data_6iwb_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 6iwb _Structure_validation_residue.Date_analyzed 2019-12-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 120.919 0.177 . . . . 87.68 113.023 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -94.84 56.88 2.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 105.89 111.898 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptm85 -136.26 -48.12 0.65 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 119.088 -1.045 . . . . 97.36 112.157 172.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -59.05 -29.02 67.0 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 118.571 -1.251 . . . . 68.64 110.155 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -68.08 -35.24 77.85 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 121.23 -0.188 . . . . 81.24 111.274 173.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.86 -42.53 66.77 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.93 -0.708 . . . . 74.52 111.091 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -40.35 85.63 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.433 -0.507 . . . . 60.21 110.936 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.42 -45.77 91.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.679 -0.408 . . . . 52.68 110.871 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.69 -23.56 55.6 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.908 -0.663 . . . . 57.56 113.696 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -81.27 -34.54 31.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.813 0.806 . . . . 64.42 111.165 174.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.7 -50.78 69.8 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.398 -0.521 . . . . 58.76 110.683 171.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.07 -41.35 98.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.935 -0.306 . . . . 59.53 111.429 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -62.78 -38.04 89.04 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.533 -0.467 . . . . 101.05 111.259 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.38 -48.39 56.47 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.986 -0.686 . . . . 62.62 110.906 176.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 tt -51.95 -40.72 61.28 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.641 0.258 . . . . 64.36 110.853 173.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -52.43 -43.16 64.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.681 0.276 . . . . 72.53 111.341 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 39.6 t90 -70.1 -31.01 68.37 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 119.904 -0.718 . . . . 61.5 111.734 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.03 -31.56 35.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 118.873 -1.131 . . . . 60.09 110.36 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 m -64.71 -21.13 66.68 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.431 0.53 . . . . 57.34 112.431 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 t -64.05 -23.14 67.22 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.783 -0.767 . . . . 72.59 111.501 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.4 mt 49.49 39.52 16.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.531 0.681 . . . . 69.81 111.354 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.4 p -71.11 162.12 29.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.95 0.881 . . . . 76.32 110.456 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -46.85 -42.16 16.86 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.845 -1.071 . . . . 87.7 110.491 168.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -58.71 -47.17 85.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.335 -0.393 . . . . 88.08 111.082 172.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.5 t -67.28 -45.81 85.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.883 0.373 . . . . 72.21 110.787 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -61.33 -40.19 93.3 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.339 -0.544 . . . . 66.64 111.303 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.69 -41.27 97.35 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.333 -0.547 . . . . 88.71 110.962 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -64.81 -41.02 96.11 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.563 -0.455 . . . . 91.4 111.287 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.73 -13.72 36.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.268 0.84 . . . . 58.86 113.268 -175.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mt -88.14 -1.36 57.96 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.757 0.708 . . . . 64.48 112.213 176.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -106.95 176.29 5.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.1 0.96 . . . . 64.13 108.992 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.3 p -99.71 15.02 28.15 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.633 -0.712 . . . . 60.42 112.363 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -81.47 -27.83 34.41 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.378 0.51 . . . . 66.31 112.378 -178.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -80.27 -38.93 18.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 120.104 -0.638 . . . . 54.56 110.77 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.7 p -75.32 -30.38 60.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.052 -0.659 . . . . 48.2 111.899 176.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -65.94 -41.83 90.82 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.142 -0.623 . . . . 65.78 110.989 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.84 -39.97 94.41 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.471 -0.492 . . . . 58.13 111.214 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 mt -61.39 -37.98 85.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.675 -0.41 . . . . 56.5 111.48 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.3 ttp85 -66.36 -37.01 84.32 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.002 -0.679 . . . . 86.01 111.238 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.07 -54.71 37.53 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.979 0.419 . . . . 48.2 111.008 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.1 mt -62.19 -28.35 69.61 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.672 -0.411 . . . . 48.89 111.632 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.4 ttp -74.36 -48.6 27.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.718 -0.393 . . . . 56.73 110.935 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -65.55 -17.18 64.38 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.128 0.418 . . . . 53.97 112.128 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -81.46 -45.72 15.59 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 117.941 0.337 . . . . 54.03 110.788 170.