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 38' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -105.09 136.77 43.96 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.129 -0.693 . . . . 55.12 109.129 173.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 39' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -128.47 103.42 7.12 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.289 -1.374 . . . . 63.37 107.289 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 40' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -73.86 151.65 88.78 Favored Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.108 -0.496 . . . . 68.59 109.74 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 41' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.45 118.86 4.4 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 120.678 0.918 . . . . 74.38 113.86 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.69 21.06 64.63 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.38 0.912 . . . . 62.8 115.38 176.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 43' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -133.12 159.23 40.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.379 1.089 . . . . 98.09 109.932 -177.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.95 150.61 90.44 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-N 115.089 -0.96 . . . . 68.24 109.665 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 45' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -65.66 159.09 49.96 Favored 'Trans proline' 0 C--N 1.332 -0.323 0 CA-C-O 122.01 0.754 . . . . 66.22 112.053 -177.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 46' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -128.63 139.27 52.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.954 -1.021 . . . . 71.86 109.217 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 47' ' ' LEU . . . . . . . . . . . . . 61.3 tp -68.16 132.9 48.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 56.85 110.128 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 48' ' ' LEU . . . . . . . . . . . . . 80.2 mt -110.54 -54.32 2.6 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.543 0.571 . . . . 56.9 112.543 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 49' ' ' ILE . . . . . . . . . . . . . 13.2 mm -128.8 138.1 55.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.11 -1.07 . . . . 50.83 108.11 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 50' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -130.53 164.29 25.19 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.016 -0.735 . . . . 68.28 109.016 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.97 18.6 4.54 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.771 -0.65 . . . . 53.75 113.552 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 52' ' ' ALA . . . . . . . . . . . . . . . 73.79 -8.03 1.48 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.338 2.255 . . . . 59.83 113.918 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 53' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -144.15 3.22 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.873 1.064 . . . . 55.37 113.873 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -100.81 123.48 45.07 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 119.143 0.883 . . . . 53.69 109.895 -171.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 55' ' ' ARG . . . . . . . . . . . . . 41.5 ttm105 -77.01 131.87 38.68 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.173 -0.467 . . . . 86.05 110.099 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.06 158.37 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.904 0.859 . . . . 58.93 110.608 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 57' ' ' THR . . . . . . . . . . . . . 7.6 m -62.69 133.09 54.31 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.509 -0.769 . . . . 70.61 110.164 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 22.53 72.6 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 115.59 0.996 . . . . 70.32 115.59 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 59' ' ' ILE . . . . . . . . . . . . . 15.9 mm -103.3 131.29 22.23 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 118.485 1.142 . . . . 69.66 108.068 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 155.78 11.06 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 120.51 0.807 . . . . 76.73 113.249 178.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 61' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.54 -16.91 61.76 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.295 0.85 . . . . 119.47 113.295 -172.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 62' ' ' ARG . . . . . . . . . . . . . 31.7 ptt-85 -75.23 -15.02 60.57 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.748 0.647 . . . . 66.24 112.748 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -85.35 139.61 31.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.684 -0.487 . . . . 65.37 109.684 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 64' ' ' SER . . . . . . . . . . . . . 35.7 p -161.03 145.27 13.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.65 -0.87 . . . . 70.45 108.65 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 65' ' ' GLY . . . . . . . . . . . . . . . -120.93 152.65 16.77 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.707 -0.957 . . . . 48.02 110.707 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 66' ' ' SER . . . . . . . . . . . . . 51.8 p -157.26 166.36 33.36 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.342 -0.984 . . . . 62.65 108.342 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.88 178.33 19.62 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-O 122.337 0.965 . . . . 48.97 111.768 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 68' ' ' SER . . . . . . . . . . . . . 80.2 p -172.47 166.99 5.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 107.837 -1.171 . . . . 57.87 107.837 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.97 -110.06 3.1 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.374 -0.83 . . . . 58.91 112.646 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 70' ' ' THR . . . . . . . . . . . . . 73.3 p -108.39 -0.78 20.42 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.35 0.87 . . . . 62.03 113.35 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 71' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.15 121.8 23.1 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.012 0.824 . . . . 68.69 110.195 -173.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 72' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -129.76 149.43 51.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.286 -0.635 . . . . 50.55 109.286 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 73' ' ' THR . . . . . . . . . . . . . 92.6 m -134.04 140.86 46.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.728 -0.669 . . . . 48.98 110.37 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 74' ' ' LEU . . . . . . . . . . . . . 24.5 tp -113.18 130.61 56.16 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.502 -0.925 . . . . 57.24 108.502 170.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 75' ' ' THR . . . . . . . . . . . . . 28.0 m -118.7 125.61 50.06 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.103 -0.703 . . . . 62.95 109.103 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 76' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.63 111.65 36.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 106.17 -1.789 . . . . 59.92 106.17 171.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 77' ' ' SER . . . . . . . . . . . . . 51.8 p -78.28 -29.66 48.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.323 -0.951 . . . . 89.15 112.729 -165.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 -143.71 100.78 3.65 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.023 -1.473 . . . . 96.36 107.023 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.4 111.99 3.32 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.617 -0.512 . . . . 69.64 109.617 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 80' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -83.33 162.74 52.95 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 109.35 -0.611 . . . . 97.61 109.35 168.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 81' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -54.99 -36.96 93.8 Favored 'Trans proline' 0 C--O 1.237 0.433 0 N-CA-C 113.203 0.424 . . . . 72.45 113.203 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 82' ' ' GLU . . . . . 0.673 ' OE1' ' O ' ' L' ' 402' ' ' HOH . 2.0 pt-20 -67.54 -13.21 61.86 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.268 0.84 . . . . 101.26 113.268 178.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 83' ' ' ASP . . . . . 0.422 ' O ' ' OH ' ' L' ' 87' ' ' TYR . 73.8 m-20 -85.53 -6.01 59.23 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.557 0.947 . . . . 74.64 113.557 -174.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 84' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.56 90.12 7.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 122.051 0.929 . . . . 67.01 108.87 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 85' ' ' ALA . . . . . . . . . . . . . . . -142.31 -166.14 2.18 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.648 -1.241 . . . . 49.24 107.648 -172.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 86' ' ' VAL . . . . . . . . . . . . . 9.4 t -107.94 142.34 20.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.77 -1.196 . . . . 54.75 107.77 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 87' ' ' TYR . . . . . 0.422 ' OH ' ' O ' ' L' ' 83' ' ' ASP . 89.3 m-85 -123.03 132.22 54.03 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.729 -0.471 . . . . 55.73 109.729 -177.071 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 88' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -114.09 139.49 49.27 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.265 0.626 . . . . 55.66 110.157 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 89' ' ' CYS . . . . . . . . . . . . . 29.2 p -99.46 157.0 16.73 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.617 -0.883 . . . . 83.8 108.617 166.356 62.081 157.761 71.018 106.576 2.055 106.078 114.167 -178.216 1 1 . 1 . 001 ecloud orig full ' L' L ' 90' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -152.9 135.92 15.56 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.567 -0.742 . . . . 61.14 109.367 -173.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 91' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -98.7 128.31 44.92 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.565 -0.902 . . . . 89.67 108.565 166.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 92' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -119.72 -177.86 3.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.618 0.723 . . . . 63.69 109.692 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.96 -10.1 69.6 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 115.671 1.028 . . . . 78.42 115.671 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 94' ' ' SER . . . . . . . . . . . . . 83.6 p -154.18 -165.18 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.972 1.386 . . . . 100.26 108.977 -168.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 95' ' ' SER . . . . . . . . . . . . . 14.5 m -46.82 -65.11 0.76 Allowed Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 116.125 1.898 . . . . 99.42 116.125 -146.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 96' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -97.86 -5.35 1.02 Allowed 'Trans proline' 0 C--N 1.354 0.828 0 CA-C-N 121.381 1.529 . . . . 81.07 115.305 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 97' ' ' TRP . . . . . . . . . . . . . 32.3 m-90 47.69 51.68 13.68 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.626 0.727 . . . . 75.69 111.201 -167.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 98' ' ' THR . . . . . . . . . . . . . 77.0 m -65.32 145.81 55.72 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.589 0.709 . . . . 75.75 111.792 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 99' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -108.12 153.16 23.55 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.964 0.905 . . . . 54.51 110.216 176.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.77 169.45 54.41 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.929 -0.868 . . . . 58.63 110.929 164.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 101' ' ' GLN . . . . . 0.715 ' NE2' ' O ' ' L' ' 403' ' ' HOH . 10.3 pm0 -81.15 -15.45 55.8 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.825 -0.75 . . . . 74.06 112.873 -176.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.42 144.55 12.66 Favored Glycine 0 C--O 1.237 0.343 0 CA-C-N 118.387 0.54 . . . . 55.6 113.73 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 103' ' ' THR . . . . . . . . . . . . . 24.5 m -120.91 129.5 53.5 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.749 0.82 . . . . 55.84 108.799 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -104.48 128.0 52.31 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.455 -0.572 . . . . 76.62 109.455 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 105' ' ' VAL . . . . . . . . . . . . . 23.5 t -104.32 111.01 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.475 -1.306 . . . . 63.53 107.475 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 106' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -112.28 165.34 12.27 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.705 0.765 . . . . 103.9 110.262 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 107' ' ' ILE . . . . . . . . . . . . . 6.4 mt -82.51 131.24 34.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.29 -0.868 . . . . 80.92 109.78 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 108' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -91.62 133.67 35.36 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.73 -0.471 . . . . 72.1 109.73 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 109' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -137.97 177.14 8.1 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.311 -0.996 . . . . 62.46 108.311 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -76.32 154.99 34.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.784 0.802 . . . . 74.33 110.33 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 111' ' ' VAL . . . . . . . . . . . . . 73.2 t -56.31 138.11 17.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 CA-C-N 115.124 -0.944 . . . . 73.96 110.604 -175.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 112' ' ' ALA . . . . . . . . . . . . . . . -129.58 127.44 40.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.705 -0.85 . . . . 63.79 108.705 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 113' ' ' ALA . . . . . . . . . . . . . . . -83.51 138.78 41.24 Favored Pre-proline 0 C--O 1.234 0.265 0 O-C-N 123.319 0.387 . . . . 66.09 110.333 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 114' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.74 146.81 34.27 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 C-N-CA 120.274 0.649 . . . . 63.73 112.389 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 115' ' ' SER . . . . . . . . . . . . . 13.9 m -87.61 125.43 34.36 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.905 -1.146 . . . . 72.97 107.905 167.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 116' ' ' VAL . . . . . . . . . . . . . 19.8 t -104.51 135.39 42.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 109.882 -0.414 . . . . 59.8 109.882 -171.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 117' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -135.3 144.03 46.54 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.604 -0.887 . . . . 56.0 108.604 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 118' ' ' ILE . . . . . . . . . . . . . 19.8 tt -119.36 144.45 27.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.491 -0.929 . . . . 62.42 108.491 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 119' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -127.67 121.33 22.12 Favored Pre-proline 0 C--O 1.249 1.048 0 N-CA-C 109.039 -0.726 . . . . 58.09 109.039 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 120' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.71 155.24 58.91 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 120.632 0.888 . . . . 56.96 110.735 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 121' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -61.2 143.65 98.59 Favored 'Trans proline' 0 C--N 1.331 -0.342 0 N-CA-C 110.661 -0.553 . . . . 60.67 110.661 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 122' ' ' SER . . . . . . . . . . . . . 99.2 p -77.63 157.36 30.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.944 0.878 . . . . 57.78 110.674 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 123' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -59.46 -34.96 73.19 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.117 -0.947 . . . . 101.99 111.47 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -64.47 -42.23 96.03 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.4 -0.52 . . . . 75.91 110.872 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 125' ' ' GLN . . . . . 0.904 ' OE1' ' O ' ' L' ' 401' ' ' HOH . 34.6 tt0 -63.99 -43.89 94.32 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.581 -0.847 . . . . 61.15 111.132 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 126' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.24 -37.09 81.81 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.389 -0.524 . . . . 66.53 111.392 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 127' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -64.91 -22.64 67.03 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.309 0.485 . . . . 81.64 112.309 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 128' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' L' ' 125' ' ' GLN . 10.0 p -89.61 -8.26 52.95 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.99 0.737 . . . . 77.24 112.99 176.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 129' ' ' GLY . . . . . . . . . . . . . . . 99.32 8.96 52.3 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 116.927 1.531 . . . . 80.32 116.927 174.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -122.17 165.59 15.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.897 1.349 . . . . 76.73 109.64 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.03 118.61 10.39 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.57 -0.9 . . . . 67.39 108.57 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 132' ' ' SER . . . . . . . . . . . . . 73.1 m -121.33 127.49 51.33 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.799 -0.815 . . . . 67.31 108.799 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -109.01 134.56 50.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.474 -1.306 . . . . 63.32 107.474 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 134' ' ' VAL . . . . . . . . . . . . . 95.9 t -124.23 130.58 73.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.271 -0.64 . . . . 57.72 109.271 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 135' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.72 133.42 55.86 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.61 -1.256 . . . . 93.04 107.61 173.349 -174.099 117.75 60.024 106.698 2.05 106.109 155.248 66.548 1 1 . 1 . 001 ecloud orig full ' L' L ' 136' ' ' LEU . . . . . . . . . . . . . 7.0 tp -117.54 128.17 54.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.883 -0.414 . . . . 63.81 109.883 -176.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 137' ' ' LEU . . . . . . . . . . . . . 11.0 mp -105.57 113.48 27.08 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.099 -1.445 . . . . 62.47 107.099 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 138' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -107.26 124.27 49.52 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.746 -0.206 . . . . 56.43 110.838 -168.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 139' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 58.11 63.84 1.66 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.983 0.913 . . . . 74.68 112.207 164.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 140' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -120.5 160.48 23.07 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.473 -0.785 . . . . 60.78 110.824 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 141' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -155.01 138.25 10.71 Favored Pre-proline 0 C--O 1.24 0.574 0 N-CA-C 107.267 -1.383 . . . . 68.57 107.267 175.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 142' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.56 -171.41 9.84 Favored 'Cis proline' 0 CA--C 1.531 0.327 0 N-CA-C 113.898 0.691 . . . . 53.4 113.898 1.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 143' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -73.5 -27.33 61.32 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 123.583 0.552 . . . . 77.42 112.335 -167.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 144' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -70.71 122.18 19.34 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 122.055 -0.403 . . . . 105.42 110.168 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 145' ' ' ALA . . . . . . . . . . . . . . . -143.69 167.75 21.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.645 -1.243 . . . . 71.16 107.645 170.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 146' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.96 138.53 40.69 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.721 -0.844 . . . . 92.94 108.721 173.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 147' ' ' VAL . . . . . . . . . . . . . 69.8 t -125.29 120.29 57.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 107.975 -1.12 . . . . 63.91 107.975 -176.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 148' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -109.09 137.62 46.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.827 0.346 . . . . 111.71 110.355 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 149' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -102.26 138.61 38.97 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.808 -0.633 . . . . 73.41 109.841 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 150' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -132.34 116.29 16.67 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.028 -0.73 . . . . 84.64 109.028 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 151' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.43 105.76 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 106.494 -1.669 . . . . 67.15 106.494 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 152' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 54.72 49.78 17.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.882 0.848 . . . . 113.91 111.068 -172.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 153' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.21 33.87 23.57 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.115 -0.948 . . . . 94.14 111.709 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 154' ' ' ALA . . . . . 0.461 ' O ' ' NE2' ' L' ' 156' ' ' GLN . . . -118.46 121.83 41.25 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.709 -1.219 . . . . 76.47 107.709 173.139 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.3 124.09 25.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.903 -0.589 . . . . 88.81 110.246 -170.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 156' ' ' GLN . . . . . 0.461 ' NE2' ' O ' ' L' ' 154' ' ' ALA . 66.0 mm-40 -85.48 163.74 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.47 0.652 . . . . 64.04 110.345 178.075 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 157' ' ' SER . . . . . . . . . . . . . 13.4 t -167.7 136.5 2.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.541 -0.754 . . . . 64.24 109.306 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 158' ' ' GLY . . . . . . . . . . . . . . . 80.58 2.36 89.66 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 115.442 0.937 . . . . 56.44 115.442 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 159' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -126.14 23.87 7.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.71 1.255 . . . . 71.56 111.858 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 160' ' ' SER . . . . . . . . . . . . . 25.1 p -128.91 150.9 50.17 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.185 -0.672 . . . . 68.58 109.185 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 161' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -130.87 149.56 52.44 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.943 -0.762 . . . . 94.16 108.943 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -134.77 140.01 45.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.849 -0.614 . . . . 96.5 110.304 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 163' ' ' SER . . . . . . . . . . . . . 1.2 t -127.61 147.83 50.36 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.841 -1.17 . . . . 65.36 107.841 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 164' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.5 136.34 60.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.346 -0.612 . . . . 