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.2 m -56.46 -46.26 80.47 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.814 0.34 . . . . 45.4 111.057 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.88 -32.35 71.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.417 -0.513 . . . . 49.67 111.689 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -65.55 -52.01 55.6 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.375 -0.53 . . . . 57.15 111.023 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -63.93 -28.6 69.94 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.56 -0.456 . . . . 78.05 111.621 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 tp -76.41 -42.97 42.4 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.992 -0.283 . . . . 66.64 111.504 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.1 ttpp -65.58 -37.77 87.6 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.735 -0.386 . . . . 64.79 111.354 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.92 -12.94 60.81 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.717 0.636 . . . . 59.17 112.717 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -93.77 -29.91 15.13 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.643 0.608 . . . . 90.78 112.643 -178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . 0.794 ' NZ ' ' OE2' ' A' ' 66' ' ' GLU . 34.9 tttm -69.01 -35.78 77.04 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.096 -0.642 . . . . 87.61 110.605 170.374 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.2 m -65.22 -40.46 94.13 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.452 -0.499 . . . . 80.77 111.152 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -59.68 -34.63 73.12 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.645 -0.422 . . . . 84.96 111.51 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.7 mt -74.06 -44.65 53.41 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.23 -0.588 . . . . 95.34 110.949 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . 0.794 ' OE2' ' NZ ' ' A' ' 62' ' ' LYS . 26.1 mt-10 -53.23 -11.74 0.32 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.424 0.898 . . . . 113.41 113.424 178.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -89.4 -58.63 2.46 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.456 0.571 . . . . 110.56 111.151 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -75.79 -18.43 59.51 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.767 0.655 . . . . 111.89 112.767 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 101.87 0.42 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.788 -0.819 . . . . 119.17 108.788 170.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . 0.424 ' N ' ' CD ' ' A' ' 71' ' ' PRO . 7.8 p -112.41 -16.7 0.12 Allowed Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 116.348 1.981 . . . . 127.87 116.348 -173.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 70' ' ' THR . 45.6 Cg_exo -65.14 -39.1 24.86 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 CA-C-N 121.646 1.624 . . . . 129.12 113.966 -177.114 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 33.0 m 47.24 61.99 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 126.608 1.963 . . . . 126.61 114.574 170.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.46 113.74 16.74 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.384 -1.339 . . . . 121.31 107.384 161.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -104.23 -14.38 15.85 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 115.312 1.597 . . . . 134.03 115.312 -160.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -65.06 -30.83 71.82 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 119.396 0.998 . . . . 150.56 111.212 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 m -107.21 -1.42 21.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.643 0.609 . . . . 145.56 112.643 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 3.4 mtp-105 -90.52 -18.57 25.06 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.233 0.827 . . . . 131.93 113.233 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.34 -0.03 9.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.948 -0.701 . . . . 128.88 111.577 160.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . 0.452 ' NE ' ' OE2' ' A' ' 83' ' ' GLU . 8.7 ttt85 -109.42 -35.77 6.17 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.164 1.386 . . . . 133.18 112.421 167.298 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.6 mt -61.09 -69.69 0.22 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.577 0.751 . . . . 119.22 112.273 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . 0.648 ' OG ' ' OH ' ' A' ' 149' ' ' TYR . 61.3 m -61.35 -31.7 71.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.604 -0.439 . . . . 110.54 111.697 -177.164 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -65.48 -31.6 72.76 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.392 -0.523 . . . . 114.98 111.624 176.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . 0.452 ' OE2' ' NE ' ' A' ' 79' ' ' ARG . 73.5 mt-10 -71.23 -30.03 65.85 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.718 -0.393 . . . . 116.27 111.52 175.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.8 tp -92.98 -32.75 14.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.438 0.533 . . . . 82.92 112.438 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -63.32 -23.58 67.48 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.565 0.209 . . . . 95.25 111.565 169.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -88.6 -28.0 20.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.453 0.538 . . . . 82.27 112.453 170.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.57 -18.4 51.8 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.344 0.498 . . . . 72.72 112.344 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -82.06 -27.37 33.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.378 -0.529 . . . . 95.45 111.017 162.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.8 -29.11 69.94 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.535 -0.466 . . . . 58.81 111.242 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -74.94 -34.93 62.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.138 -0.625 . . . . 65.38 111.886 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.7 tp -68.61 -47.49 66.55 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.78 -0.768 . . . . 59.9 110.88 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -60.03 -27.28 64.54 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 119.909 -1.139 . . . . 50.34 112.641 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.64 -48.4 60.06 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.207 0.504 . . . . 41.78 111.192 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.93 -43.26 81.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.457 -0.497 . . . . 55.06 111.155 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.2 mtm -70.89 -29.96 66.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.379 -0.528 . . . . 48.03 111.696 -177.