48.82 109.346 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 165' ' ' THR . . . . . . . . . . . . . 18.9 p -70.53 162.86 28.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.849 0.833 . . . . 63.67 109.951 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 166' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -77.7 165.91 23.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 118.669 -1.212 . . . . 91.58 108.997 166.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 167' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -59.05 127.43 32.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 66.5 110.525 -174.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 168' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.16 145.07 52.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.698 0.761 . . . . 86.96 110.726 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.82 -28.9 44.49 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.473 -0.785 . . . . 96.03 112.228 -176.869 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 170' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -87.15 -37.66 17.14 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 119.749 -0.78 . . . . 94.47 112.856 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 171' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -133.03 6.58 3.93 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.403 0.89 . . . . 91.96 113.403 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 172' ' ' SER . . . . . . . . . . . . . 40.6 m 57.05 32.56 21.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.087 0.773 . . . . 64.12 113.087 170.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 173' ' ' THR . . . . . . . . . . . . . 71.0 p -100.84 178.39 4.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 122.094 0.95 . . . . 58.36 109.825 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 174' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -121.49 155.65 34.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.275 -0.875 . . . . 69.88 109.487 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 175' ' ' SER . . . . . . . . . . . . . 7.7 m -126.94 149.1 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.235 -0.893 . . . . 59.28 108.8 170.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 176' ' ' LEU . . . . . . . . . . . . . 7.7 tt -136.89 139.18 41.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.492 -0.777 . . . . 51.92 109.041 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 177' ' ' SER . . . . . . . . . . . . . 4.8 p -123.44 133.51 54.05 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.029 -0.73 . . . . 61.35 109.029 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 178' ' ' SER . . . . . . . . . . . . . 14.3 t -120.0 134.19 55.32 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.882 -0.784 . . . . 68.45 108.882 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 179' ' ' THR . . . . . . . . . . . . . 7.4 m -124.62 113.3 17.85 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.519 -0.919 . . . . 68.46 108.519 -174.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 180' ' ' LEU . . . . . . . . . . . . . 59.2 tp -89.49 126.97 35.79 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 109.677 -0.49 . . . . 66.2 109.677 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 181' ' ' THR . . . . . . . . . . . . . 20.7 m -101.44 122.26 43.45 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.433 -0.581 . . . . 61.2 109.433 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 182' ' ' LEU . . . . . . . . . . . . . 16.7 mt -127.72 154.81 44.9 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.868 -0.79 . . . . 69.64 108.868 173.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 183' ' ' SER . . . . . . . . . . . . . 24.7 p -68.83 148.9 49.59 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 119.194 -1.002 . . . . 68.73 108.781 165.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 184' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -55.28 -40.32 70.89 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.041 -0.663 . . . . 66.37 110.996 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 185' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.59 86.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.647 -0.421 . . . . 74.84 111.272 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 186' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.84 -44.87 88.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.495 -0.482 . . . . 108.62 111.543 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 187' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.54 -35.27 73.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.584 -0.447 . . . . 69.99 111.269 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 188' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.45 -13.15 60.37 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.25 0.833 . . . . 86.02 113.25 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 189' ' ' LYS . . . . . . . . . . . . . 35.4 mttp -85.06 -35.92 21.54 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.742 0.701 . . . . 111.65 112.863 -177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 190' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -106.38 157.86 17.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.515 0.674 . . . . 81.19 111.089 -172.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 191' ' ' LYS . . . . . . . . . . . . . 2.2 ptpt -99.54 -55.76 2.58 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.14 0.792 . . . . 109.64 113.14 -169.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 192' ' ' VAL . . . . . . . . . . . . . 4.7 t -101.62 126.04 55.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 74.48 109.508 -166.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 193' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -120.34 123.74 43.85 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.726 -0.842 . . . . 64.4 108.726 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 194' ' ' ALA . . . . . . . . . . . . . . . -134.87 145.97 48.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.117 0.567 . . . . 66.71 109.751 -177.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -116.61 132.98 56.54 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.795 -1.187 . . . . 94.53 107.795 167.562 66.548 155.248 60.024 106.109 2.05 106.698 117.75 -174.099 1 1 . 1 . 001 ecloud orig full ' L' L ' 196' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -114.62 123.28 48.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.377 -0.972 . . . . 108.4 108.377 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 197' ' ' VAL . . . . . . . . . . . . . 56.1 t -113.81 132.25 63.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.016 -0.735 . . . . 66.13 109.016 -172.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 198' ' ' THR . . . . . . . . . . . . . 2.5 m -118.31 127.52 53.78 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.773 -0.825 . . . . 75.29 108.773 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 199' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -149.42 151.84 34.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.21 -0.663 . . . . 78.76 109.21 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 200' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.56 -41.92 22.48 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.236 -0.893 . . . . 100.45 112.303 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 201' ' ' GLY . . . . . . . . . . . . . . . -76.65 -5.56 83.42 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 115.796 1.078 . . . . 69.5 115.796 -176.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 202' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.73 129.81 46.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.052 0.926 . . . . 78.93 109.567 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 203' ' ' SER . . . . . . . . . . . . . 3.2 t -65.11 -47.31 77.61 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.526 -0.87 . . . . 96.65 111.523 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 204' ' ' SER . . . . . . . . . . . . . 1.7 p -131.2 157.08 79.13 Favored Pre-proline 0 C--O 1.233 0.214 0 C-N-CA 125.929 1.691 . . . . 110.06 108.912 171.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 205' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -58.68 131.41 42.15 Favored 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-O 121.581 0.575 . . . . 83.92 113.198 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 206' ' ' VAL . . . . . . . . . . . . . 2.8 t -87.67 131.91 34.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.778 -0.823 . . . . 72.43 108.778 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 207' ' ' THR . . . . . . . . . . . . . 32.0 m -119.03 124.8 47.83 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.281 -0.637 . . . . 86.12 109.281 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 208' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -114.79 135.25 54.38 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.764 -1.198 . . . . 75.57 107.764 172.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 209' ' ' SER . . . . . . . . . . . . . 58.9 p -144.6 173.84 11.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.015 0.912 . . . . 62.02 110.645 -172.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 210' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -159.38 147.1 17.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.506 -1.224 . . . . 68.46 107.929 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 211' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -96.94 139.07 33.51 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.224 -0.658 . . . . 87.9 109.224 171.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 212' ' ' ARG . . . . . . . . . . . . . 44.5 ttp85 -64.14 141.48 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.368 0.604 . . . . 83.52 111.029 -172.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 213' ' ' GLY . . . . . . . . . . . . . . . 75.2 24.09 72.24 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 115.152 0.821 . . . . 115.62 115.152 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 214' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 118.222 1.011 . . . . 129.96 110.725 178.054 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 401' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' H' ' 103' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 402' ' ' HOH . . . . . 0.709 ' O ' ' OD1' ' H' ' 90' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 403' ' ' HOH . . . . . 0.621 ' O ' ' OE1' ' H' ' 46' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 404' ' ' HOH . . . . . 0.476 ' O ' ' N ' ' H' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 405' ' ' HOH . . . . . 0.538 ' O ' ' NE ' ' H' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 401' ' ' HOH . . . . . 0.904 ' O ' ' OE1' ' L' ' 125' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 402' ' ' HOH . . . . . 0.673 ' O ' ' OE1' ' L' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 403' ' ' HOH . . . . . 0.715 ' O ' ' NE2' ' L' ' 101' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 404' ' ' HOH . . . . . 0.705 ' O ' ' N ' ' L' ' 20' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 1' ' ' GLN . . . . . 0.404 ' HB2' ' H ' ' H' ' 2' ' ' VAL . 10.5 mt-30 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 121.59 0.71 . . . . 105.95 111.304 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 2' ' ' VAL . . . . . 0.404 ' H ' ' HB2' ' H' ' 1' ' ' GLN . 7.7 t -88.75 120.2 37.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.918 -1.141 . . . . 86.66 107.918 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 3' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -127.13 142.79 51.42 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.847 0.356 . . . . 102.52 110.285 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 18.1 mt -119.44 127.62 53.25 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.946 -1.131 . . . . 61.93 107.946 171.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -126.33 124.68 66.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 109.037 -0.727 . . . . 70.11 109.037 -172.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -110.07 146.05 36.05 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.62 0.768 . . . . 82.71 110.529 -173.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -132.16 -25.49 2.0 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 115.897 1.814 . . . . 88.43 115.897 -166.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 8' ' ' GLY . . . . . . . . . . . . . . . -90.04 7.23 82.01 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 119.358 2.503 . . . . 72.04 119.358 -159.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.21 170.94 33.26 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 119.85 1.825 . . . . 81.58 113.626 -171.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.72 -172.56 40.47 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.816 -0.707 . . . . 66.46 112.074 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 11' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' H' ' 115' ' ' THR . 78.5 t -114.64 128.15 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 124.021 0.928 . . . . 53.09 108.501 -178.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 12' ' ' VAL . . . . . . . . . . . . . 29.3 m -144.61 159.19 14.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 121.847 0.832 . . . . 53.04 110.013 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -76.88 155.46 82.92 Favored Pre-proline 0 N--CA 1.454 -0.266 0 CA-C-N 115.014 -0.994 . . . . 57.53 111.115 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 14' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.37 156.26 52.46 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 CA-C-O 121.98 0.742 . . . . 51.71 111.516 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.67 -2.83 77.44 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 114.917 -1.038 . . . . 52.3 115.693 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -96.36 -175.7 3.42 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.869 1.335 . . . . 71.71 111.475 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' SER . . . . . . . . . . . . . 27.4 m -117.13 156.96 26.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.352 -0.84 . . . . 61.32 110.519 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -164.66 129.66 2.67 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.631 -1.248 . . . . 67.3 107.631 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 19' ' ' ARG . . . . . . . . . . . . . 25.0 ttp180 -109.91 123.78 50.2 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.192 0.307 . . . . 89.41 110.383 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 84.0 mt -96.12 145.53 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.723 -0.843 . . . . 50.55 108.723 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' SER . . . . . . . . . . . . . 3.4 p -129.11 148.33 51.05 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.877 -0.786 . . . . 75.22 108.877 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' CYS . . . . . . . . . . . . . 15.3 t -134.46 103.03 5.53 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 106.642 -1.614 . . . . 84.73 106.642 -179.83 170.126 130.364 63.111 107.471 2.052 106.003 173.166 56.968 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.2 131.49 34.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.466 -0.568 . . . . 76.92 109.466 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ALA . . . . . . . . . . . . . . . -120.57 143.28 48.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.287 -0.415 . . . . 68.09 110.349 -173.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 33.4 p -150.97 169.37 21.95 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.661 -0.866 . . . . 88.84 108.661 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.5 -0.3 88.32 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 115.691 1.037 . . . . 77.46 115.691 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -153.91 170.81 20.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.609 1.204 . . . . 78.45 108.717 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' THR . . . . . . . . . . . . . 32.0 m -78.57 104.86 9.46 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.999 -1.112 . . . . 81.71 107.999 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.27 -46.24 86.38 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.101 -0.499 . . . . 82.24 111.668 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' SER . . . . . . . . . . . . . 83.3 p -81.77 17.27 1.53 Allowed 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.2 0.815 . . . . 77.92 113.2 -169.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 1.1 m -107.28 -11.97 15.45 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.379 0.881 . . . . 91.54 113.379 174.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -113.57 155.2 25.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.611 0.719 . . . . 79.76 110.625 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 33' ' ' THR . . . . . . . . . . . . . 69.5 p -93.0 154.57 18.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.368 -0.833 . . . . 61.17 109.659 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 34' ' ' MET . . . . . 0.474 ' HB3' HD22 ' H' ' 79' ' ' LEU . 84.3 mmm -126.76 155.25 43.08 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.508 0.671 . . . . 74.03 110.822 -169.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -132.83 159.05 40.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.021 -0.99 . . . . 58.93 110.676 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 36' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -112.88 132.97 55.08 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.915 -1.143 . . . . 54.14 107.915 160.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 90.4 t -130.75 133.18 63.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.614 -1.254 . . . . 60.43 107.614 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -122.08 156.36 33.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.976 0.893 . . . . 62.04 110.925 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -141.21 110.23 6.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.478 -1.237 . . . . 54.77 107.994 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.74 161.12 73.73 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 110.084 -0.339 . . . . 50.99 110.084 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.8 120.43 8.3 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 120.12 0.547 . . . . 64.04 112.208 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.19 10.35 73.8 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 115.203 0.841 . . . . 66.43 115.203 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -118.77 178.6 4.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.239 1.02 . . . . 98.76 109.785 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.81 -170.51 35.47 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-O 122.576 1.098 . . . . 79.95 112.967 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' LEU . . . . . . . . . . . . . 30.2 mt -92.33 147.69 22.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.489 -0.856 . . . . 58.22 110.352 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' GLU . . . . . 0.621 ' OE1' ' O ' ' H' ' 403' ' ' HOH . 31.4 tt0 -142.38 121.43 12.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.147 -0.686 . . . . 89.3 109.147 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 47' ' ' TRP . . . . . . . . . . . . . 69.6 t90 -63.18 138.12 58.44 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.18 0.514 . . . . 57.61 110.309 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 88.4 t -110.89 -58.96 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.816 -0.629 . . . . 52.89 111.207 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 49' ' ' THR . . . . . 0.526 HG23 HD12 ' H' ' 70' ' ' ILE . 4.7 t -157.41 156.92 33.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.479 0.657 . . . . 56.34 109.709 -172.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -132.74 145.09 50.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 114.853 -1.067 . . . . 59.82 109.075 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 51' ' ' ILE . . . . . . . . . . . . . 18.6 tt -139.5 140.33 37.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 108.753 -0.832 . . . . 65.15 108.753 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' SER . . . . . . . . . . . . . 12.5 p -82.78 -171.37 3.49 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.731 0.777 . . . . 74.13 109.344 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -53.69 7.3 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.685 -0.634 . . . . 84.03 110.366 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 54' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' H' ' 54' ' ' ASP . 0.0 OUTLIER -48.35 -51.4 26.44 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.015 0.436 . . . . 98.13 111.293 175.097 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . 111.05 1.15 28.46 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-O 119.3 -0.722 . . . . 86.11 113.364 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' H' ' 54' ' ' ASP . 8.9 m120 -94.12 1.73 56.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.042 0.921 . . . . 103.83 113.21 -172.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 57' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -134.34 108.73 8.36 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.371 -0.974 . . . . 91.45 108.371 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -120.82 131.41 54.43 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.325 -0.991 . . . . 82.49 108.325 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -126.73 145.8 50.46 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.291 -0.633 . . . . 103.26 109.291 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -135.94 138.05 41.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 115.995 -0.548 . . . . 61.72 109.815 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.57 152.67 25.52 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.128 -0.629 . . . . 63.2 109.61 168.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -62.82 -27.3 69.22 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.135 -0.626 . . . . 91.58 111.532 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m -56.0 -28.96 59.49 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.337 0.495 . . . . 76.39 112.337 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 64' ' ' VAL . . . . . . . . . . . . . 25.1 m -128.13 -1.23 3.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 113.579 0.955 . . . . 61.71 113.579 -166.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' H' ' 65' ' ' LYS . 4.8 tptt -64.86 135.18 55.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.302 0.956 . . . . 87.29 110.344 -179.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.57 -7.98 80.51 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-O 119.219 -0.767 . . . . 70.36 114.809 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -127.9 -27.24 2.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.135 0.967 . . . . 61.73 111.312 -176.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -111.96 141.06 46.08 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.747 -0.464 . . . . 70.75 109.747 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' THR . . . . . . . . . . . . . 16.0 m -128.8 113.06 14.83 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.391 -0.596 . . . . 82.32 109.391 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' ILE . . . . . 0.526 HD12 HG23 ' H' ' 49' ' ' THR . 17.9 tt -87.06 143.6 11.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.524 -0.917 . . . . 65.46 108.524 173.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' SER . . . . . . . . . . . . . 54.8 p -156.04 161.4 40.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.434 -0.951 . . . . 64.31 108.434 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 72' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -142.11 144.48 33.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.582 -0.735 . . . . 80.7 109.262 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -121.41 106.67 11.65 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 107.27 -1.382 . . . . 107.81 107.27 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -73.39 -26.9 61.19 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.225 -0.59 . . . . 91.54 111.808 -177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' SER . . . . . . . . . . . . . 30.2 p -67.13 -17.34 64.82 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.307 -0.557 . . . . 91.55 112.364 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 76' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -115.85 0.81 13.24 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.008 0.744 . . . . 92.36 113.008 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 58.49 52.79 6.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.601 0.715 . . . . 78.2 111.094 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 78' ' ' THR . . . . . . . . . . . . . 18.5 m -136.85 134.48 36.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.038 -0.528 . . . . 76.56 110.331 -175.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 79' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' H' ' 34' ' ' MET . 18.9 tp -102.11 140.62 36.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.151 -0.685 . . . . 62.09 109.151 169.