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.43 -38.62 81.36 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.697 -0.801 . . . . 58.91 110.898 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . 0.488 ' OD2' ' NH2' ' A' ' 134' ' ' ARG . 91.9 m-20 -65.75 -42.33 91.07 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.818 -0.353 . . . . 47.18 111.54 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.2 t -55.18 -42.59 66.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 121.252 0.549 . . . . 46.74 110.305 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ARG . . . . . 0.579 ' NH2' ' O1 ' ' A' ' 202' ' ' SO4 . 8.7 ttt-85 -65.2 -42.84 93.16 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 122.104 -0.372 . . . . 78.51 111.232 178.67 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.38 90.97 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.102 -1.047 . . . . 41.29 112.991 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -59.81 -27.72 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.236 -0.567 . . . . 60.68 111.59 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.8 mt -91.12 -14.04 31.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.873 0.694 . . . . 51.24 112.873 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.2 -39.64 43.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.367 -0.533 . . . . 47.58 110.153 167.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -64.17 -41.53 97.09 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 122.124 -0.36 . . . . 56.98 111.343 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -58.68 -41.94 87.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.129 -0.628 . . . . 59.06 110.925 175.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -62.96 -53.74 49.32 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.639 -0.424 . . . . 72.82 111.067 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.71 -22.46 59.63 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.646 -0.788 . . . . 36.79 113.882 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -78.82 -42.46 27.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 117.773 0.786 . . . . 43.04 111.468 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.8 m -73.43 -22.94 19.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.097 -0.641 . . . . 43.98 111.532 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -66.08 -31.46 72.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.121 -0.632 . . . . 59.79 111.221 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 0.09 35.42 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.666 0.617 . . . . 57.93 112.666 173.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 36.9 mtp -113.75 18.29 17.54 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.002 0.521 . . . . 62.6 111.784 173.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mt 58.81 48.46 11.26 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.594 0.711 . . . . 71.87 111.009 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 78.25 -10.85 26.21 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.403 0.921 . . . . 71.24 115.403 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -81.98 165.72 20.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 118.695 1.247 . . . . 100.8 110.246 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.7 t -153.71 116.67 4.51 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.689 -0.687 . . . . 77.58 109.339 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.4 p -77.18 164.46 25.61 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.744 0.783 . . . . 65.96 110.743 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -76.93 -30.95 56.32 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.436 -0.802 . . . . 92.83 111.69 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -54.4 -34.64 61.71 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.54 -0.464 . . . . 51.13 111.195 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.83 -43.76 57.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.724 -0.39 . . . . 49.79 111.369 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -69.53 -35.07 75.13 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.394 -0.522 . . . . 72.85 111.879 -177.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 74.4 t -66.33 -38.37 81.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 120.18 -0.608 . . . . 41.22 110.167 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 26.7 ttp85 -67.21 -41.66 85.4 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.958 -0.464 . . . . 53.76 111.345 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.43 -43.36 94.57 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.223 -0.591 . . . . 46.63 111.124 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.59 -35.09 73.62 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.591 -0.443 . . . . 36.95 111.145 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 2.2 m -57.58 -49.43 76.43 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.021 0.439 . . . . 56.04 110.79 174.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 -70.85 -37.52 73.14 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.708 -0.397 . . . . 60.94 111.317 -175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.85 -43.65 98.41 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.09 -0.644 . . . . 34.37 111.086 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 61.9 mt -62.92 -46.13 97.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.046 0.45 . . . . 44.52 110.493 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.59 -39.48 70.78 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.568 -0.453 . . . . 43.24 111.132 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.6 mt -75.47 -45.43 38.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.783 -0.367 . . . . 47.5 111.706 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -50.91 -49.31 59.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.079 0.466 . . . . 59.31 110.966 174.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 82.9 mt -60.27 -54.37 46.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.784 0.326 . . . . 51.58 111.138 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ARG . . . . . 0.488 ' NH2' ' OD2' ' A' ' 97' ' ' ASP . 9.1 ttp180 -63.1 -32.13 73.43 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.306 -0.558 . . . . 56.95 111.623 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.04 -55.05 28.9 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.369 -0.532 . . . . 61.41 110.754 176.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 72.3 mt -58.88 -46.74 91.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-O 121.148 0.499 . . . . 59.27 110.397 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -61.23 -41.06 99.38 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.18 -1.01 . . . . 66.24 112.877 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -64.64 -39.68 94.11 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.18 -0.608 . . . . 65.14 111.094 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.68 -22.21 64.