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.72 147.12 48.8 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.31 0.576 . . . . 81.2 111.376 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LEU . . . . . . . . . . . . . 49.6 tp -129.77 108.65 10.33 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.127 -1.064 . . . . 57.93 108.127 167.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -86.92 115.53 24.38 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.119 -1.067 . . . . 65.02 108.119 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' MET . . . . . . . . . . . . . 6.6 mtm -103.79 123.87 47.86 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.288 -0.634 . . . . 63.27 109.288 -179.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 57.0 m-20 -124.7 162.45 24.16 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.544 -0.539 . . . . 61.31 109.544 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 85' ' ' SER . . . . . . . . . . . . . 62.1 m 47.28 52.47 12.08 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.889 0.852 . . . . 67.08 110.901 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 86' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.53 145.18 56.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.397 -0.819 . . . . 57.14 111.177 -172.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -122.34 157.44 31.78 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.163 0.985 . . . . 83.1 109.45 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.05 -39.99 69.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.569 -0.741 . . . . 54.04 111.294 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -63.29 -13.14 35.18 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.913 0.709 . . . . 105.68 112.913 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ASP . . . . . 0.709 ' OD1' ' O ' ' H' ' 402' ' ' HOH . 65.3 m-20 -76.7 -2.84 34.93 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.14 0.793 . . . . 86.51 113.14 174.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 91' ' ' THR . . . . . . . . . . . . . 16.5 m -67.11 115.04 6.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 118.052 0.387 . . . . 57.11 110.027 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' ALA . . . . . . . . . . . . . . . -168.68 167.21 11.45 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.125 -0.694 . . . . 53.61 109.125 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 89.3 mt -81.88 129.99 36.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.965 -1.124 . . . . 52.53 107.965 163.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -107.85 125.22 51.19 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.541 -0.54 . . . . 50.93 109.541 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 95' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -109.22 139.8 43.67 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.12 0.968 . . . . 58.08 110.143 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' CYS . . . . . . . . . . . . . 24.7 p -90.22 147.1 23.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.109 -1.071 . . . . 80.04 108.109 160.474 56.968 173.166 63.111 106.003 2.052 107.471 130.364 170.126 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.25 147.64 32.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.962 -0.563 . . . . 58.07 109.67 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -106.37 140.5 39.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.406 -0.816 . . . . 80.32 109.703 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' THR . . . . . . . . . . . . . 1.3 p -91.55 114.63 27.21 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.735 -0.839 . . . . 87.87 108.735 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 100' ' ' GLY . . . . . . . . . . . . . . . -56.87 164.48 5.85 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.051 -1.071 . . . . 65.5 111.422 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -54.59 -33.5 60.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.94 -0.704 . . . . 109.02 110.972 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.01 -21.19 33.95 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.127 0.788 . . . . 82.16 113.127 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' GLY . . . . . 0.762 ' O ' ' O ' ' H' ' 401' ' ' HOH . . . 135.21 -33.61 2.42 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 119.661 2.624 . . . . 63.8 119.661 168.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.03 -179.99 5.96 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 CA-C-N 119.683 1.741 . . . . 65.04 111.49 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -89.14 92.94 9.4 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 107.466 -1.309 . . . . 61.16 107.466 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.62 -23.35 29.6 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.841 1.052 . . . . 77.79 113.841 -170.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 107' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -137.44 130.78 31.0 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.914 0.779 . . . . 65.05 109.923 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 108' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -117.66 145.06 44.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.208 0.528 . . . . 53.22 110.368 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.02 -179.92 30.44 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 122.59 1.106 . . . . 55.26 110.756 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 pm0 -85.77 -23.15 27.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.836 -0.746 . . . . 55.47 112.806 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' GLY . . . . . . . . . . . . . . . 100.06 121.19 4.62 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 118.182 0.446 . . . . 64.54 114.047 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 112' ' ' THR . . . . . . . . . . . . . 1.4 p -102.77 138.94 39.0 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.175 -0.676 . . . . 71.88 109.175 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' LEU . . . . . . . . . . . . . 60.0 tp -86.96 135.65 33.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.921 -0.581 . . . . 53.75 109.819 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' VAL . . . . . . . . . . . . . 98.5 t -126.92 120.91 56.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.637 -1.246 . . . . 48.37 107.637 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 115' ' ' THR . . . . . 0.413 ' HB ' HG22 ' H' ' 11' ' ' VAL . 42.2 m -117.22 129.91 56.24 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.765 -0.828 . . . . 58.41 108.765 -179.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 116' ' ' VAL . . . . . . . . . . . . . 38.4 t -120.37 109.2 24.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 106.776 -1.564 . . . . 45.53 106.776 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' SER . . . . . . . . . . . . . 25.7 t -147.89 151.17 35.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.782 -0.821 . . . . 52.29 108.782 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' SER . . . . . . . . . . . . . 91.4 p -88.21 -1.65 58.14 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.652 -0.703 . . . . 51.45 112.316 176.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.77 160.47 31.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.95 0.881 . . . . 57.97 110.651 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' SER . . . . . . . . . . . . . 32.3 m -107.24 155.17 20.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.148 -0.933 . . . . 55.77 109.01 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' THR . . . . . . . . . . . . . 6.6 m -53.11 129.89 32.44 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.774 -0.648 . . . . 52.53 110.01 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -147.28 128.3 14.57 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.079 -0.51 . . . . 73.56 109.684 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.39 156.96 50.49 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.791 -0.923 . . . . 44.45 110.791 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . 0.522 ' HB3' ' HB3' ' H' ' 150' ' ' TYR . 86.7 Cg_endo -84.57 164.03 12.45 Favored 'Trans proline' 0 C--N 1.326 -0.619 0 CA-C-O 122.355 0.898 . . . . 54.87 112.452 -173.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 125' ' ' SER . . . . . . . . . . . . . 48.3 m -101.98 130.63 48.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.443 -1.253 . . . . 63.66 108.044 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 126' ' ' VAL . . . . . . . . . . . . . 75.8 t -114.75 122.82 69.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 51.57 108.523 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 127' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -124.63 144.9 47.72 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-N 116.199 -0.455 . . . . 51.08 109.981 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 128' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -81.49 143.36 13.62 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 CA-C-O 121.548 0.562 . . . . 60.2 111.892 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' LEU . . . . . . . . . . . . . 80.2 mt -102.41 94.91 5.93 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.274 -1.75 . . . . 52.28 106.274 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.89 145.42 81.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.776 -0.647 . . . . 66.0 110.805 -170.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -85.24 163.34 11.35 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 C-N-CA 121.352 1.368 . . . . 92.61 112.321 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 114.852 -1.067 . . . . 111.79 111.274 175.509 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 113.492 0.157 . . . . 88.31 113.492 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 140' ' ' THR . . . . . . . . . . . . . 1.4 t -114.54 146.26 40.95 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.376 0.608 . . . . 78.66 110.664 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.58 166.75 21.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.374 -0.83 . . . . 70.5 108.957 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 142' ' ' ALA . . . . . . . . . . . . . . . -134.13 144.27 48.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.744 -0.662 . . . . 60.76 109.57 -178.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 pp -150.01 153.72 36.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.503 -1.295 . . . . 68.77 107.503 175.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 144' ' ' GLY . . . . . . . . . . . . . . . -156.75 -167.92 18.66 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 118.431 -1.842 . . . . 52.78 114.255 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 145' ' ' CYS . . . . . . . . . . . . . 1.2 m -136.96 128.33 28.26 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 124.558 1.143 . . . . 92.27 111.339 -174.999 -97.939 173.054 -167.073 103.816 1.967 96.391 149.165 -155.384 1 1 . 1 . 001 ecloud build full ' H' H ' 146' ' ' LEU . . . . . . . . . . . . . 4.8 tp -96.63 111.73 23.76 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 107.532 -1.285 . . . . 56.2 107.532 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 147' ' ' VAL . . . . . . . . . . . . . 94.9 t -105.42 103.61 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 105.963 -1.866 . . . . 52.13 105.963 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 148' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -120.96 140.62 51.62 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.014 0.526 . . . . 58.56 112.069 -162.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 149' ' ' ASP . . . . . 0.436 ' OD1' ' NE2' ' H' ' 176' ' ' GLN . 69.7 m-20 58.97 63.03 1.72 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.32 1.048 . . . . 80.25 112.607 168.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 150' ' ' TYR . . . . . 0.522 ' HB3' ' HB3' ' H' ' 124' ' ' PRO . 53.2 p90 -123.47 161.15 25.41 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.529 -0.76 . . . . 55.17 110.323 172.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 151' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -162.86 135.61 4.27 Favored Pre-proline 0 C--O 1.239 0.525 0 N-CA-C 108.14 -1.059 . . . . 53.5 108.14 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -97.0 -171.98 2.77 Favored 'Cis proline' 0 N--CA 1.462 -0.373 0 C-N-CA 123.113 -1.62 . . . . 55.63 111.44 -0.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 153' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -63.41 156.84 68.21 Favored Pre-proline 0 N--CA 1.448 -0.571 0 N-CA-C 109.355 -0.609 . . . . 78.62 109.355 167.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 154' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -101.71 -172.58 1.66 Allowed 'Cis proline' 0 N--CA 1.462 -0.377 0 CA-C-O 122.531 0.971 . . . . 45.82 114.424 -4.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 155' ' ' VAL . . . . . . . . . . . . . 2.5 t -141.1 136.73 33.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 113.462 -1.699 . . . . 61.58 107.553 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' THR . . . . . . . . . . . . . 26.9 m -106.37 121.18 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.856 -0.794 . . . . 54.85 108.856 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 20.5 t -112.99 130.88 66.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.315 -0.995 . . . . 56.29 108.315 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 158' ' ' SER . . . . . . . . . . . . . 14.8 p -138.07 157.73 45.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.953 -1.129 . . . . 57.08 107.953 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -117.16 130.4 56.58 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.852 -0.613 . . . . 61.46 109.577 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 49.41 43.66 23.52 Favored 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.789 0.68 . . . . 61.2 110.903 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' SER . . . . . . . . . . . . . 19.0 m 60.26 40.97 17.22 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.623 -0.717 . . . . 59.65 111.537 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' GLY . . . . . . . . . . . . . . . 81.28 -3.17 78.83 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 115.263 0.865 . . . . 61.01 115.263 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.92 -7.88 54.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.55 1.175 . . . . 63.76 112.994 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' LEU . . . . . . . . . . . . . 40.2 tp -131.11 110.54 11.26 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.816 -1.179 . . . . 65.32 107.816 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 165' ' ' THR . . . . . . . . . . . . . 70.8 p -123.39 -37.08 2.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.972 0.73 . . . . 69.4 112.972 -177.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 166' ' ' SER . . . . . . . . . . . . . 6.2 t -63.17 122.57 16.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.828 0.347 . . . . 85.74 110.538 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 167' ' ' GLY . . . . . . . . . . . . . . . 94.8 1.33 63.58 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 115.382 0.913 . . . . 63.74 115.382 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 168' ' ' VAL . . . . . . . . . . . . . 69.0 t -86.8 129.29 38.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.706 1.253 . . . . 59.24 109.676 -173.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -123.32 114.31 20.03 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.182 -1.044 . . . . 66.77 108.182 172.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 170' ' ' THR . . . . . . . . . . . . . 98.1 m -106.36 112.51 25.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.587 -1.634 . . . . 55.34 106.587 171.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -77.96 152.07 79.55 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.062 -0.517 . . . . 53.01 111.037 -174.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.34 149.19 91.64 Favored 'Trans proline' 0 C--N 1.331 -0.359 0 CA-C-O 121.435 0.514 . . . . 51.8 110.82 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ALA . . . . . . . . . . . . . . . -76.46 134.85 39.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.663 -0.698 . . . . 53.63 110.507 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 174' ' ' VAL . . . . . . . . . . . . . 30.9 m -92.99 139.82 17.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.322 -0.992 . . . . 67.31 108.322 169.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' LEU . . . . . 0.472 HD23 ' O ' ' H' ' 176' ' ' GLN . 6.3 tt -83.34 128.5 34.56 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.971 -0.751 . . . . 79.13 108.971 175.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' GLN . . . . . 0.472 ' O ' HD23 ' H' ' 175' ' ' LEU . 30.5 mt-30 -94.52 167.71 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.805 0.812 . . . . 94.33 110.64 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 177' ' ' SER . . . . . . . . . . . . . 2.7 t -58.0 -24.57 58.7 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.713 -0.676 . . . . 78.95 112.585 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 178' ' ' SER . . . . . . . . . . . . . 44.3 p -74.73 -18.91 60.43 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.262 0.838 . . . . 77.18 113.262 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' GLY . . . . . . . . . . . . . . . 103.61 -14.8 53.57 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 118.747 0.703 . . . . 59.48 113.733 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' LEU . . . . . . . . . . . . . 14.1 mt -92.2 147.49 22.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.724 0.809 . . . . 47.58 110.94 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -88.93 160.02 17.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.274 -0.875 . . . . 48.09 110.332 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -145.52 150.9 37.28 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 107.511 -1.292 . . . . 70.03 107.511 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 183' ' ' LEU . . . . . . . . . . . . . 8.0 tt -154.89 156.34 35.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.142 -0.688 . . . . 55.68 109.142 -165.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' SER . . . . . . . . . . . . . 9.3 t -133.56 138.21 45.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.282 -0.872 . . . . 67.26 109.625 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 185' ' ' SER . . . . . . . . . . . . . 28.0 t -125.63 136.37 53.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.258 -1.016 . . . . 49.04 108.258 171.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' ' ' VAL . . . . . . . . . . . . . 29.4 m -135.35 166.99 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-O 121.815 0.817 . . . . 56.41 109.007 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 187' ' ' VAL . . . . . . . . . . . . . 7.3 p -155.27 136.11 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 107.526 -1.287 . . . . 58.11 107.526 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 188' ' ' THR . . . . . . . . . . . . . 13.4 p -92.77 146.7 23.44 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.293 -0.632 . . . . 52.56 109.293 172.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 189' ' ' VAL . . . . . . . . . . . . . 31.6 m -143.9 156.89 58.72 Favored Pre-proline 0 C--O 1.242 0.704 0 N-CA-C 108.886 -0.783 . . . . 67.31 108.886 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 190' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -53.87 120.75 8.4 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.558 -0.593 . . . . 83.51 110.558 167.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' SER . . . . . . . . . . . . . 23.4 t -59.57 -22.77 62.22 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.463 0.542 . . . . 93.52 112.463 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' SER . . . . . 0.476 ' N ' ' O ' ' H' ' 404' ' ' HOH . 77.8 p -65.86 -6.86 13.47 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.288 0.847 . . . . 72.62 113.288 176.933 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 193' ' ' SER . . . . . . . . . . . . . 81.0 p -102.31 -7.32 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.275 0.843 . . . . 73.89 113.275 -177.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 194' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.32 -25.72 67.32 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.409 0.55 . . . . 76.37 112.273 -173.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 195' ' ' GLY . . . . . . . . . . . . . . . -89.32 -19.24 50.57 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.669 -0.777 . . . . 94.38 113.941 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 196' ' ' THR . . . . . . . . . . . . . 41.8 p -114.88 -41.37 3.37 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.874 1.064 . . . . 93.32 113.874 -172.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -86.45 136.67 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.445 0.566 . . . . 79.67 110.206 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' THR . . . . . . . . . . . . . 9.0 m -93.77 135.05 35.47 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.155 -0.683 . . . . 68.2 109.155 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 199' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -120.49 110.17 16.16 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.825 -0.805 . . . . 60.34 108.825 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 200' ' ' ILE . . . . . . . . . . . . . 22.3 mt -114.52 121.49 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 121.515 0.674 . . . . 63.37 109.281 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 201' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.41 132.71 46.02 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.782 -1.099 . . . . 83.0 110.807 171.294 -155.384 149.165 -167.073 96.391 1.967 103.816 173.054 -97.939 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -118.36 121.93 41.58 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.397 -0.964 . . . . 51.42 108.397 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 203' ' ' VAL . . . . . . . . . . . . . 59.9 t -126.98 121.58 58.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 108.638 -0.875 . . . . 55.7 108.638 -175.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -121.0 127.94 52.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.742 0.817 . . . . 54.71 109.094 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 205' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -125.21 91.78 3.49 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 106.395 -1.705 . . . . 44.07 106.395 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 206' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -57.96 -37.93 61.14 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.528 1.307 . . . . 78.44 114.528 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -66.53 -23.52 49.98 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.033 1.762 . . . . 46.18 114.366 -175.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' SER . . . . . . . . . . . . . 92.5 p -101.58 -6.06 24.32 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.309 0.959 . . . . 53.6 113.215 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' ASN . . . . . . . . . . . . . 64.7 t30 65.37 44.55 3.13 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.553 0.692 . . . . 54.35 111.524 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 210' ' ' THR . . . . . . . . . . . . . 11.1 p -130.85 128.37 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.779 -0.823 . . . . 57.05 108.779 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' LYS . . . . . 0.462 ' NZ ' ' OD1' ' H' ' 213' ' ' ASP . 5.6 tptp -130.17 129.9 44.04 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.939 -1.504 . . . . 67.11 106.939 168.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' VAL . . . . . . . . . . . . . 25.4 m -134.99 153.91 35.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 121.461 0.648 . . . . 49.21 109.715 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 213' ' ' ASP . . . . . 0.462 ' OD1' ' NZ ' ' H' ' 211' ' ' LYS . 66.9 m-20 -118.93 134.55 55.11 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.336 -0.847 . . . . 65.16 108.963 174.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 214' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -125.78 113.8 17.77 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.088 -0.708 . . . . 54.92 109.088 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.35 136.15 47.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.114 0.483 . . . . 67.26 110.095 172.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' VAL . . . . . . . . . . . . . 49.1 t -112.53 125.05 69.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.427 -0.953 . . . . 56.62 108.427 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -141.07 154.79 68.49 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 116.218 -0.446 . . . . 99.82 110.075 -168.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 218' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--N 1.343 0.238 0 C-N-CA 123.187 2.591 . . . . 83.62 112.727 173.218 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 108.551 -0.907 . . . . 120.74 108.551 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 2' ' ' ILE . . . . . 0.485 HD13 ' OE1' ' L' ' 91' ' ' GLN . 3.9 tt -75.57 136.55 24.