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.156 0.428 . . . . 59.64 112.156 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -48.74 18.5 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 117.892 0.314 . . . . 90.14 111.085 175.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -57.07 -18.01 12.69 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 111.922 0.342 . . . . 95.61 111.922 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.5 tp -87.21 -60.08 2.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.066 0.395 . . . . 94.36 112.066 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -54.16 -30.66 50.05 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.84 0.311 . . . . 103.5 111.84 -175.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . . . -71.19 -41.2 70.6 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.186 -0.606 . . . . 100.66 111.08 170.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . . . -74.52 -10.56 59.67 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.646 0.609 . . . . 93.02 112.646 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 47.6 mt -93.74 11.72 28.13 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.359 0.527 . . . . 98.3 112.003 168.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.9 -14.05 9.45 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.318 0.647 . . . . 108.2 112.675 169.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.78 -32.69 12.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 118.436 0.562 . . . . 118.95 109.618 163.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' TYR . . . . . 0.648 ' OH ' ' OG ' ' A' ' 81' ' ' SER . 1.3 t80 -61.99 -50.78 70.7 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.761 0.315 . . . . 123.18 110.816 171.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -80.5 -43.06 21.4 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.523 -0.871 . . . . 132.08 112.042 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.264 0 O-C-N 121.579 -0.7 . . . . 133.68 110.774 -178.656 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.676 0.274 . . . . 96.46 111.045 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -59.18 -49.05 79.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.915 -0.584 . . . . 91.41 111.309 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -64.25 -30.83 71.87 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.206 0.447 . . . . 81.86 112.206 -166.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ARG . . . . . 0.742 ' NH1' ' O ' ' B' ' 12' ' ' ARG . 38.1 tpt85 -59.46 -44.99 92.86 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 83.99 110.943 175.38 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . . . -68.45 -41.21 80.57 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.477 -0.489 . . . . 83.57 111.523 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 60.9 mt -59.85 -40.96 84.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 CA-C-O 120.946 0.403 . . . . 66.85 110.691 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 59.7 t -66.01 -42.99 92.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 120.028 -0.669 . . . . 58.17 110.398 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' MET . . . . . . . . . . . . . 15.4 ttp -51.83 -56.33 14.59 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.96 -0.462 . . . . 107.34 111.79 -176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -72.79 -31.89 65.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.124 -0.63 . . . . 65.02 111.85 -174.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' TYR . . . . . 0.434 ' OH ' ' OE2' ' B' ' 111' ' ' GLU . 34.9 t80 -67.23 -37.38 83.49 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.332 -0.947 . . . . 60.13 110.997 178.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ILE . . . . . . . . . . . . . 15.5 mm -72.04 -47.81 52.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 119.701 -0.799 . . . . 78.02 109.612 176.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -34.53 -54.24 0.53 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.557 1.143 . . . . 94.73 112.238 167.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -71.72 -38.59 70.47 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.296 -0.866 . . . . 88.04 111.617 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -65.18 -18.27 65.17 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.97 0.73 . . . . 78.32 112.97 -177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . . . -70.22 -37.04 74.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.764 -0.774 . . . . 90.55 111.446 173.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 26.9 m -58.54 -43.34 89.21 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.803 -0.359 . . . . 79.16 111.427 -170.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.9 -13.49 61.76 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 113.421 0.897 . . . . 101.95 113.421 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . . . -109.7 27.94 9.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 118.871 0.76 . . . . 96.65 112.056 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.39 43.39 97.43 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.825 -0.702 . . . . 95.34 113.013 -177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -147.37 164.45 33.24 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.999 -1.111 . . . . 96.44 107.999 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . . . -174.89 141.22 0.59 Allowed 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.301 -0.629 . . . . 98.01 109.301 166.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -146.03 174.71 11.05 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.525 0.679 . . . . 117.79 109.355 -178.582 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.9 t0 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 125.916 1.686 . . . . 92.2 114.362 178.431 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.56 0.219 . . . . 103.05 111.285 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -87.91 1.37 54.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.419 0.525 . . . . 101.78 112.419 176.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 5.2 p -69.62 -25.09 27.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.055 0.389 . . . . 80.39 110.882 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 45.4 t -65.98 -49.53 76.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.04 0.448 . . . . 71.49 110.382 173.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 7.1 m80 -63.14 -32.15 73.47 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.079 -0.388 . . . . 79.51 111.59 -178.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.38 -48.88 20.9 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.639 -0.424 . . . . 77.65 111.055 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 96.7 m -59.56 -43.27 93.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.657 -0.417 . . . . 64.93 111.239 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.6 tp -63.3 -34.04 76.82 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.386 -0.526 . . . . 