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 118.587 -1.245 . . . . 77.43 109.251 172.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 3' ' ' VAL . . . . . . . . . . . . . 19.9 t -119.25 119.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.335 -0.987 . . . . 64.88 108.335 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 32.7 mt -94.29 122.29 36.69 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.438 -0.949 . . . . 64.74 108.438 170.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 5' ' ' THR . . . . . . . . . . . . . 91.6 m -111.46 115.43 29.21 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.366 -0.605 . . . . 59.99 109.366 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -94.12 145.02 24.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.984 0.421 . . . . 57.6 110.111 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 7' ' ' SER . . . . . . . . . . . . . 3.0 p -147.18 144.67 20.05 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 108.264 -1.013 . . . . 68.73 108.264 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.13 172.45 62.99 Favored 'Cis proline' 0 N--CA 1.464 -0.25 0 C-N-CA 123.58 -1.425 . . . . 67.23 110.182 -7.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.86 -41.97 99.77 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 119.476 -1.345 . . . . 67.47 112.086 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 10' ' ' THR . . . . . . . . . . . . . 52.2 m -133.94 137.57 44.95 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.278 -1.008 . . . . 67.99 108.278 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' L' ' 13' ' ' LEU . 60.6 tp -124.17 124.0 41.52 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.864 -1.162 . . . . 69.78 107.864 -177.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -117.41 104.01 10.68 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.634 -0.506 . . . . 67.97 109.634 -168.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' L' ' 11' ' ' LEU . 1.3 mp -131.44 162.12 30.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.912 0.863 . . . . 65.24 110.484 -178.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' ' ' SER . . . . . . . . . . . . . 27.1 t -80.66 153.35 73.21 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 114.516 -1.22 . . . . 75.21 110.563 173.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 15' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -66.0 139.11 55.04 Favored 'Trans proline' 0 C--N 1.332 -0.298 0 CA-C-O 121.329 0.471 . . . . 68.65 111.621 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.91 -16.14 61.46 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.612 -0.722 . . . . 69.65 114.215 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 17' ' ' GLU . . . . . 0.433 ' OE2' HD23 ' L' ' 13' ' ' LEU . 72.5 tt0 -87.4 157.98 19.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.367 1.467 . . . . 112.09 109.893 -176.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 18' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -85.62 141.61 29.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.867 -0.606 . . . . 86.03 110.789 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 19' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' L' ' 404' ' ' HOH . . . -114.48 135.52 54.02 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.063 -0.517 . . . . 51.0 110.037 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 20' ' ' THR . . . . . 0.428 ' N ' ' O ' ' L' ' 404' ' ' HOH . 1.7 m -123.52 120.87 34.15 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.068 -0.716 . . . . 61.2 109.068 176.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.15 140.18 51.5 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.795 -0.817 . . . . 47.66 108.795 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 22' ' ' SER . . . . . . . . . . . . . 1.3 t -120.85 147.7 45.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.383 0.611 . . . . 61.76 111.08 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 23' ' ' CYS . . . . . . . . . . . . . 51.3 t -136.8 112.83 9.69 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.702 -1.592 . . . . 79.19 106.702 179.58 -178.216 114.167 71.018 106.078 2.055 106.576 157.761 62.081 1 1 . 1 . 001 ecloud build full ' L' L ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -108.12 133.18 52.76 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.784 -0.821 . . . . 73.97 108.784 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.07 145.18 29.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.311 0.577 . . . . 67.09 110.657 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -65.21 -36.4 84.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.59 -0.732 . . . . 70.23 111.061 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -131.77 170.8 14.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.896 -0.779 . . . . 87.26 108.896 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 28' ' ' SER . . . . . . . . . . . . . 42.6 t -76.12 133.41 40.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.858 -0.61 . . . . 77.07 111.218 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 t -89.33 84.94 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 105.684 -1.969 . . . . 76.6 105.684 171.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.21 74.77 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.377 -0.916 . . . . 62.96 113.546 -173.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 31' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -14.32 59.81 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.117 0.784 . . . . 71.68 113.117 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 32' ' ' SER . . . . . . . . . . . . . 3.1 m 61.32 25.78 15.7 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.573 0.749 . . . . 52.48 111.373 -170.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 33' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.59 68.01 2.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 122.451 1.119 . . . . 66.36 108.985 173.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 34' ' ' LEU . . . . . 0.428 HD13 ' CD2' ' L' ' 72' ' ' PHE . 0.6 OUTLIER -120.72 131.8 54.72 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.109 -0.95 . . . . 69.85 109.528 179.922 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 35' ' ' ALA . . . . . . . . . . . . . . . -119.37 152.59 36.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.007 0.523 . . . . 47.17 110.342 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 36' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -118.79 137.63 53.25 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.082 -0.71 . . . . 50.75 109.082 170.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -125.81 144.51 50.62 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.916 0.389 . . . . 57.03 110.234 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 38' ' ' GLN . . . . . 0.553 ' HB2' HD11 ' L' ' 48' ' ' LEU . 48.3 tt0 -105.09 136.77 43.96 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.129 -0.693 . . . . 55.12 109.129 173.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 39' ' ' GLN . . . . . 0.428 ' O ' ' HB1' ' L' ' 85' ' ' ALA . 51.8 tt0 -128.47 103.42 7.12 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.289 -1.374 . . . . 63.37 107.289 174.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 40' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -73.86 151.65 88.78 Favored Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.108 -0.496 . . . . 68.59 109.74 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 41' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.45 118.86 4.4 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 120.678 0.918 . . . . 74.38 113.86 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.69 21.06 64.63 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.38 0.912 . . . . 62.8 115.38 176.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 43' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -133.12 159.23 40.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.379 1.089 . . . . 98.09 109.932 -177.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.95 150.61 90.44 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-N 115.089 -0.96 . . . . 68.24 109.665 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 45' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -65.66 159.09 49.96 Favored 'Trans proline' 0 C--N 1.332 -0.323 0 CA-C-O 122.01 0.754 . . . . 66.22 112.053 -177.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 46' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -128.63 139.27 52.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.954 -1.021 . . . . 71.86 109.217 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 47' ' ' LEU . . . . . . . . . . . . . 61.3 tp -68.16 132.9 48.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 56.85 110.128 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 48' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' L' ' 38' ' ' GLN . 80.2 mt -110.54 -54.32 2.6 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.543 0.571 . . . . 56.9 112.543 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 49' ' ' ILE . . . . . . . . . . . . . 13.2 mm -128.8 138.1 55.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.11 -1.07 . . . . 50.83 108.11 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 50' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -130.53 164.29 25.19 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.016 -0.735 . . . . 68.28 109.016 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.97 18.6 4.54 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.771 -0.65 . . . . 53.75 113.552 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 52' ' ' ALA . . . . . . . . . . . . . . . 73.79 -8.03 1.48 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.338 2.255 . . . . 59.83 113.918 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 53' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -144.15 3.22 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.873 1.064 . . . . 55.37 113.873 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -100.81 123.48 45.07 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 119.143 0.883 . . . . 53.69 109.895 -171.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 55' ' ' ARG . . . . . . . . . . . . . 41.5 ttm105 -77.01 131.87 38.68 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.173 -0.467 . . . . 86.05 110.099 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.06 158.37 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.904 0.859 . . . . 58.93 110.608 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 57' ' ' THR . . . . . . . . . . . . . 7.6 m -62.69 133.09 54.31 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.509 -0.769 . . . . 70.61 110.164 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 22.53 72.6 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 115.59 0.996 . . . . 70.32 115.59 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 59' ' ' ILE . . . . . . . . . . . . . 15.9 mm -103.3 131.29 22.23 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 118.485 1.142 . . . . 69.66 108.068 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 155.78 11.06 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 120.51 0.807 . . . . 76.73 113.249 178.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 61' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.54 -16.91 61.76 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.295 0.85 . . . . 119.47 113.295 -172.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 62' ' ' ARG . . . . . . . . . . . . . 31.7 ptt-85 -75.23 -15.02 60.57 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.748 0.647 . . . . 66.24 112.748 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -85.35 139.61 31.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.684 -0.487 . . . . 65.37 109.684 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 64' ' ' SER . . . . . . . . . . . . . 35.7 p -161.03 145.27 13.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.65 -0.87 . . . . 70.45 108.65 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 65' ' ' GLY . . . . . . . . . . . . . . . -120.93 152.65 16.77 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.707 -0.957 . . . . 48.02 110.707 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 66' ' ' SER . . . . . . . . . . . . . 51.8 p -157.26 166.36 33.36 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.342 -0.984 . . . . 62.65 108.342 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.88 178.33 19.62 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-O 122.337 0.965 . . . . 48.97 111.768 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 68' ' ' SER . . . . . . . . . . . . . 80.2 p -172.47 166.99 5.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 107.837 -1.171 . . . . 57.87 107.837 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.97 -110.06 3.1 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.374 -0.83 . . . . 58.91 112.646 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 70' ' ' THR . . . . . . . . . . . . . 73.3 p -108.39 -0.78 20.42 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.35 0.87 . . . . 62.03 113.35 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 71' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.15 121.8 23.1 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.012 0.824 . . . . 68.69 110.195 -173.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 72' ' ' PHE . . . . . 0.428 ' CD2' HD13 ' L' ' 34' ' ' LEU . 83.7 m-85 -129.76 149.43 51.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.286 -0.635 . . . . 50.55 109.286 178.648 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 73' ' ' THR . . . . . . . . . . . . . 92.6 m -134.04 140.86 46.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.728 -0.669 . . . . 48.98 110.37 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 74' ' ' LEU . . . . . . . . . . . . . 24.5 tp -113.18 130.61 56.16 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.502 -0.925 . . . . 57.24 108.502 170.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 75' ' ' THR . . . . . . . . . . . . . 28.0 m -118.7 125.61 50.06 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.103 -0.703 . . . . 62.95 109.103 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 76' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.63 111.65 36.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 106.17 -1.789 . . . . 59.92 106.17 171.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 77' ' ' SER . . . . . . . . . . . . . 51.8 p -78.28 -29.66 48.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.323 -0.951 . . . . 89.15 112.729 -165.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 -143.71 100.78 3.65 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.023 -1.473 . . . . 96.36 107.023 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.4 111.99 3.32 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.617 -0.512 . . . . 69.64 109.617 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 80' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -83.33 162.74 52.95 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 109.35 -0.611 . . . . 97.61 109.35 168.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 81' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -54.99 -36.96 93.8 Favored 'Trans proline' 0 C--O 1.237 0.433 0 N-CA-C 113.203 0.424 . . . . 72.45 113.203 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 82' ' ' GLU . . . . . 0.673 ' OE1' ' O ' ' L' ' 402' ' ' HOH . 2.0 pt-20 -67.54 -13.21 61.86 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.268 0.84 . . . . 101.26 113.268 178.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 83' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -85.53 -6.01 59.23 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.557 0.947 . . . . 74.64 113.557 -174.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 84' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.56 90.12 7.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 122.051 0.929 . . . . 67.01 108.87 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 85' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' L' ' 39' ' ' GLN . . . -142.31 -166.14 2.18 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.648 -1.241 . . . . 49.24 107.648 -172.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 86' ' ' VAL . . . . . . . . . . . . . 9.4 t -107.94 142.34 20.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.77 -1.196 . . . . 54.75 107.77 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 87' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -123.03 132.22 54.03 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.729 -0.471 . . . . 55.73 109.729 -177.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 88' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -114.09 139.49 49.27 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.265 0.626 . . . . 55.66 110.157 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 89' ' ' CYS . . . . . . . . . . . . . 29.2 p -99.46 157.0 16.73 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.617 -0.883 . . . . 83.8 108.617 166.356 62.081 157.761 71.018 106.576 2.055 106.078 114.167 -178.216 1 1 . 1 . 001 ecloud build full ' L' L ' 90' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -152.9 135.92 15.56 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.567 -0.742 . . . . 61.14 109.367 -173.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 91' ' ' GLN . . . . . 0.485 ' OE1' HD13 ' L' ' 2' ' ' ILE . 15.2 tt0 -98.7 128.31 44.92 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.565 -0.902 . . . . 89.67 108.565 166.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 92' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -119.72 -177.86 3.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.618 0.723 . . . . 63.69 109.692 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.96 -10.1 69.6 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 115.671 1.028 . . . . 78.42 115.671 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 94' ' ' SER . . . . . . . . . . . . . 83.6 p -154.18 -165.18 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.972 1.386 . . . . 100.26 108.977 -168.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 95' ' ' SER . . . . . 0.689 ' HB2' ' HD3' ' L' ' 96' ' ' PRO . 14.5 m -46.82 -65.11 0.76 Allowed Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 116.125 1.898 . . . . 99.42 116.125 -146.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 96' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' L' ' 95' ' ' SER . 11.7 Cg_endo -97.86 -5.35 1.02 Allowed 'Trans proline' 0 C--N 1.354 0.828 0 CA-C-N 121.381 1.529 . . . . 81.07 115.305 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 97' ' ' TRP . . . . . . . . . . . . . 32.3 m-90 47.69 51.68 13.68 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.626 0.727 . . . . 75.69 111.201 -167.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 98' ' ' THR . . . . . . . . . . . . . 77.0 m -65.32 145.81 55.72 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.589 0.709 . . . . 75.75 111.792 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 99' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -108.12 153.16 23.55 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.964 0.905 . . . . 54.51 110.216 176.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.77 169.45 54.41 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.929 -0.868 . . . . 58.63 110.929 164.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 101' ' ' GLN . . . . . . . . . . . . . 10.3 pm0 -81.15 -15.45 55.8 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.825 -0.75 . . . . 74.06 112.873 -176.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.42 144.55 12.66 Favored Glycine 0 C--O 1.237 0.343 0 CA-C-N 118.387 0.54 . . . . 55.6 113.73 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 103' ' ' THR . . . . . . . . . . . . . 24.5 m -120.91 129.5 53.5 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.749 0.82 . . . . 55.84 108.799 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 104' ' ' LYS . . . . . 0.438 ' HE2' ' HB3' ' L' ' 106' ' ' GLU . 63.8 tttt -104.48 128.0 52.31 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.455 -0.572 . . . . 76.62 109.455 -179.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 105' ' ' VAL . . . . . . . . . . . . . 23.5 t -104.32 111.01 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.475 -1.306 . . . . 63.53 107.475 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 106' ' ' GLU . . . . . 0.438 ' HB3' ' HE2' ' L' ' 104' ' ' LYS . 0.9 OUTLIER -112.28 165.34 12.27 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.705 0.765 . . . . 103.9 110.262 -179.785 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 107' ' ' ILE . . . . . . . . . . . . . 6.4 mt -82.51 131.24 34.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.29 -0.868 . . . . 80.92 109.78 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 108' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -91.62 133.67 35.36 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.73 -0.471 . . . . 72.1 109.73 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 109' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -137.97 177.14 8.1 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.311 -0.996 . . . . 62.46 108.311 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -76.32 154.99 34.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.784 0.802 . . . . 74.33 110.33 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 111' ' ' VAL . . . . . . . . . . . . . 73.2 t -56.31 138.11 17.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 CA-C-N 115.124 -0.944 . . . . 73.96 110.604 -175.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 112' ' ' ALA . . . . . . . . . . . . . . . -129.58 127.44 40.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.705 -0.85 . . . . 63.79 108.705 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 113' ' ' ALA . . . . . . . . . . . . . . . -83.51 138.78 41.24 Favored Pre-proline 0 C--O 1.234 0.265 0 O-C-N 123.319 0.387 . . . . 66.09 110.333 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 114' ' ' PRO . . . . . 0.497 ' HB3' ' HB3' ' L' ' 140' ' ' PHE . 82.4 Cg_endo -74.74 146.81 34.27 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 C-N-CA 120.274 0.649 . . . . 63.73 112.389 -176.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 115' ' ' SER . . . . . . . . . . . . . 13.9 m -87.61 125.43 34.36 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.905 -1.146 . . . . 72.97 107.905 167.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 116' ' ' VAL . . . . . . . . . . . . . 19.8 t -104.51 135.39 42.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 109.882 -0.414 . . . . 59.8 109.882 -171.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 117' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -135.3 144.03 46.54 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.604 -0.887 . . . . 56.0 108.604 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 118' ' ' ILE . . . . . . . . . . . . . 19.8 tt -119.36 144.45 27.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.491 -0.929 . . . . 62.42 108.491 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 119' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -127.67 121.33 22.12 Favored Pre-proline 0 C--O 1.249 1.048 0 N-CA-C 109.039 -0.726 . . . . 58.09 109.039 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 120' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.71 155.24 58.91 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 120.632 0.888 . . . . 56.96 110.735 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 121' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -61.2 143.65 98.59 Favored 'Trans proline' 0 C--N 1.331 -0.342 0 N-CA-C 110.661 -0.553 . . . . 60.67 110.661 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 122' ' ' SER . . . . . . . . . . . . . 99.2 p -77.63 157.36 30.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.944 0.878 . . . . 57.78 110.674 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 123' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -59.46 -34.96 73.19 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.117 -0.947 . . . . 101.99 111.47 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -64.47 -42.23 96.03 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.4 -0.52 . . . . 75.91 110.872 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 125' ' ' GLN . . . . . 0.904 ' OE1' ' O ' ' L' ' 401' ' ' HOH . 34.6 tt0 -63.99 -43.89 94.32 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.581 -0.847 . . . . 61.15 111.132 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 126' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.24 -37.09 81.81 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.389 -0.524 . . . . 66.53 111.392 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 127' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -64.91 -22.64 67.03 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.309 0.485 . . . . 81.64 112.309 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 128' ' ' SER . . . . . . . . . . . . . 10.0 p -89.61 -8.26 52.95 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.99 0.737 . . . . 77.24 112.99 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 129' ' ' GLY . . . . . . . . . . . . . . . 99.32 8.96 52.3 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 116.927 1.531 . . . . 80.32 116.927 174.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -122.17 165.59 15.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.897 1.349 . . . . 76.73 109.64 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.03 118.61 10.39 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.57 -0.9 . . . . 67.39 108.57 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 132' ' ' SER . . . . . . . . . . . . . 73.1 m -121.33 127.49 51.33 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.799 -0.815 . . . . 67.31 108.799 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -109.01 134.56 50.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.474 -1.306 . . . . 63.32 107.474 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 134' ' ' VAL . . . . . . . . . . . . . 95.9 t -124.23 130.58 73.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.271 -0.64 . . . . 57.72 109.271 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 135' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.72 133.42 55.86 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.61 -1.256 . . . . 93.04 107.61 173.349 -174.099 117.75 60.024 106.698 2.05 106.109 155.248 66.548 1 1 . 1 . 001 ecloud build full ' L' L ' 136' ' ' LEU . . . . . . . . . . . . . 7.0 tp -117.54 128.17 54.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.883 -0.414 . . . . 63.81 109.883 -176.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 137' ' ' LEU . . . . . . . . . . . . . 11.0 mp -105.57 113.48 27.08 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.099 -1.445 . . . . 62.47 107.099 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 138' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -107.26 124.27 49.52 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.746 -0.206 . . . . 56.43 110.838 -168.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 139' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 58.11 63.84 1.66 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.983 0.913 . . . . 74.68 112.207 164.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 140' ' ' PHE . . . . . 0.497 ' HB3' ' HB3' ' L' ' 114' ' ' PRO . 48.8 p90 -120.5 160.48 23.07 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.473 -0.785 . . . . 60.78 110.824 179.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 141' ' ' TYR . . . . . 0.428 ' CG ' ' HA ' ' L' ' 142' ' ' PRO . 58.6 t80 -155.01 138.25 10.71 Favored Pre-proline 0 C--O 1.24 0.574 0 N-CA-C 107.267 -1.383 . . . . 68.57 107.267 175.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 142' ' ' PRO . . . . . 0.428 ' HA ' ' CG ' ' L' ' 141' ' ' TYR . 72.0 Cg_endo -78.56 -171.41 9.84 Favored 'Cis proline' 0 CA--C 1.531 0.327 0 N-CA-C 113.898 0.691 . . . . 53.4 113.898 1.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 143' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -73.5 -27.33 61.32 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 123.583 0.552 . . . . 77.42 112.335 -167.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 144' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -70.71 122.18 19.34 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 122.055 -0.403 . . . . 105.42 110.168 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 145' ' ' ALA . . . . . . . . . . . . . . . -143.69 167.75 21.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.645 -1.243 . . . . 71.16 107.645 170.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 146' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.96 138.53 40.69 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.721 -0.844 . . . . 92.94 108.721 173.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 147' ' ' VAL . . . . . 0.486 HG22 HG22 ' L' ' 197' ' ' VAL . 69.8 t -125.29 120.29 57.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 107.975 -1.12 . . . . 63.91 107.975 -176.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 148' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -109.09 137.62 46.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.827 0.346 . . . . 111.71 110.355 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 149' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -102.26 138.61 38.97 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.808 -0.633 . . . . 73.41 109.841 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 150' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -132.34 116.29 16.67 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.028 -0.73 . . . . 84.64 109.028 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 151' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.43 105.76 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 106.494 -1.669 . . . . 67.15 106.494 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 152' ' ' ASP . . . . . 0.516 ' OD1' ' HG3' ' L' ' 191' ' ' LYS . 86.6 m-20 54.72 49.78 17.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.882 0.848 . . . . 113.91 111.068 -172.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 153' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.21 33.87 23.57 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.115 -0.948 . . . . 94.14 111.709 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.46 121.83 41.25 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.709 -1.219 . . . . 76.47 107.709 173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.3 124.09 25.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.903 -0.589 . . . . 88.81 110.246 -170.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 156' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -85.48 163.74 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.47 0.652 . . . . 64.04 110.345 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 157' ' ' SER . . . . . . . . . . . . . 13.4 t -167.7 136.5 2.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.541 -0.754 . . . . 64.24 109.306 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 158' ' ' GLY . . . . . . . . . . . . . . . 80.58 2.36 89.66 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 115.442 0.937 . . . . 56.44 115.442 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 159' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -126.14 23.87 7.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.71 1.255 . . . . 71.56 111.858 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 160' ' ' SER . . . . . . . . . . . . . 25.1 p -128.91 150.9 50.17 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.185 -0.672 . . . . 68.58 109.185 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 161' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -130.87 149.56 52.44 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.943 -0.762 . . . . 94.16 108.943 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -134.77 140.01 45.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.849 -0.614 . . . . 96.5 110.304 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 163' ' ' SER . . . . . . . . . . . . . 1.2 t -127.61 147.83 50.36 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.841 -1.17 . . . . 65.36 107.841 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 164' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.5 136.34 60.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.346 -0.612 . . . . 48.82 109.346 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 165' ' ' THR . . . . . . . . . . . . . 18.9 p -70.53 162.86 28.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.849 0.833 . . . . 63.67 109.951 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 166' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -77.7 165.91 23.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 118.669 -1.212 . . . . 91.58 108.997 166.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 167' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' L' ' 172' ' ' SER . 32.8 tt0 -59.05 127.43 32.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 66.5 110.525 -174.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 168' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.16 145.07 52.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.698 0.761 . . . . 86.96 110.726 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.82 -28.9 44.49 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.473 -0.785 . . . . 96.03 112.228 -176.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 170' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -87.15 -37.66 17.14 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 119.749 -0.78 . . . . 94.47 112.856 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 171' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -133.03 6.58 3.93 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.403 0.89 . . . . 91.96 113.403 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 172' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' L' ' 167' ' ' GLN . 40.6 m 57.05 32.56 21.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.087 0.773 . . . . 64.12 113.087 170.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 173' ' ' THR . . . . . . . . . . . . . 71.0 p -100.84 178.39 4.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 122.094 0.95 . . . . 58.36 109.825 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 174' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -121.49 155.65 34.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.275 -0.875 . . . . 69.88 109.487 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 175' ' ' SER . . . . . . . . . . . . . 7.7 m -126.94 149.1 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.235 -0.893 . . . . 59.28 108.8 170.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 176' ' ' LEU . . . . . . . . . . . . . 7.7 tt -136.89 139.18 41.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.492 -0.777 . . . . 51.92 109.041 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 177' ' ' SER . . . . . . . . . . . . . 4.8 p -123.44 133.51 54.05 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.029 -0.73 . . . . 61.35 109.029 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 178' ' ' SER . . . . . . . . . . . . . 14.3 t -120.0 134.19 55.32 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.882 -0.784 . . . . 68.45 108.882 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 179' ' ' THR . . . . . . . . . . . . . 7.4 m -124.62 113.3 17.85 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.519 -0.919 . . . . 68.46 108.519 -174.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 180' ' ' LEU . . . . . . . . . . . . . 59.2 tp -89.49 126.97 35.79 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 109.677 -0.49 . . . . 66.2 109.677 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 181' ' ' THR . . . . . . . . . . . . . 20.7 m -101.44 122.26 43.45 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.433 -0.581 . . . . 61.2 109.433 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 182' ' ' LEU . . . . . . . . . . . . . 16.7 mt -127.72 154.81 44.9 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.868 -0.79 . . . . 69.64 108.868 173.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 183' ' ' SER . . . . . . . . . . . . . 24.7 p -68.83 148.9 49.59 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 119.194 -1.002 . . . . 68.73 108.781 165.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 184' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -55.28 -40.32 70.89 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.041 -0.663 . . . . 66.37 110.996 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 185' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' L' ' 189' ' ' LYS . . . -57.92 -44.59 86.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.647 -0.421 . . . . 74.84 111.272 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 186' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.84 -44.87 88.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.495 -0.482 . . . . 108.62 111.543 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 187' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.54 -35.27 73.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.584 -0.447 . . . . 69.99 111.269 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 188' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.45 -13.15 60.37 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.25 0.833 . . . . 86.02 113.25 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 189' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' L' ' 185' ' ' ALA . 35.4 mttp -85.06 -35.92 21.54 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.742 0.701 . . . . 111.65 112.863 -177.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 190' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -106.38 157.86 17.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.515 0.674 . . . . 81.19 111.089 -172.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 191' ' ' LYS . . . . . 0.516 ' HG3' ' OD1' ' L' ' 152' ' ' ASP . 2.2 ptpt -99.54 -55.76 2.58 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.14 0.792 . . . . 109.64 113.14 -169.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 192' ' ' VAL . . . . . 0.54 HG22 ' OD1' ' L' ' 211' ' ' ASN . 4.7 t -101.62 126.04 55.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 74.48 109.508 -166.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 193' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -120.34 123.74 43.85 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.726 -0.842 . . . . 64.4 108.726 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 194' ' ' ALA . . . . . . . . . . . . . . . -134.87 145.97 48.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.117 0.567 . . . . 66.71 109.751 -177.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -116.61 132.98 56.54 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.795 -1.187 . . . . 94.53 107.795 167.562 66.548 155.248 60.024 106.109 2.05 106.698 117.75 -174.099 1 1 . 1 . 001 ecloud build full ' L' L ' 196' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -114.62 123.28 48.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.377 -0.972 . . . . 108.4 108.377 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 197' ' ' VAL . . . . . 0.486 HG22 HG22 ' L' ' 147' ' ' VAL . 56.1 t -113.81 132.25 63.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.016 -0.735 . . . . 66.13 109.016 -172.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 198' ' ' THR . . . . . . . . . . . . . 2.5 m -118.31 127.52 53.78 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.773 -0.825 . . . . 75.29 108.773 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 199' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -149.42 151.84 34.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.21 -0.663 . . . . 78.76 109.21 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 200' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.56 -41.92 22.48 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.236 -0.893 . . . . 100.45 112.303 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 201' ' ' GLY . . . . . . . . . . . . . . . -76.65 -5.56 83.42 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 115.796 1.078 . . . . 69.5 115.796 -176.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 202' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.73 129.81 46.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.052 0.926 . . . . 78.93 109.567 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 203' ' ' SER . . . . . . . . . . . . . 3.2 t -65.11 -47.31 77.61 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.526 -0.87 . . . . 96.65 111.523 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 204' ' ' SER . . . . . . . . . . . . . 1.7 p -131.2 157.08 79.13 Favored Pre-proline 0 C--O 1.233 0.214 0 C-N-CA 125.929 1.691 . . . . 110.06 108.912 171.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 205' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -58.68 131.41 42.15 Favored 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-O 121.581 0.575 . . . . 83.92 113.198 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 206' ' ' VAL . . . . . . . . . . . . . 2.8 t -87.67 131.91 34.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.778 -0.823 . . . . 72.43 108.778 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 207' ' ' THR . . . . . . . . . . . . . 32.0 m -119.03 124.8 47.83 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.281 -0.637 . . . . 86.12 109.281 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 208' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -114.79 135.25 54.38 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.764 -1.198 . . . . 75.57 107.764 172.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 209' ' ' SER . . . . . . . . . . . . . 58.9 p -144.6 173.84 11.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.015 0.912 . . . . 62.02 110.645 -172.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 210' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -159.38 147.1 17.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.506 -1.224 . . . . 68.46 107.929 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 211' ' ' ASN . . . . . 0.54 ' OD1' HG22 ' L' ' 192' ' ' VAL . 3.4 m-20 -96.94 139.07 33.51 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.224 -0.658 . . . . 87.9 109.224 171.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 212' ' ' ARG . . . . . . . . . . . . . 44.5 ttp85 -64.14 141.48 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.368 0.604 . . . . 83.52 111.029 -172.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 213' ' ' GLY . . . . . . . . . . . . . . . 75.2 24.09 72.24 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 115.152 0.821 . . . . 115.62 115.152 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 214' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 118.222 1.011 . . . . 129.96 110.725 178.054 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 401' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' H' ' 103' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 402' ' ' HOH . . . . . 0.709 ' O ' ' OD1' ' H' ' 90' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 403' ' ' HOH . . . . . 0.621 ' O ' ' OE1' ' H' ' 46' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 404' ' ' HOH . . . . . 0.476 ' O ' ' N ' ' H' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 401' ' ' HOH . . . . . 0.904 ' O ' ' OE1' ' L' ' 125' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 402' ' ' HOH . . . . . 0.673 ' O ' ' OE1' ' L' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 404' ' ' HOH . . . . . 0.499 ' O ' ' HA ' ' L' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 1' ' ' GLN . . . . . 0.404 ' HB2' ' H ' ' H' ' 2' ' ' VAL . 10.5 mt-30 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 121.59 0.71 . . . . 105.95 111.304 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 2' ' ' VAL . . . . . 0.404 ' H ' ' HB2' ' H' ' 1' ' ' GLN . 7.7 t -88.75 120.2 37.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.918 -1.141 . . . . 86.66 107.918 175.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 -127.13 142.79 51.42 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.847 0.356 . . . . 102.52 110.285 177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 18.1 mt -119.44 127.62 53.25 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.946 -1.131 . . . . 61.93 107.946 171.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -126.33 124.68 66.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 109.037 -0.727 . . . . 70.11 109.037 -172.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -110.07 146.05 36.05 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.62 0.768 . . . . 82.71 110.529 -173.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -132.16 -25.49 2.0 Allowed 'General case' 0 C--O 1.236 0.366 0 N-CA-C 115.897 1.814 . . . . 88.43 115.897 -166.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 8' ' ' GLY . . . . . . . . . . . . . . . -90.04 7.23 82.01 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 119.358 2.503 . . . . 72.04 119.358 -159.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.21 170.94 33.26 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 119.85 1.825 . . . . 81.58 113.626 -171.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.72 -172.56 40.47 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.816 -0.707 . . . . 66.46 112.074 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 11' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' H' ' 115' ' ' THR . 78.5 t -114.64 128.15 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 124.021 0.928 . . . . 53.09 108.501 -178.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 12' ' ' VAL . . . . . . . . . . . . . 29.3 m -144.61 159.19 14.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 121.847 0.832 . . . . 53.04 110.013 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 13' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -76.88 155.46 82.92 Favored Pre-proline 0 N--CA 1.454 -0.266 0 CA-C-N 115.014 -0.994 . . . . 57.53 111.115 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 14' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -62.37 156.26 52.46 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 CA-C-O 121.98 0.742 . . . . 51.71 111.516 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.67 -2.83 77.44 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 114.917 -1.038 . . . . 52.3 115.693 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -96.36 -175.7 3.42 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.869 1.335 . . . . 71.71 111.475 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' SER . . . . . . . . . . . . . 27.4 m -117.13 156.96 26.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.352 -0.84 . . . . 61.32 110.519 -179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' LEU . . . . . . . . . . . . . 42.0 tp -164.66 129.66 2.67 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.631 -1.248 . . . . 67.3 107.631 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' ARG . . . . . . . . . . . . . 25.0 ttp180 -109.91 123.78 50.2 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.192 0.307 . . . . 89.41 110.383 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 84.0 mt -96.12 145.53 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.723 -0.843 . . . . 50.55 108.723 174.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' SER . . . . . . . . . . . . . 3.4 p -129.11 148.33 51.05 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.877 -0.786 . . . . 75.22 108.877 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' CYS . . . . . . . . . . . . . 15.3 t -134.46 103.03 5.53 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 106.642 -1.614 . . . . 84.73 106.642 -179.83 170.126 130.364 63.111 107.471 2.052 106.003 173.166 56.968 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.2 131.49 34.75 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.466 -0.568 . . . . 76.92 109.466 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ALA . . . . . . . . . . . . . . . -120.57 143.28 48.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.287 -0.415 . . . . 68.09 110.349 -173.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' SER . . . . . . . . . . . . . 33.4 p -150.97 169.37 21.95 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.661 -0.866 . . . . 88.84 108.661 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.5 -0.3 88.32 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 115.691 1.037 . . . . 77.46 115.691 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -153.91 170.81 20.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.609 1.204 . . . . 78.45 108.717 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' THR . . . . . . . . . . . . . 32.0 m -78.57 104.86 9.46 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.999 -1.112 . . . . 81.71 107.999 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.27 -46.24 86.38 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.101 -0.499 . . . . 82.24 111.668 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' SER . . . . . . . . . . . . . 83.3 p -81.77 17.27 1.53 Allowed 'General case' 0 C--O 1.237 0.405 0 N-CA-C 113.2 0.815 . . . . 77.92 113.2 -169.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' SER . . . . . . . . . . . . . 1.1 m -107.28 -11.97 15.45 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 113.379 0.881 . . . . 91.54 113.379 174.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -113.57 155.2 25.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.611 0.719 . . . . 79.76 110.625 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' THR . . . . . . . . . . . . . 69.5 p -93.0 154.57 18.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 115.368 -0.833 . . . . 61.17 109.659 170.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' MET . . . . . 0.474 ' HB3' HD22 ' H' ' 79' ' ' LEU . 84.3 mmm -126.76 155.25 43.08 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.508 0.671 . . . . 74.03 110.822 -169.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -132.83 159.05 40.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.021 -0.99 . . . . 58.93 110.676 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -112.88 132.97 55.08 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.915 -1.143 . . . . 54.14 107.915 160.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' VAL . . . . . . . . . . . . . 90.4 t -130.75 133.18 63.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 107.614 -1.254 . . . . 60.43 107.614 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -122.08 156.36 33.73 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.976 0.893 . . . . 62.04 110.925 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -141.21 110.23 6.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.478 -1.237 . . . . 54.77 107.994 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.74 161.12 73.73 Favored Pre-proline 0 N--CA 1.448 -0.555 0 N-CA-C 110.084 -0.339 . . . . 