53.29 111.48 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -64.92 -42.29 94.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.381 -0.528 . . . . 58.29 111.135 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -71.89 -39.11 69.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.563 -0.455 . . . . 87.55 111.287 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.58 82.86 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.679 -0.408 . . . . 57.97 110.793 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.49 -21.16 62.15 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.78 -0.724 . . . . 64.61 113.746 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -82.14 -49.31 10.31 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 117.832 0.816 . . . . 76.09 111.288 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.04 -43.74 66.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.402 -0.519 . . . . 83.42 110.573 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -61.52 -46.0 91.82 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.754 0.311 . . . . 73.42 111.182 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 71.2 p -76.35 -25.76 55.01 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.77 0.656 . . . . 87.76 112.77 -170.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -91.6 9.08 33.68 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.411 0.55 . . . . 86.9 112.165 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -91.88 -36.56 13.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.639 0.776 . . . . 112.44 109.591 152.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -60.48 -85.4 0.01 OUTLIER 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.175 0.59 . . . . 108.41 110.277 171.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -62.25 1.3 0.34 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.478 0.918 . . . . 108.32 113.478 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . . . -66.04 -73.93 0.12 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.928 -0.397 . . . . 97.89 109.928 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.26 51.43 0.75 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.981 -0.377 . . . . 88.92 109.981 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -144.53 -156.36 0.69 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.253 -1.388 . . . . 101.05 107.253 170.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.37 170.05 17.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.605 -1.628 . . . . 101.63 106.605 162.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . 0.419 ' C ' ' N ' ' B' ' 75' ' ' SER . . . -66.53 -126.24 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.982 1.475 . . . . 102.02 114.982 -161.522 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . . . -73.69 41.28 0.12 Allowed 'General case' 0 C--O 1.236 0.362 0 N-CA-C 106.971 -1.492 . . . . 97.19 106.971 164.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . 0.419 ' N ' ' C ' ' B' ' 73' ' ' GLU . 1.9 t -95.44 -33.82 12.33 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 126.862 2.065 . . . . 99.22 113.334 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 10.3 m -81.04 34.88 0.36 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.013 -1.106 . . . . 101.5 108.013 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . . . -73.63 -174.29 1.7 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 122.553 1.168 . . . . 99.93 111.764 -157.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 1.9 mp -125.82 179.58 5.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.415 -1.266 . . . . 102.96 108.338 173.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -86.33 103.37 14.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 107.74 -1.207 . . . . 89.68 107.74 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -107.95 109.93 21.54 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.032 0.533 . . . . 77.91 109.805 -172.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 p -108.64 170.07 5.85 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 124.933 1.293 . . . . 54.41 109.258 169.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -63.33 -20.11 69.67 Favored 'Trans proline' 0 C--O 1.238 0.485 0 N-CA-C 113.578 0.568 . . . . 49.25 113.578 172.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -96.55 -24.62 15.97 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.429 0.9 . . . . 46.58 113.429 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 26.6 p -96.08 -9.17 31.49 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.092 0.775 . . . . 43.77 113.092 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.58 88.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.216 0.462 . . . . 43.93 111.489 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -67.94 -27.57 66.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.8 -0.76 . . . . 68.3 111.304 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.09 -44.65 17.87 Favored Glycine 0 C--N 1.335 0.527 0 C-N-CA 120.135 -1.031 . . . . 42.7 112.479 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.37 -36.56 79.38 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.268 -0.573 . . . . 77.12 111.018 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -58.56 -45.49 88.85 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.257 -0.577 . . . . 43.17 110.735 173.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.24 -45.63 69.31 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.909 -0.316 . . . . 32.36 111.53 -176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 20.2 m -56.01 -49.2 74.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.663 -0.415 . . . . 36.79 110.941 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.13 -44.16 88.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.738 -0.385 . . . . 37.85 110.898 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.59 -35.56 70.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 O-C-N 121.776 -0.578 . . . . 40.98 110.846 -174.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -59.48 -56.29 23.86 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.769 -0.582 . . . . 45.01 110.683 174.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -64.03 -24.93 67.9 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 111.832 0.308 . . . . 60.84 111.832 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.83 -41.09 92.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.685 -0.406 . . . . 55.57 111.107 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -107.49 19.18 20.59 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.549 0.574 . . . . 63.22 112.549 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -55.7 -35.22 65.82 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.988 0.366 . . . . 68.31 111.988 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -133.34 60.74 1.7 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.747 0.784 . . . . 78.99 110.336 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 111.44 170.98 19.03 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 122.554 1.085 . . . . 