50.99 110.084 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.8 120.43 8.3 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 120.12 0.547 . . . . 64.04 112.208 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.19 10.35 73.8 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 115.203 0.841 . . . . 66.43 115.203 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtmt -118.77 178.6 4.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.239 1.02 . . . . 98.76 109.785 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.81 -170.51 35.47 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-O 122.576 1.098 . . . . 79.95 112.967 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' LEU . . . . . . . . . . . . . 30.2 mt -92.33 147.69 22.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.489 -0.856 . . . . 58.22 110.352 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' GLU . . . . . 0.621 ' OE1' ' O ' ' H' ' 403' ' ' HOH . 31.4 tt0 -142.38 121.43 12.89 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.147 -0.686 . . . . 89.3 109.147 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' TRP . . . . . . . . . . . . . 69.6 t90 -63.18 138.12 58.44 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.18 0.514 . . . . 57.61 110.309 173.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' VAL . . . . . . . . . . . . . 88.4 t -110.89 -58.96 3.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.816 -0.629 . . . . 52.89 111.207 -175.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' THR . . . . . 0.526 HG23 HD12 ' H' ' 70' ' ' ILE . 4.7 t -157.41 156.92 33.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.479 0.657 . . . . 56.34 109.709 -172.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -132.74 145.09 50.74 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 114.853 -1.067 . . . . 59.82 109.075 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' ILE . . . . . . . . . . . . . 18.6 tt -139.5 140.33 37.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 108.753 -0.832 . . . . 65.15 108.753 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' SER . . . . . . . . . . . . . 12.5 p -82.78 -171.37 3.49 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.731 0.777 . . . . 74.13 109.344 -177.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -53.69 7.3 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.685 -0.634 . . . . 84.03 110.366 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' H' ' 54' ' ' ASP . 0.0 OUTLIER -48.35 -51.4 26.44 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.015 0.436 . . . . 98.13 111.293 175.097 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' GLY . . . . . . . . . . . . . . . 111.05 1.15 28.46 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-O 119.3 -0.722 . . . . 86.11 113.364 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' H' ' 54' ' ' ASP . 8.9 m120 -94.12 1.73 56.08 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 118.042 0.921 . . . . 103.83 113.21 -172.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -134.34 108.73 8.36 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.371 -0.974 . . . . 91.45 108.371 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -120.82 131.41 54.43 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.325 -0.991 . . . . 82.49 108.325 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -126.73 145.8 50.46 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.291 -0.633 . . . . 103.26 109.291 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -135.94 138.05 41.95 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 115.995 -0.548 . . . . 61.72 109.815 -171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.57 152.67 25.52 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 120.128 -0.629 . . . . 63.2 109.61 168.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -62.82 -27.3 69.22 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.135 -0.626 . . . . 91.58 111.532 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m -56.0 -28.96 59.49 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.337 0.495 . . . . 76.39 112.337 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' VAL . . . . . . . . . . . . . 25.1 m -128.13 -1.23 3.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 113.579 0.955 . . . . 61.71 113.579 -166.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' H' ' 65' ' ' LYS . 4.8 tptt -64.86 135.18 55.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 119.302 0.956 . . . . 87.29 110.344 -179.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' GLY . . . . . . . . . . . . . . . 90.57 -7.98 80.51 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-O 119.219 -0.767 . . . . 70.36 114.809 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -127.9 -27.24 2.81 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 118.135 0.967 . . . . 61.73 111.312 -176.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -111.96 141.06 46.08 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.747 -0.464 . . . . 70.75 109.747 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' THR . . . . . . . . . . . . . 16.0 m -128.8 113.06 14.83 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.391 -0.596 . . . . 82.32 109.391 -179.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' ILE . . . . . 0.526 HD12 HG23 ' H' ' 49' ' ' THR . 17.9 tt -87.06 143.6 11.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.524 -0.917 . . . . 65.46 108.524 173.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' SER . . . . . . . . . . . . . 54.8 p -156.04 161.4 40.44 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.434 -0.951 . . . . 64.31 108.434 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -142.11 144.48 33.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.582 -0.735 . . . . 80.7 109.262 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -121.41 106.67 11.65 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 107.27 -1.382 . . . . 107.81 107.27 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -73.39 -26.9 61.19 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.225 -0.59 . . . . 91.54 111.808 -177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' SER . . . . . . . . . . . . . 30.2 p -67.13 -17.34 64.82 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.307 -0.557 . . . . 91.55 112.364 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -115.85 0.81 13.24 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 113.008 0.744 . . . . 92.36 113.008 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 58.49 52.79 6.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.601 0.715 . . . . 78.2 111.094 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' THR . . . . . . . . . . . . . 18.5 m -136.85 134.48 36.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.038 -0.528 . . . . 76.56 110.331 -175.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' LEU . . . . . 0.474 HD22 ' HB3' ' H' ' 34' ' ' MET . 18.9 tp -102.11 140.62 36.16 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.151 -0.685 . . . . 62.09 109.151 169.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -124.72 147.12 48.8 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.31 0.576 . . . . 81.2 111.376 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LEU . . . . . . . . . . . . . 49.6 tp -129.77 108.65 10.33 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.127 -1.064 . . . . 57.93 108.127 167.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -86.92 115.53 24.38 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.119 -1.067 . . . . 65.02 108.119 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' MET . . . . . . . . . . . . . 6.6 mtm -103.79 123.87 47.86 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.288 -0.634 . . . . 63.27 109.288 -179.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' ASN . . . . . . . . . . . . . 57.0 m-20 -124.7 162.45 24.16 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.544 -0.539 . . . . 61.31 109.544 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' SER . . . . . . . . . . . . . 62.1 m 47.28 52.47 12.08 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.889 0.852 . . . . 67.08 110.901 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' LEU . . . . . . . . . . . . . 14.1 mt -65.53 145.18 56.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.397 -0.819 . . . . 57.14 111.177 -172.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -122.34 157.44 31.78 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.163 0.985 . . . . 83.1 109.45 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ALA . . . . . . . . . . . . . . . -55.05 -39.99 69.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.569 -0.741 . . . . 54.04 111.294 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -63.29 -13.14 35.18 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 112.913 0.709 . . . . 105.68 112.913 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ASP . . . . . 0.709 ' OD1' ' O ' ' H' ' 402' ' ' HOH . 65.3 m-20 -76.7 -2.84 34.93 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.14 0.793 . . . . 86.51 113.14 174.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' THR . . . . . . . . . . . . . 16.5 m -67.11 115.04 6.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 118.052 0.387 . . . . 57.11 110.027 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' ALA . . . . . . . . . . . . . . . -168.68 167.21 11.45 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.125 -0.694 . . . . 53.61 109.125 -177.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 89.3 mt -81.88 129.99 36.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.965 -1.124 . . . . 52.53 107.965 163.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -107.85 125.22 51.19 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.541 -0.54 . . . . 50.93 109.541 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -109.22 139.8 43.67 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.12 0.968 . . . . 58.08 110.143 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' CYS . . . . . . . . . . . . . 24.7 p -90.22 147.1 23.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.109 -1.071 . . . . 80.04 108.109 160.474 56.968 173.166 63.111 106.003 2.052 107.471 130.364 170.126 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ALA . . . . . . . . . . . . . . . -145.25 147.64 32.62 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.962 -0.563 . . . . 58.07 109.67 -177.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -106.37 140.5 39.19 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.406 -0.816 . . . . 80.32 109.703 -178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' THR . . . . . . . . . . . . . 1.3 p -91.55 114.63 27.21 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.735 -0.839 . . . . 87.87 108.735 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' GLY . . . . . . . . . . . . . . . -56.87 164.48 5.85 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.051 -1.071 . . . . 65.5 111.422 172.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -54.59 -33.5 60.44 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.94 -0.704 . . . . 109.02 110.972 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.01 -21.19 33.95 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.127 0.788 . . . . 82.16 113.127 -174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' GLY . . . . . 0.762 ' O ' ' O ' ' H' ' 401' ' ' HOH . . . 135.21 -33.61 2.42 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 119.661 2.624 . . . . 63.8 119.661 168.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -79.03 -179.99 5.96 Favored 'Trans proline' 0 C--N 1.332 -0.308 0 CA-C-N 119.683 1.741 . . . . 65.04 111.49 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -89.14 92.94 9.4 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 107.466 -1.309 . . . . 61.16 107.466 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' ASP . . . . . . . . . . . . . 50.3 p-10 -84.62 -23.35 29.6 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 113.841 1.052 . . . . 77.79 113.841 -170.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -137.44 130.78 31.0 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.914 0.779 . . . . 65.05 109.923 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' TRP . . . . . . . . . . . . . 29.5 m95 -117.66 145.06 44.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.208 0.528 . . . . 53.22 110.368 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' GLY . . . . . . . . . . . . . . . -71.02 -179.92 30.44 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-O 122.59 1.106 . . . . 55.26 110.756 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' GLN . . . . . . . . . . . . . 7.2 pm0 -85.77 -23.15 27.38 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.836 -0.746 . . . . 55.47 112.806 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' GLY . . . . . . . . . . . . . . . 100.06 121.19 4.62 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 118.182 0.446 . . . . 64.54 114.047 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' THR . . . . . . . . . . . . . 1.4 p -102.77 138.94 39.0 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.175 -0.676 . . . . 71.88 109.175 168.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' LEU . . . . . . . . . . . . . 60.0 tp -86.96 135.65 33.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.921 -0.581 . . . . 53.75 109.819 177.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' VAL . . . . . . . . . . . . . 98.5 t -126.92 120.91 56.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.637 -1.246 . . . . 48.37 107.637 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' THR . . . . . 0.413 ' HB ' HG22 ' H' ' 11' ' ' VAL . 42.2 m -117.22 129.91 56.24 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.765 -0.828 . . . . 58.41 108.765 -179.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' VAL . . . . . . . . . . . . . 38.4 t -120.37 109.2 24.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 106.776 -1.564 . . . . 45.53 106.776 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' SER . . . . . . . . . . . . . 25.7 t -147.89 151.17 35.44 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.782 -0.821 . . . . 52.29 108.782 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' SER . . . . . . . . . . . . . 91.4 p -88.21 -1.65 58.14 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.652 -0.703 . . . . 51.45 112.316 176.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.77 160.47 31.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.95 0.881 . . . . 57.97 110.651 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' SER . . . . . . . . . . . . . 32.3 m -107.24 155.17 20.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.148 -0.933 . . . . 55.77 109.01 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' THR . . . . . . . . . . . . . 6.6 m -53.11 129.89 32.44 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.774 -0.648 . . . . 52.53 110.01 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -147.28 128.3 14.57 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.079 -0.51 . . . . 73.56 109.684 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.39 156.96 50.49 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.791 -0.923 . . . . 44.45 110.791 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . 0.522 ' HB3' ' HB3' ' H' ' 150' ' ' TYR . 86.7 Cg_endo -84.57 164.03 12.45 Favored 'Trans proline' 0 C--N 1.326 -0.619 0 CA-C-O 122.355 0.898 . . . . 54.87 112.452 -173.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' SER . . . . . . . . . . . . . 48.3 m -101.98 130.63 48.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.443 -1.253 . . . . 63.66 108.044 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' VAL . . . . . . . . . . . . . 75.8 t -114.75 122.82 69.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.523 -0.917 . . . . 51.57 108.523 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -124.63 144.9 47.72 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-N 116.199 -0.455 . . . . 51.08 109.981 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -81.49 143.36 13.62 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 CA-C-O 121.548 0.562 . . . . 60.2 111.892 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' LEU . . . . . . . . . . . . . 80.2 mt -102.41 94.91 5.93 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 106.274 -1.75 . . . . 52.28 106.274 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' ALA . . . . . . . . . . . . . . . -74.89 145.42 81.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.776 -0.647 . . . . 66.0 110.805 -170.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -85.24 163.34 11.35 Favored 'Trans proline' 0 C--N 1.33 -0.406 0 C-N-CA 121.352 1.368 . . . . 92.61 112.321 173.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' SER . . . . . . . . . . . . . 34.7 t . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 114.852 -1.067 . . . . 111.79 111.274 175.509 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 113.492 0.157 . . . . 88.31 113.492 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' THR . . . . . . . . . . . . . 1.4 t -114.54 146.26 40.95 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.376 0.608 . . . . 78.66 110.664 -177.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' ALA . . . . . . . . . . . . . . . -132.58 166.75 21.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.374 -0.83 . . . . 70.5 108.957 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' ALA . . . . . . . . . . . . . . . -134.13 144.27 48.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.744 -0.662 . . . . 60.76 109.57 -178.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' LEU . . . . . . . . . . . . . 2.9 pp -150.01 153.72 36.99 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 107.503 -1.295 . . . . 68.77 107.503 175.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' GLY . . . . . . . . . . . . . . . -156.75 -167.92 18.66 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 118.431 -1.842 . . . . 52.78 114.255 -171.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' CYS . . . . . . . . . . . . . 1.2 m -136.96 128.33 28.26 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 124.558 1.143 . . . . 92.27 111.339 -174.999 -97.939 173.054 -167.073 103.816 1.967 96.391 149.165 -155.384 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' LEU . . . . . . . . . . . . . 4.8 tp -96.63 111.73 23.76 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 107.532 -1.285 . . . . 56.2 107.532 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 147' ' ' VAL . . . . . . . . . . . . . 94.9 t -105.42 103.61 15.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 105.963 -1.866 . . . . 52.13 105.963 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 148' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -120.96 140.62 51.62 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 123.014 0.526 . . . . 58.56 112.069 -162.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 149' ' ' ASP . . . . . 0.436 ' OD1' ' NE2' ' H' ' 176' ' ' GLN . 69.7 m-20 58.97 63.03 1.72 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.32 1.048 . . . . 80.25 112.607 168.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' TYR . . . . . 0.522 ' HB3' ' HB3' ' H' ' 124' ' ' PRO . 53.2 p90 -123.47 161.15 25.41 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.529 -0.76 . . . . 55.17 110.323 172.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -162.86 135.61 4.27 Favored Pre-proline 0 C--O 1.239 0.525 0 N-CA-C 108.14 -1.059 . . . . 53.5 108.14 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -97.0 -171.98 2.77 Favored 'Cis proline' 0 N--CA 1.462 -0.373 0 C-N-CA 123.113 -1.62 . . . . 55.63 111.44 -0.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -63.41 156.84 68.21 Favored Pre-proline 0 N--CA 1.448 -0.571 0 N-CA-C 109.355 -0.609 . . . . 78.62 109.355 167.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -101.71 -172.58 1.66 Allowed 'Cis proline' 0 N--CA 1.462 -0.377 0 CA-C-O 122.531 0.971 . . . . 45.82 114.424 -4.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' VAL . . . . . . . . . . . . . 2.5 t -141.1 136.73 33.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 113.462 -1.699 . . . . 61.58 107.553 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' THR . . . . . . . . . . . . . 26.9 m -106.37 121.18 43.72 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.856 -0.794 . . . . 54.85 108.856 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 20.5 t -112.99 130.88 66.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.315 -0.995 . . . . 56.29 108.315 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' SER . . . . . . . . . . . . . 14.8 p -138.07 157.73 45.74 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.953 -1.129 . . . . 57.08 107.953 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -117.16 130.4 56.58 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.852 -0.613 . . . . 61.46 109.577 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 49.41 43.66 23.52 Favored 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.789 0.68 . . . . 61.2 110.903 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' SER . . . . . . . . . . . . . 19.0 m 60.26 40.97 17.22 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.623 -0.717 . . . . 59.65 111.537 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' GLY . . . . . . . . . . . . . . . 81.28 -3.17 78.83 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 115.263 0.865 . . . . 61.01 115.263 -178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' ALA . . . . . . . . . . . . . . . -74.92 -7.88 54.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.55 1.175 . . . . 63.76 112.994 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' LEU . . . . . . . . . . . . . 40.2 tp -131.11 110.54 11.26 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.816 -1.179 . . . . 65.32 107.816 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' THR . . . . . . . . . . . . . 70.8 p -123.39 -37.08 2.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.972 0.73 . . . . 69.4 112.972 -177.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' SER . . . . . . . . . . . . . 6.2 t -63.17 122.57 16.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.828 0.347 . . . . 85.74 110.538 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' GLY . . . . . . . . . . . . . . . 94.8 1.33 63.58 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 115.382 0.913 . . . . 63.74 115.382 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' VAL . . . . . . . . . . . . . 69.0 t -86.8 129.29 38.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 118.706 1.253 . . . . 59.24 109.676 -173.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -123.32 114.31 20.03 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.182 -1.044 . . . . 66.77 108.182 172.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' THR . . . . . . . . . . . . . 98.1 m -106.36 112.51 25.56 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.587 -1.634 . . . . 55.34 106.587 171.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -77.96 152.07 79.55 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.062 -0.517 . . . . 53.01 111.037 -174.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -62.34 149.19 91.64 Favored 'Trans proline' 0 C--N 1.331 -0.359 0 CA-C-O 121.435 0.514 . . . . 51.8 110.82 173.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ALA . . . . . . . . . . . . . . . -76.46 134.85 39.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.663 -0.698 . . . . 53.63 110.507 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' VAL . . . . . . . . . . . . . 30.9 m -92.99 139.82 17.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 108.322 -0.992 . . . . 67.31 108.322 169.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' LEU . . . . . 0.472 HD23 ' O ' ' H' ' 176' ' ' GLN . 6.3 tt -83.34 128.5 34.56 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.971 -0.751 . . . . 79.13 108.971 175.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' GLN . . . . . 0.472 ' O ' HD23 ' H' ' 175' ' ' LEU . 30.5 mt-30 -94.52 167.71 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.805 0.812 . . . . 94.33 110.64 -179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' SER . . . . . . . . . . . . . 2.7 t -58.0 -24.57 58.7 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.713 -0.676 . . . . 78.95 112.585 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' SER . . . . . . . . . . . . . 44.3 p -74.73 -18.91 60.43 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.262 0.838 . . . . 77.18 113.262 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' GLY . . . . . . . . . . . . . . . 103.61 -14.8 53.57 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 118.747 0.703 . . . . 59.48 113.733 -169.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' LEU . . . . . . . . . . . . . 14.1 mt -92.2 147.49 22.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.724 0.809 . . . . 47.58 110.94 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -88.93 160.02 17.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.274 -0.875 . . . . 48.09 110.332 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' SER . . . . . . . . . . . . . 27.9 t -145.52 150.9 37.28 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 107.511 -1.292 . . . . 70.03 107.511 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' LEU . . . . . . . . . . . . . 8.0 tt -154.89 156.34 35.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.142 -0.688 . . . . 55.68 109.142 -165.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' SER . . . . . . . . . . . . . 9.3 t -133.56 138.21 45.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.282 -0.872 . . . . 67.26 109.625 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' SER . . . . . . . . . . . . . 28.0 t -125.63 136.37 53.18 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.258 -1.016 . . . . 49.04 108.258 171.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' VAL . . . . . . . . . . . . . 29.4 m -135.35 166.99 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-O 121.815 0.817 . . . . 56.41 109.007 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' VAL . . . . . . . . . . . . . 7.3 p -155.27 136.11 4.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 107.526 -1.287 . . . . 58.11 107.526 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' THR . . . . . . . . . . . . . 13.4 p -92.77 146.7 23.44 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.293 -0.632 . . . . 52.56 109.293 172.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' VAL . . . . . . . . . . . . . 31.6 m -143.9 156.89 58.72 Favored Pre-proline 0 C--O 1.242 0.704 0 N-CA-C 108.886 -0.783 . . . . 67.31 108.886 -176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -53.87 120.75 8.4 Favored 'Trans proline' 0 C--O 1.236 0.383 0 N-CA-C 110.558 -0.593 . . . . 83.51 110.558 167.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' SER . . . . . . . . . . . . . 23.4 t -59.57 -22.77 62.22 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.463 0.542 . . . . 93.52 112.463 -177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' SER . . . . . 0.476 ' N ' ' O ' ' H' ' 404' ' ' HOH . 77.8 p -65.86 -6.86 13.47 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.288 0.847 . . . . 72.62 113.288 176.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' SER . . . . . . . . . . . . . 81.0 p -102.31 -7.32 22.17 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.275 0.843 . . . . 73.89 113.275 -177.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.32 -25.72 67.32 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 118.409 0.55 . . . . 76.37 112.273 -173.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' GLY . . . . . . . . . . . . . . . -89.32 -19.24 50.57 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.669 -0.777 . . . . 94.38 113.941 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' THR . . . . . . . . . . . . . 41.8 p -114.88 -41.37 3.37 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.874 1.064 . . . . 93.32 113.874 -172.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -86.45 136.67 33.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 118.445 0.566 . . . . 79.67 110.206 -178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' THR . . . . . . . . . . . . . 9.0 m -93.77 135.05 35.47 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.155 -0.683 . . . . 68.2 109.155 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -120.49 110.17 16.16 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.825 -0.805 . . . . 60.34 108.825 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' ILE . . . . . . . . . . . . . 22.3 mt -114.52 121.49 66.74 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 CA-C-O 121.515 0.674 . . . . 63.37 109.281 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.41 132.71 46.02 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.782 -1.099 . . . . 83.0 110.807 171.294 -155.384 149.165 -167.073 96.391 1.967 103.816 173.054 -97.939 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -118.36 121.93 41.58 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.397 -0.964 . . . . 51.42 108.397 171.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' VAL . . . . . . . . . . . . . 59.9 t -126.98 121.58 58.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 108.638 -0.875 . . . . 55.7 108.638 -175.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -121.0 127.94 52.24 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.742 0.817 . . . . 54.71 109.094 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -125.21 91.78 3.49 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 106.395 -1.705 . . . . 44.07 106.395 176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -57.96 -37.93 61.14 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.528 1.307 . . . . 78.44 114.528 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -66.53 -23.52 49.98 Favored 'Trans proline' 0 C--O 1.236 0.413 0 CA-C-N 122.033 1.762 . . . . 46.18 114.366 -175.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' SER . . . . . . . . . . . . . 92.5 p -101.58 -6.06 24.32 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 119.309 0.959 . . . . 53.6 113.215 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' ASN . . . . . . . . . . . . . 64.7 t30 65.37 44.55 3.13 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.553 0.692 . . . . 54.35 111.524 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' THR . . . . . . . . . . . . . 11.1 p -130.85 128.37 40.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.779 -0.823 . . . . 57.05 108.779 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' LYS . . . . . 0.462 ' NZ ' ' OD1' ' H' ' 213' ' ' ASP . 5.6 tptp -130.17 129.9 44.04 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.939 -1.504 . . . . 67.11 106.939 168.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' VAL . . . . . . . . . . . . . 25.4 m -134.99 153.91 35.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 121.461 0.648 . . . . 49.21 109.715 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' ASP . . . . . 0.462 ' OD1' ' NZ ' ' H' ' 211' ' ' LYS . 66.9 m-20 -118.93 134.55 55.11 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.336 -0.847 . . . . 65.16 108.963 174.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -125.78 113.8 17.77 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.088 -0.708 . . . . 54.92 109.088 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -71.35 136.15 47.67 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.114 0.483 . . . . 67.26 110.095 172.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' VAL . . . . . . . . . . . . . 49.1 t -112.53 125.05 69.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.427 -0.953 . . . . 56.62 108.427 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -141.07 154.79 68.49 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 116.218 -0.446 . . . . 99.82 110.075 -168.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 218' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo . . . . . 0 C--N 1.343 0.238 0 C-N-CA 123.187 2.591 . . . . 83.62 112.727 173.218 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' GLU . . . . . . . . . . . . . 23.6 tp10 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 108.551 -0.907 . . . . 120.74 108.551 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' ILE . . . . . 0.485 HD13 ' OE1' ' L' ' 91' ' ' GLN . 3.9 tt -75.57 136.55 24.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 118.587 -1.245 . . . . 77.43 109.251 172.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' VAL . . . . . . . . . . . . . 19.9 t -119.25 119.6 61.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 N-CA-C 108.335 -0.987 . . . . 64.88 108.335 -178.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 32.7 mt -94.29 122.29 36.69 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.438 -0.949 . . . . 64.74 108.438 170.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' THR . . . . . . . . . . . . . 91.6 m -111.46 115.43 29.21 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.366 -0.605 . . . . 59.99 109.366 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -94.12 145.02 24.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.984 0.421 . . . . 57.6 110.111 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' SER . . . . . . . . . . . . . 3.0 p -147.18 144.67 20.05 Favored Pre-proline 0 C--O 1.24 0.573 0 N-CA-C 108.264 -1.013 . . . . 68.73 108.264 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -75.13 172.45 62.99 Favored 'Cis proline' 0 N--CA 1.464 -0.25 0 C-N-CA 123.58 -1.425 . . . . 67.23 110.182 -7.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.86 -41.97 99.77 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 119.476 -1.345 . . . . 67.47 112.086 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' THR . . . . . . . . . . . . . 52.2 m -133.94 137.57 44.95 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.278 -1.008 . . . . 67.99 108.278 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' L' ' 13' ' ' LEU . 60.6 tp -124.17 124.0 41.52 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.864 -1.162 . . . . 69.78 107.864 -177.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -117.41 104.01 10.68 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.634 -0.506 . . . . 67.97 109.634 -168.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' L' ' 11' ' ' LEU . 1.3 mp -131.44 162.12 30.93 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.912 0.863 . . . . 65.24 110.484 -178.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' SER . . . . . . . . . . . . . 27.1 t -80.66 153.35 73.21 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 114.516 -1.22 . . . . 75.21 110.563 173.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 15' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -66.0 139.11 55.04 Favored 'Trans proline' 0 C--N 1.332 -0.298 0 CA-C-O 121.329 0.471 . . . . 68.65 111.621 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.91 -16.14 61.46 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.612 -0.722 . . . . 69.65 114.215 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 17' ' ' GLU . . . . . 0.433 ' OE2' HD23 ' L' ' 13' ' ' LEU . 72.5 tt0 -87.4 157.98 19.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.367 1.467 . . . . 112.09 109.893 -176.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 18' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -85.62 141.61 29.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.867 -0.606 . . . . 86.03 110.789 -177.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 19' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' L' ' 404' ' ' HOH . . . -114.48 135.52 54.02 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.063 -0.517 . . . . 51.0 110.037 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 20' ' ' THR . . . . . 0.428 ' N ' ' O ' ' L' ' 404' ' ' HOH . 1.7 m -123.52 120.87 34.15 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.068 -0.716 . . . . 61.2 109.068 176.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . 7.0 mp -120.15 140.18 51.5 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.795 -0.817 . . . . 47.66 108.795 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 22' ' ' SER . . . . . . . . . . . . . 1.3 t -120.85 147.7 45.03 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.383 0.611 . . . . 61.76 111.08 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 23' ' ' CYS . . . . . . . . . . . . . 51.3 t -136.8 112.83 9.69 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.702 -1.592 . . . . 79.19 106.702 179.58 -178.216 114.167 71.018 106.078 2.055 106.576 157.761 62.081 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -108.12 133.18 52.76 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.784 -0.821 . . . . 73.97 108.784 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.07 145.18 29.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.311 0.577 . . . . 67.09 110.657 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -65.21 -36.4 84.06 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.59 -0.732 . . . . 70.23 111.061 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -131.77 170.8 14.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.896 -0.779 . . . . 87.26 108.896 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 28' ' ' SER . . . . . . . . . . . . . 42.6 t -76.12 133.41 40.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.858 -0.61 . . . . 77.07 111.218 -169.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 t -89.33 84.94 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 105.684 -1.969 . . . . 76.6 105.684 171.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.21 74.77 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.377 -0.916 . . . . 62.96 113.546 -173.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 31' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -14.32 59.81 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.117 0.784 . . . . 71.68 113.117 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 32' ' ' SER . . . . . . . . . . . . . 3.1 m 61.32 25.78 15.7 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.573 0.749 . . . . 52.48 111.373 -170.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 33' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.59 68.01 2.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 122.451 1.119 . . . . 66.36 108.985 173.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 34' ' ' LEU . . . . . 0.428 HD13 ' CD2' ' L' ' 72' ' ' PHE . 0.6 OUTLIER -120.72 131.8 54.72 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.109 -0.95 . . . . 69.85 109.528 179.922 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 35' ' ' ALA . . . . . . . . . . . . . . . -119.37 152.59 36.54 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.007 0.523 . . . . 47.17 110.342 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 36' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -118.79 137.63 53.25 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 109.082 -0.71 . . . . 50.75 109.082 170.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 37' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -125.81 144.51 50.62 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.916 0.389 . . . . 57.03 110.234 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 38' ' ' GLN . . . . . 0.553 ' HB2' HD11 ' L' ' 48' ' ' LEU . 48.3 tt0 -105.09 136.77 43.96 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.129 -0.693 . . . . 55.12 109.129 173.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 39' ' ' GLN . . . . . 0.428 ' O ' ' HB1' ' L' ' 85' ' ' ALA . 51.8 tt0 -128.47 103.42 7.12 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.289 -1.374 . . . . 63.37 107.289 174.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 40' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -73.86 151.65 88.78 Favored Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.108 -0.496 . . . . 68.59 109.74 173.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 41' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.45 118.86 4.4 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 120.678 0.918 . . . . 74.38 113.86 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.69 21.06 64.63 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.38 0.912 . . . . 62.8 115.38 176.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 43' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -133.12 159.23 40.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.379 1.089 . . . . 98.09 109.932 -177.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.95 150.61 90.44 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-N 115.089 -0.96 . . . . 68.24 109.665 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 45' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -65.66 159.09 49.96 Favored 'Trans proline' 0 C--N 1.332 -0.323 0 CA-C-O 122.01 0.754 . . . . 66.22 112.053 -177.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 46' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -128.63 139.27 52.35 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 114.954 -1.021 . . . . 71.86 109.217 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 47' ' ' LEU . . . . . . . . . . . . . 61.3 tp -68.16 132.9 48.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.583 -0.735 . . . . 56.85 110.128 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 48' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' L' ' 38' ' ' GLN . 80.2 mt -110.54 -54.32 2.6 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 112.543 0.571 . . . . 56.9 112.543 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 49' ' ' ILE . . . . . . . . . . . . . 13.2 mm -128.8 138.1 55.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.11 -1.07 . . . . 50.83 108.11 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 50' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -130.53 164.29 25.19 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.016 -0.735 . . . . 68.28 109.016 170.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 51' ' ' GLY . . . . . . . . . . . . . . . 51.97 18.6 4.54 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.771 -0.65 . . . . 53.75 113.552 -174.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 52' ' ' ALA . . . . . . . . . . . . . . . 73.79 -8.03 1.48 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.338 2.255 . . . . 59.83 113.918 170.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 53' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -144.15 3.22 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.873 1.064 . . . . 55.37 113.873 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -100.81 123.48 45.07 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 119.143 0.883 . . . . 53.69 109.895 -171.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 55' ' ' ARG . . . . . . . . . . . . . 41.5 ttm105 -77.01 131.87 38.68 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.173 -0.467 . . . . 86.05 110.099 -178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.06 158.37 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.904 0.859 . . . . 58.93 110.608 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 57' ' ' THR . . . . . . . . . . . . . 7.6 m -62.69 133.09 54.31 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.509 -0.769 . . . . 70.61 110.164 -178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.5 22.53 72.6 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 115.59 0.996 . . . . 70.32 115.59 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 59' ' ' ILE . . . . . . . . . . . . . 15.9 mm -103.3 131.29 22.23 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 118.485 1.142 . . . . 69.66 108.068 177.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 155.78 11.06 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 120.51 0.807 . . . . 76.73 113.249 178.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 61' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -72.54 -16.91 61.76 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.295 0.85 . . . . 119.47 113.295 -172.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 62' ' ' ARG . . . . . . . . . . . . . 31.7 ptt-85 -75.23 -15.02 60.57 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.748 0.647 . . . . 66.24 112.748 -176.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -85.35 139.61 31.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.684 -0.487 . . . . 65.37 109.684 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 64' ' ' SER . . . . . . . . . . . . . 35.7 p -161.03 145.27 13.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.65 -0.87 . . . . 70.45 108.65 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 65' ' ' GLY . . . . . . . . . . . . . . . -120.93 152.65 16.77 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.707 -0.957 . . . . 48.02 110.707 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 66' ' ' SER . . . . . . . . . . . . . 51.8 p -157.26 166.36 33.36 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.342 -0.984 . . . . 62.65 108.342 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 67' ' ' GLY . . . . . . . . . . . . . . . 112.88 178.33 19.62 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-O 122.337 0.965 . . . . 48.97 111.768 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 68' ' ' SER . . . . . . . . . . . . . 80.2 p -172.47 166.99 5.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 107.837 -1.171 . . . . 57.87 107.837 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.97 -110.06 3.1 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.374 -0.83 . . . . 58.91 112.646 179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 70' ' ' THR . . . . . . . . . . . . . 73.3 p -108.39 -0.78 20.42 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 113.35 0.87 . . . . 62.03 113.35 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 71' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -133.15 121.8 23.1 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.012 0.824 . . . . 68.69 110.195 -173.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 72' ' ' PHE . . . . . 0.428 ' CD2' HD13 ' L' ' 34' ' ' LEU . 83.7 m-85 -129.76 149.43 51.51 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.286 -0.635 . . . . 50.55 109.286 178.648 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 73' ' ' THR . . . . . . . . . . . . . 92.6 m -134.04 140.86 46.95 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.728 -0.669 . . . . 48.98 110.37 -175.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 74' ' ' LEU . . . . . . . . . . . . . 24.5 tp -113.18 130.61 56.16 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 108.502 -0.925 . . . . 57.24 108.502 170.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 75' ' ' THR . . . . . . . . . . . . . 28.0 m -118.7 125.61 50.06 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.103 -0.703 . . . . 62.95 109.103 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 76' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.63 111.65 36.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 106.17 -1.789 . . . . 59.92 106.17 171.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 77' ' ' SER . . . . . . . . . . . . . 51.8 p -78.28 -29.66 48.07 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.323 -0.951 . . . . 89.15 112.729 -165.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 -143.71 100.78 3.65 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.023 -1.473 . . . . 96.36 107.023 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.4 111.99 3.32 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.617 -0.512 . . . . 69.64 109.617 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 80' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -83.33 162.74 52.95 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 109.35 -0.611 . . . . 97.61 109.35 168.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 81' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -54.99 -36.96 93.8 Favored 'Trans proline' 0 C--O 1.237 0.433 0 N-CA-C 113.203 0.424 . . . . 72.45 113.203 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 82' ' ' GLU . . . . . 0.673 ' OE1' ' O ' ' L' ' 402' ' ' HOH . 2.0 pt-20 -67.54 -13.21 61.86 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.268 0.84 . . . . 101.26 113.268 178.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 83' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -85.53 -6.01 59.23 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 113.557 0.947 . . . . 74.64 113.557 -174.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 84' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.56 90.12 7.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 122.051 0.929 . . . . 67.01 108.87 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 85' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' L' ' 39' ' ' GLN . . . -142.31 -166.14 2.18 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.648 -1.241 . . . . 49.24 107.648 -172.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 86' ' ' VAL . . . . . . . . . . . . . 9.4 t -107.94 142.34 20.86 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.77 -1.196 . . . . 54.75 107.77 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 87' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -123.03 132.22 54.03 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.729 -0.471 . . . . 55.73 109.729 -177.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 88' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -114.09 139.49 49.27 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.265 0.626 . . . . 55.66 110.157 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 89' ' ' CYS . . . . . . . . . . . . . 29.2 p -99.46 157.0 16.73 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.617 -0.883 . . . . 83.8 108.617 166.356 62.081 157.761 71.018 106.576 2.055 106.078 114.167 -178.216 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 90' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -152.9 135.92 15.56 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.567 -0.742 . . . . 61.14 109.367 -173.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 91' ' ' GLN . . . . . 0.485 ' OE1' HD13 ' L' ' 2' ' ' ILE . 15.2 tt0 -98.7 128.31 44.92 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.565 -0.902 . . . . 89.67 108.565 166.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 92' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -119.72 -177.86 3.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.618 0.723 . . . . 63.69 109.692 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.96 -10.1 69.6 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 115.671 1.028 . . . . 78.42 115.671 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 94' ' ' SER . . . . . . . . . . . . . 83.6 p -154.18 -165.18 2.03 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.972 1.386 . . . . 100.26 108.977 -168.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 95' ' ' SER . . . . . 0.689 ' HB2' ' HD3' ' L' ' 96' ' ' PRO . 14.5 m -46.82 -65.11 0.76 Allowed Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 116.125 1.898 . . . . 99.42 116.125 -146.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 96' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' L' ' 95' ' ' SER . 11.7 Cg_endo -97.86 -5.35 1.02 Allowed 'Trans proline' 0 C--N 1.354 0.828 0 CA-C-N 121.381 1.529 . . . . 81.07 115.305 -176.