73.42 112.482 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.75 132.92 61.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 114.103 -1.048 . . . . 76.78 108.469 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -140.94 174.93 10.04 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.667 -0.864 . . . . 58.55 108.667 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' TRP . . . . . . . . . . . . . 54.3 m95 -68.64 -38.43 80.47 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.095 -0.642 . . . . 59.34 111.577 -177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . -63.02 -28.75 72.59 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.143 -1.027 . . . . 51.72 113.115 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -79.65 -31.02 41.44 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.28 0.54 . . . . 64.19 112.156 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.09 -35.14 70.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 120.103 -0.639 . . . . 48.41 110.207 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.18 -44.05 94.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 O-C-N 121.986 -0.446 . . . . 44.22 110.25 171.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' B' ' 112' ' ' PHE . . . -59.04 -43.17 91.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.584 -0.446 . . . . 37.31 110.962 173.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -58.38 -41.92 85.9 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 120.529 0.204 . . . . 50.42 111.248 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -69.01 -43.58 74.5 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.258 -0.577 . . . . 40.13 111.164 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . 0.434 ' OE2' ' OH ' ' B' ' 18' ' ' TYR . 16.8 mm-40 -60.35 -44.29 95.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.409 -0.517 . . . . 47.28 111.169 177.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' PHE . . . . . 0.406 ' N ' ' O ' ' B' ' 108' ' ' ALA . 43.4 t80 -61.61 -45.96 91.86 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.456 -0.497 . . . . 43.13 111.215 178.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.37 76.13 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 119.986 -1.102 . . . . 52.05 112.357 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -69.75 -42.28 71.28 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.039 -1.076 . . . . 54.74 112.479 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.85 -32.44 43.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 O-C-N 122.313 -0.522 . . . . 61.45 110.586 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 7.2 mmt -59.86 -51.58 69.09 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 72.31 111.125 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' CYS . . . . . . . . . . . . . 56.9 m -69.29 -38.28 78.23 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.994 0.368 . . . . 64.26 111.994 -169.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 4.9 m -77.83 -25.25 14.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.557 -0.857 . . . . 78.8 111.823 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -70.03 -24.33 63.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.312 0.505 . . . . 80.16 111.272 167.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 21.1 m -66.1 -57.53 7.48 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.93 -0.308 . . . . 67.51 111.219 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 1.3 m -68.11 -28.67 41.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 119.745 -0.782 . . . . 81.73 110.749 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . . . -74.07 -13.01 60.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 121.732 -0.605 . . . . 78.3 112.296 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . . . -123.38 22.28 9.31 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.08 0.552 . . . . 83.97 111.835 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 74.59 37.45 0.54 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.434 0.902 . . . . 88.82 113.434 164.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' MET . . . . . . . . . . . . . 27.8 mtm -136.85 151.3 48.96 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 108.183 -1.044 . . . . 85.49 108.183 171.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' SER . . . . . . . . . . . . . 6.2 m -155.56 -36.03 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.309 0 C-N-CA 117.551 -1.659 . . . . 92.77 114.786 177.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -58.16 -16.02 25.79 Favored 'Trans proline' 0 C--O 1.24 0.589 0 CA-C-N 121.486 1.566 . . . . 74.25 112.398 168.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.49 -35.32 62.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.642 0.258 . . . . 70.0 111.282 165.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 27.6 t -56.1 -44.35 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.986 0.422 . . . . 73.55 110.616 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.59 -38.53 87.88 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.192 -0.603 . . . . 82.55 110.936 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -62.69 -50.76 69.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.487 -0.485 . . . . 78.0 110.75 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 37.2 mt -55.25 -40.56 56.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-O 121.071 0.462 . . . . 46.01 110.258 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.6 97.28 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.084 -0.385 . . . . 55.52 111.245 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 7.9 tt -84.11 8.54 15.22 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 119.929 -0.708 . . . . 76.81 111.721 169.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' TRP . . . . . 0.504 ' C ' ' OE2' ' B' ' 138' ' ' GLU . 54.0 m0 -100.57 0.16 38.86 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.1 -1.84 . . . . 69.54 112.546 167.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' MET . . . . . . . . . . . . . 60.3 mtp -110.3 -37.98 5.38 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.118 0.784 . . . . 61.34 113.118 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' THR . . . . . . . . . . . . . 61.2 m -57.61 -72.98 0.08 Allowed 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.207 1.003 . . . . 63.91 113.134 -178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' GLU . . . . . 1.0 ' N ' ' OE1' ' B' ' 138' ' ' GLU . 1.3 pm0 -46.37 -37.53 7.67 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.104 0.962 . . . . 92.43 113.532 173.076 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -67.56 -33.84 75.85 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 118.865 -1.134 . . . . 51.23 110.45 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' LEU . . . . . 0.576 ' O ' ' N ' ' B' ' 145' ' ' HIS . 5.8 mt -67.78 -42.42 81.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.44 -0.504 . . . . 66.72 110.807 165.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -66.06 -40.03 90.59 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.052 0.39 . . . . 65.22 112.052 -175.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -93.11 -57.42 2.63 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.939 -0.476 . . . . 81.28 112.027 -173.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -104.45 -10.13 17.91 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.879 1.066 . . . . 60.91 113.879 -168.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 31.8 mt -110.47 -28.5 8.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 113.675 0.991 . . . . 72.97 113.675 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' HIS . . . . . 0.576 ' N ' ' O ' ' B' ' 140' ' ' LEU . 23.6 t-160 -51.8 -33.98 38.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.122 0.419 . . . . 108.97 112.113 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 38.5 m -67.22 -42.99 83.15 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.644 -0.422 . . . . 84.52 111.515 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -74.17 -23.86 59.3 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.391 0.515 . . . . 75.59 112.391 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ILE . . . . . . . . . . . . . 23.4 mm -64.44 -53.17 46.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.007 0.432 . . . . 96.41 110.622 -175.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -69.35 -18.67 63.82 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.845 0.683 . . . . 111.43 112.845 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -45.47 56.02 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.127 -0.629 . . . . 93.56 111.346 -178.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -87.29 17.88 4.1 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.707 0.632 . . . . 92.21 112.707 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLY . . . . . . . . . . . . . . . 114.4 11.5 11.79 Favored Glycine 0 C--N 1.333 0.381 0 N-CA-C 116.138 1.215 . . . . 97.42 116.138 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . 71.63 -174.63 42.07 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.166 -1.016 . . . . 87.7 112.054 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' TRP . . . . . . . . . . . . . 5.3 m95 -67.97 -35.23 78.02 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.677 -0.761 . . . . 77.54 111.474 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -65.49 -12.48 53.11 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.636 0.606 . . . . 90.13 112.636 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.54 -33.46 60.69 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.092 -0.643 . . . . 84.09 111.505 170.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -62.03 -44.52 96.53 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.453 -0.499 . . . . 75.87 110.932 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 23.5 m -66.92 -32.12 56.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 119.582 -0.847 . . . . 85.41 110.761 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -70.91 -27.41 63.76 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.625 -0.83 . . . . 102.49 111.692 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.7 -20.26 19.69 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.528 0.936 . . . . 84.38 113.528 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -121.37 9.97 10.45 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.381 0.512 . . . . 90.41 112.381 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -80.23 -82.28 0.75 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 118.403 0.547 . . . . 119.43 113.884 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.75 16.68 0.13 Allowed 'Trans proline' 0 C--O 1.236 0.398 0 N-CA-C 113.914 0.698 . . . . 121.43 113.914 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.841 0.353 . . . . 122.58 110.536 176.708 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.451 0 N-CA-C 113.387 0.115 . . . . 80.96 113.387 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLN . . . . . . . . . . . . . . . -86.82 -27.28 23.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.416 0.895 . . . . 89.29 113.416 -165.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -62.99 -42.1 99.76 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.972 -0.691 . . . . 110.93 111.93 -161.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' TRP . . . . . 0.553 ' CH2' ' CD1' ' C' ' 142' ' ' LEU . 18.2 p-90 -69.64 -34.29 73.81 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 117.977 -1.489 . . . . 72.31 110.961 173.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLU . . . . . 0.675 ' OE1' ' NE2' ' C' ' 143' ' ' GLN . 13.9 mt-10 -63.59 -36.54 84.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.502 -0.479 . . . . 73.24 111.085 177.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 11.0 mt -61.83 -39.52 92.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.078 -0.649 . . . . 71.45 110.684 174.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.96 94.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.574 -0.45 . . . . 53.23 111.203 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 37.1 tp -64.33 -40.55 96.12 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.402 -0.519 . . . . 52.35 111.09 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.34 71.69 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.384 -0.912 . . . . 54.61 113.223 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ARG . . . . . . . . . . . . . 30.3 mtp-105 -73.63 -42.11 61.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.196 -0.601 . . . . 64.39 111.006 176.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.01 -41.96 79.47 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.552 -0.459 . . . . 55.45 110.905 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.01 -42.37 99.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.637 -0.425 . . . . 49.25 111.154 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -64.36 -37.25 86.83 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.43 -0.508 . . . . 86.83 111.305 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -70.08 -43.95 70.1 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.748 -0.781 . . . . 57.47 110.849 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 49.9 tp -55.84 -27.14 50.1 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.025 -0.27 . . . . 67.57 111.327 173.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' SER . . . . . . . . . . . . . 35.1 t -62.03 -55.43 29.3 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.192 0.52 . . . . 76.71 111.132 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' TRP . . . . . . . . . . . . . 34.4 t90 -56.47 -31.55 64.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.244 -0.435 . . . . 75.56 111.742 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -74.58 -40.81 48.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.597 -0.441 . . . . 65.04 110.764 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' SER . . . . . . . . . . . . . 