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 97' ' ' TRP . . . . . . . . . . . . . 32.3 m-90 47.69 51.68 13.68 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.626 0.727 . . . . 75.69 111.201 -167.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 98' ' ' THR . . . . . . . . . . . . . 77.0 m -65.32 145.81 55.72 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.589 0.709 . . . . 75.75 111.792 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 99' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -108.12 153.16 23.55 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.964 0.905 . . . . 54.51 110.216 176.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.77 169.45 54.41 Favored Glycine 0 N--CA 1.446 -0.65 0 N-CA-C 110.929 -0.868 . . . . 58.63 110.929 164.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 101' ' ' GLN . . . . . . . . . . . . . 10.3 pm0 -81.15 -15.45 55.8 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 119.825 -0.75 . . . . 74.06 112.873 -176.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.42 144.55 12.66 Favored Glycine 0 C--O 1.237 0.343 0 CA-C-N 118.387 0.54 . . . . 55.6 113.73 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 103' ' ' THR . . . . . . . . . . . . . 24.5 m -120.91 129.5 53.5 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.749 0.82 . . . . 55.84 108.799 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 104' ' ' LYS . . . . . 0.438 ' HE2' ' HB3' ' L' ' 106' ' ' GLU . 63.8 tttt -104.48 128.0 52.31 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.455 -0.572 . . . . 76.62 109.455 -179.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 105' ' ' VAL . . . . . . . . . . . . . 23.5 t -104.32 111.01 32.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.475 -1.306 . . . . 63.53 107.475 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 106' ' ' GLU . . . . . 0.438 ' HB3' ' HE2' ' L' ' 104' ' ' LYS . 0.9 OUTLIER -112.28 165.34 12.27 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.705 0.765 . . . . 103.9 110.262 -179.785 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 107' ' ' ILE . . . . . . . . . . . . . 6.4 mt -82.51 131.24 34.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.29 -0.868 . . . . 80.92 109.78 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 108' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -91.62 133.67 35.36 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.73 -0.471 . . . . 72.1 109.73 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 109' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -137.97 177.14 8.1 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.311 -0.996 . . . . 62.46 108.311 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -76.32 154.99 34.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.784 0.802 . . . . 74.33 110.33 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 111' ' ' VAL . . . . . . . . . . . . . 73.2 t -56.31 138.11 17.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 CA-C-N 115.124 -0.944 . . . . 73.96 110.604 -175.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 112' ' ' ALA . . . . . . . . . . . . . . . -129.58 127.44 40.68 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.705 -0.85 . . . . 63.79 108.705 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 113' ' ' ALA . . . . . . . . . . . . . . . -83.51 138.78 41.24 Favored Pre-proline 0 C--O 1.234 0.265 0 O-C-N 123.319 0.387 . . . . 66.09 110.333 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 114' ' ' PRO . . . . . 0.497 ' HB3' ' HB3' ' L' ' 140' ' ' PHE . 82.4 Cg_endo -74.74 146.81 34.27 Favored 'Trans proline' 0 C--N 1.33 -0.401 0 C-N-CA 120.274 0.649 . . . . 63.73 112.389 -176.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 115' ' ' SER . . . . . . . . . . . . . 13.9 m -87.61 125.43 34.36 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 107.905 -1.146 . . . . 72.97 107.905 167.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 116' ' ' VAL . . . . . . . . . . . . . 19.8 t -104.51 135.39 42.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 109.882 -0.414 . . . . 59.8 109.882 -171.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 117' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -135.3 144.03 46.54 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.604 -0.887 . . . . 56.0 108.604 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 118' ' ' ILE . . . . . . . . . . . . . 19.8 tt -119.36 144.45 27.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 108.491 -0.929 . . . . 62.42 108.491 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 119' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -127.67 121.33 22.12 Favored Pre-proline 0 C--O 1.249 1.048 0 N-CA-C 109.039 -0.726 . . . . 58.09 109.039 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 120' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.71 155.24 58.91 Favored 'Trans proline' 0 C--O 1.24 0.613 0 C-N-CA 120.632 0.888 . . . . 56.96 110.735 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 121' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -61.2 143.65 98.59 Favored 'Trans proline' 0 C--N 1.331 -0.342 0 N-CA-C 110.661 -0.553 . . . . 60.67 110.661 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 122' ' ' SER . . . . . . . . . . . . . 99.2 p -77.63 157.36 30.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.944 0.878 . . . . 57.78 110.674 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 123' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -59.46 -34.96 73.19 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.117 -0.947 . . . . 101.99 111.47 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 124' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -64.47 -42.23 96.03 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.4 -0.52 . . . . 75.91 110.872 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 125' ' ' GLN . . . . . 0.904 ' OE1' ' O ' ' L' ' 401' ' ' HOH . 34.6 tt0 -63.99 -43.89 94.32 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.581 -0.847 . . . . 61.15 111.132 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 126' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.24 -37.09 81.81 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.389 -0.524 . . . . 66.53 111.392 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 127' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -64.91 -22.64 67.03 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.309 0.485 . . . . 81.64 112.309 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 128' ' ' SER . . . . . . . . . . . . . 10.0 p -89.61 -8.26 52.95 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.99 0.737 . . . . 77.24 112.99 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 129' ' ' GLY . . . . . . . . . . . . . . . 99.32 8.96 52.3 Favored Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 116.927 1.531 . . . . 80.32 116.927 174.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -122.17 165.59 15.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.897 1.349 . . . . 76.73 109.64 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 131' ' ' ALA . . . . . . . . . . . . . . . -143.03 118.61 10.39 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.57 -0.9 . . . . 67.39 108.57 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 132' ' ' SER . . . . . . . . . . . . . 73.1 m -121.33 127.49 51.33 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.799 -0.815 . . . . 67.31 108.799 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 t -109.01 134.56 50.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.474 -1.306 . . . . 63.32 107.474 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 134' ' ' VAL . . . . . . . . . . . . . 95.9 t -124.23 130.58 73.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.271 -0.64 . . . . 57.72 109.271 -170.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 135' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.72 133.42 55.86 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.61 -1.256 . . . . 93.04 107.61 173.349 -174.099 117.75 60.024 106.698 2.05 106.109 155.248 66.548 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 136' ' ' LEU . . . . . . . . . . . . . 7.0 tp -117.54 128.17 54.7 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.883 -0.414 . . . . 63.81 109.883 -176.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 137' ' ' LEU . . . . . . . . . . . . . 11.0 mp -105.57 113.48 27.08 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 107.099 -1.445 . . . . 62.47 107.099 173.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 138' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -107.26 124.27 49.52 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.746 -0.206 . . . . 56.43 110.838 -168.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 139' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 58.11 63.84 1.66 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.983 0.913 . . . . 74.68 112.207 164.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 140' ' ' PHE . . . . . 0.497 ' HB3' ' HB3' ' L' ' 114' ' ' PRO . 48.8 p90 -120.5 160.48 23.07 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.473 -0.785 . . . . 60.78 110.824 179.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 141' ' ' TYR . . . . . 0.428 ' CG ' ' HA ' ' L' ' 142' ' ' PRO . 58.6 t80 -155.01 138.25 10.71 Favored Pre-proline 0 C--O 1.24 0.574 0 N-CA-C 107.267 -1.383 . . . . 68.57 107.267 175.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 142' ' ' PRO . . . . . 0.428 ' HA ' ' CG ' ' L' ' 141' ' ' TYR . 72.0 Cg_endo -78.56 -171.41 9.84 Favored 'Cis proline' 0 CA--C 1.531 0.327 0 N-CA-C 113.898 0.691 . . . . 53.4 113.898 1.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 143' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -73.5 -27.33 61.32 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 123.583 0.552 . . . . 77.42 112.335 -167.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 144' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -70.71 122.18 19.34 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 122.055 -0.403 . . . . 105.42 110.168 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 145' ' ' ALA . . . . . . . . . . . . . . . -143.69 167.75 21.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.645 -1.243 . . . . 71.16 107.645 170.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 146' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.96 138.53 40.69 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.721 -0.844 . . . . 92.94 108.721 173.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 147' ' ' VAL . . . . . 0.486 HG22 HG22 ' L' ' 197' ' ' VAL . 69.8 t -125.29 120.29 57.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 107.975 -1.12 . . . . 63.91 107.975 -176.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 148' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -109.09 137.62 46.7 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.827 0.346 . . . . 111.71 110.355 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 149' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -102.26 138.61 38.97 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.808 -0.633 . . . . 73.41 109.841 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 150' ' ' LYS . . . . . . . . . . . . . 7.0 mtpt -132.34 116.29 16.67 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.028 -0.73 . . . . 84.64 109.028 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 151' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.43 105.76 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 106.494 -1.669 . . . . 67.15 106.494 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 152' ' ' ASP . . . . . 0.516 ' OD1' ' HG3' ' L' ' 191' ' ' LYS . 86.6 m-20 54.72 49.78 17.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.882 0.848 . . . . 113.91 111.068 -172.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 153' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.21 33.87 23.57 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.115 -0.948 . . . . 94.14 111.709 178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 154' ' ' ALA . . . . . . . . . . . . . . . -118.46 121.83 41.25 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 107.709 -1.219 . . . . 76.47 107.709 173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.3 124.09 25.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.903 -0.589 . . . . 88.81 110.246 -170.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 156' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -85.48 163.74 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.47 0.652 . . . . 64.04 110.345 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 157' ' ' SER . . . . . . . . . . . . . 13.4 t -167.7 136.5 2.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.541 -0.754 . . . . 64.24 109.306 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 158' ' ' GLY . . . . . . . . . . . . . . . 80.58 2.36 89.66 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 115.442 0.937 . . . . 56.44 115.442 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 159' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -126.14 23.87 7.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 118.71 1.255 . . . . 71.56 111.858 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 160' ' ' SER . . . . . . . . . . . . . 25.1 p -128.91 150.9 50.17 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.185 -0.672 . . . . 68.58 109.185 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 161' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -130.87 149.56 52.44 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.943 -0.762 . . . . 94.16 108.943 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 162' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -134.77 140.01 45.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.849 -0.614 . . . . 96.5 110.304 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 163' ' ' SER . . . . . . . . . . . . . 1.2 t -127.61 147.83 50.36 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.841 -1.17 . . . . 65.36 107.841 174.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 164' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.5 136.34 60.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.346 -0.612 . . . . 48.82 109.346 -175.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 165' ' ' THR . . . . . . . . . . . . . 18.9 p -70.53 162.86 28.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.849 0.833 . . . . 63.67 109.951 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 166' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -77.7 165.91 23.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 118.669 -1.212 . . . . 91.58 108.997 166.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 167' ' ' GLN . . . . . 0.411 ' HG2' ' HA ' ' L' ' 172' ' ' SER . 32.8 tt0 -59.05 127.43 32.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 66.5 110.525 -174.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 168' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.16 145.07 52.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.698 0.761 . . . . 86.96 110.726 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.82 -28.9 44.49 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.473 -0.785 . . . . 96.03 112.228 -176.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 170' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -87.15 -37.66 17.14 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 119.749 -0.78 . . . . 94.47 112.856 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 171' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -133.03 6.58 3.93 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.403 0.89 . . . . 91.96 113.403 -174.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 172' ' ' SER . . . . . 0.411 ' HA ' ' HG2' ' L' ' 167' ' ' GLN . 40.6 m 57.05 32.56 21.89 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.087 0.773 . . . . 64.12 113.087 170.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 173' ' ' THR . . . . . . . . . . . . . 71.0 p -100.84 178.39 4.7 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 122.094 0.95 . . . . 58.36 109.825 173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 174' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -121.49 155.65 34.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.275 -0.875 . . . . 69.88 109.487 176.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 175' ' ' SER . . . . . . . . . . . . . 7.7 m -126.94 149.1 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.235 -0.893 . . . . 59.28 108.8 170.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 176' ' ' LEU . . . . . . . . . . . . . 7.7 tt -136.89 139.18 41.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.492 -0.777 . . . . 51.92 109.041 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 177' ' ' SER . . . . . . . . . . . . . 4.8 p -123.44 133.51 54.05 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.029 -0.73 . . . . 61.35 109.029 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 178' ' ' SER . . . . . . . . . . . . . 14.3 t -120.0 134.19 55.32 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.882 -0.784 . . . . 68.45 108.882 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 179' ' ' THR . . . . . . . . . . . . . 7.4 m -124.62 113.3 17.85 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.519 -0.919 . . . . 68.46 108.519 -174.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 180' ' ' LEU . . . . . . . . . . . . . 59.2 tp -89.49 126.97 35.79 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 109.677 -0.49 . . . . 66.2 109.677 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 181' ' ' THR . . . . . . . . . . . . . 20.7 m -101.44 122.26 43.45 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.433 -0.581 . . . . 61.2 109.433 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 182' ' ' LEU . . . . . . . . . . . . . 16.7 mt -127.72 154.81 44.9 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.868 -0.79 . . . . 69.64 108.868 173.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 183' ' ' SER . . . . . . . . . . . . . 24.7 p -68.83 148.9 49.59 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 119.194 -1.002 . . . . 68.73 108.781 165.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 184' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -55.28 -40.32 70.89 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.041 -0.663 . . . . 66.37 110.996 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 185' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' L' ' 189' ' ' LYS . . . -57.92 -44.59 86.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.647 -0.421 . . . . 74.84 111.272 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 186' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.84 -44.87 88.42 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.495 -0.482 . . . . 108.62 111.543 -178.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 187' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.54 -35.27 73.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.584 -0.447 . . . . 69.99 111.269 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 188' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -75.45 -13.15 60.37 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.25 0.833 . . . . 86.02 113.25 -179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 189' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' L' ' 185' ' ' ALA . 35.4 mttp -85.06 -35.92 21.54 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.742 0.701 . . . . 111.65 112.863 -177.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 190' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -106.38 157.86 17.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.515 0.674 . . . . 81.19 111.089 -172.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 191' ' ' LYS . . . . . 0.516 ' HG3' ' OD1' ' L' ' 152' ' ' ASP . 2.2 ptpt -99.54 -55.76 2.58 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 113.14 0.792 . . . . 109.64 113.14 -169.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 192' ' ' VAL . . . . . 0.54 HG22 ' OD1' ' L' ' 211' ' ' ASN . 4.7 t -101.62 126.04 55.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 74.48 109.508 -166.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 193' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -120.34 123.74 43.85 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.726 -0.842 . . . . 64.4 108.726 176.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 194' ' ' ALA . . . . . . . . . . . . . . . -134.87 145.97 48.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.117 0.567 . . . . 66.71 109.751 -177.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 195' ' ' CYS . . . . . . . . . . . . . 28.2 p -116.61 132.98 56.54 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.795 -1.187 . . . . 94.53 107.795 167.562 66.548 155.248 60.024 106.109 2.05 106.698 117.75 -174.099 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 196' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -114.62 123.28 48.92 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.377 -0.972 . . . . 108.4 108.377 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 197' ' ' VAL . . . . . 0.486 HG22 HG22 ' L' ' 147' ' ' VAL . 56.1 t -113.81 132.25 63.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.016 -0.735 . . . . 66.13 109.016 -172.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 198' ' ' THR . . . . . . . . . . . . . 2.5 m -118.31 127.52 53.78 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.773 -0.825 . . . . 75.29 108.773 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 199' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -149.42 151.84 34.71 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.21 -0.663 . . . . 78.76 109.21 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 200' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -47.56 -41.92 22.48 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.236 -0.893 . . . . 100.45 112.303 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 201' ' ' GLY . . . . . . . . . . . . . . . -76.65 -5.56 83.42 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 115.796 1.078 . . . . 69.5 115.796 -176.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 202' ' ' LEU . . . . . . . . . . . . . 88.5 mt -100.73 129.81 46.67 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 118.052 0.926 . . . . 78.93 109.567 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 203' ' ' SER . . . . . . . . . . . . . 3.2 t -65.11 -47.31 77.61 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.526 -0.87 . . . . 96.65 111.523 178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 204' ' ' SER . . . . . . . . . . . . . 1.7 p -131.2 157.08 79.13 Favored Pre-proline 0 C--O 1.233 0.214 0 C-N-CA 125.929 1.691 . . . . 110.06 108.912 171.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 205' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -58.68 131.41 42.15 Favored 'Trans proline' 0 C--O 1.234 0.288 0 CA-C-O 121.581 0.575 . . . . 83.92 113.198 -175.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 206' ' ' VAL . . . . . . . . . . . . . 2.8 t -87.67 131.91 34.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.778 -0.823 . . . . 72.43 108.778 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 207' ' ' THR . . . . . . . . . . . . . 32.0 m -119.03 124.8 47.83 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 109.281 -0.637 . . . . 86.12 109.281 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 208' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -114.79 135.25 54.38 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.764 -1.198 . . . . 75.57 107.764 172.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 209' ' ' SER . . . . . . . . . . . . . 58.9 p -144.6 173.84 11.47 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 122.015 0.912 . . . . 62.02 110.645 -172.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 210' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -159.38 147.1 17.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 114.506 -1.224 . . . . 68.46 107.929 173.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 211' ' ' ASN . . . . . 0.54 ' OD1' HG22 ' L' ' 192' ' ' VAL . 3.4 m-20 -96.94 139.07 33.51 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.224 -0.658 . . . . 87.9 109.224 171.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 212' ' ' ARG . . . . . . . . . . . . . 44.5 ttp85 -64.14 141.48 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.368 0.604 . . . . 83.52 111.029 -172.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 213' ' ' GLY . . . . . . . . . . . . . . . 75.2 24.09 72.24 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 115.152 0.821 . . . . 115.62 115.152 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 214' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 118.222 1.011 . . . . 129.96 110.725 178.054 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 303' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 401' ' ' HOH . . . . . 0.762 ' O ' ' O ' ' H' ' 103' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 402' ' ' HOH . . . . . 0.709 ' O ' ' OD1' ' H' ' 90' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 403' ' ' HOH . . . . . 0.621 ' O ' ' OE1' ' H' ' 46' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 404' ' ' HOH . . . . . 0.476 ' O ' ' N ' ' H' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 401' ' ' HOH . . . . . 0.904 ' O ' ' OE1' ' L' ' 125' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 402' ' ' HOH . . . . . 0.673 ' O ' ' OE1' ' L' ' 82' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 404' ' ' HOH . . . . . 0.499 ' O ' ' HA ' ' L' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_