41.9 m -65.58 -10.87 39.09 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.165 0.802 . . . . 67.19 113.165 -176.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 73.4 p -68.38 -26.18 65.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.961 -0.696 . . . . 77.97 111.102 169.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' LEU . . . . . . . . . . . . . 78.6 mt 52.05 36.58 19.14 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.548 0.689 . . . . 73.77 110.489 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -61.34 168.37 2.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.902 0.858 . . . . 84.88 109.968 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -63.2 -36.72 84.59 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.703 -0.799 . . . . 109.94 110.889 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.53 -36.23 75.73 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 111.939 0.348 . . . . 100.84 111.939 169.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 16.8 t -71.67 -49.57 45.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.853 0.358 . . . . 70.09 110.673 -173.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -59.18 -39.64 83.19 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.583 -0.447 . . . . 65.59 110.973 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -61.46 -38.27 86.6 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.603 0.24 . . . . 102.0 111.24 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.83 -37.14 56.23 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 122.171 -0.331 . . . . 87.27 111.878 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 71.9 mt -61.7 -15.34 39.53 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.383 0.512 . . . . 57.59 112.383 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.69 -2.32 25.74 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.764 0.653 . . . . 59.14 112.764 173.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' SER . . . . . . . . . . . . . 98.7 p -116.29 178.84 4.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.628 0.771 . . . . 62.38 109.684 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' SER . . . . . . . . . . . . . 9.6 m -91.76 -3.07 56.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.467 -0.788 . . . . 68.03 112.646 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -68.54 -41.22 80.14 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.171 0.441 . . . . 76.83 111.815 -171.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 46.0 t -69.48 -41.69 80.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 119.968 -0.693 . . . . 51.37 110.755 -174.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -74.46 -34.13 63.07 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.753 -0.779 . . . . 51.47 111.736 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -68.93 -41.0 78.69 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.033 -0.667 . . . . 84.68 111.035 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -60.44 -43.93 96.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.415 -0.514 . . . . 52.85 110.963 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' LEU . . . . . . . . . . . . . 17.6 mt -56.44 -32.14 64.62 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 111.839 0.311 . . . . 57.7 111.839 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -72.94 -37.54 67.1 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.507 -0.477 . . . . 71.68 111.251 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.17 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.555 -0.458 . . . . 48.88 111.35 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mt -71.34 -30.8 66.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.372 -0.531 . . . . 45.37 111.251 177.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' MET . . . . . . . . . . . . . 61.7 ttp -67.51 -52.78 34.98 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.692 0.282 . . . . 54.17 110.964 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -62.88 -30.21 71.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.517 -0.473 . . . . 47.94 111.609 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -67.81 -47.52 68.85 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.49 -0.484 . . . . 50.72 110.905 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 32.5 m -58.27 -44.78 88.57 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 53.8 111.027 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' MET . . . . . . . . . . . . . 92.1 mmm -69.85 -36.61 75.67 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.519 -0.473 . . . . 49.22 111.278 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -61.81 -45.03 95.59 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.483 -0.487 . . . . 58.63 110.883 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -66.62 -42.57 86.59 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.493 -0.483 . . . . 76.89 111.328 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . 29.4 tp -64.95 -36.28 83.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.596 -0.441 . . . . 55.59 111.311 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -67.51 -39.63 85.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.216 -0.594 . . . . 72.97 111.148 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.61 -19.81 62.81 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.182 0.438 . . . . 56.23 112.182 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -80.78 -43.76 19.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.467 -0.493 . . . . 83.53 111.305 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' LYS . . . . . . . . . . . . . 25.7 tttp -56.07 -49.07 74.83 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.551 -0.459 . . . . 86.88 110.684 173.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' SER . . . . . . . . . . . . . 65.5 m -57.35 -40.44 78.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.875 -0.33 . . . . 82.89 111.347 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.7 -41.97 96.29 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.46 . . . . 89.84 111.121 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.7 -23.07 63.38 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.371 -0.532 . . . . 88.83 112.166 177.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -67.24 9.45 0.22 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-O 118.536 -0.745 . . . . 99.42 112.922 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -110.23 -57.75 2.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.181 0.9 . . . . 106.27 111.836 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' GLN . . . . . 0.487 ' O ' ' NE2' ' C' ' 68' ' ' GLN . 6.7 tp60 -82.59 7.23 15.18 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.023 0.529 . . . . 116.52 112.112 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 mt -65.1 160.12 21.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.911 0.863 . . . . 121.88 111.174 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' THR . . . . . 0.592 ' O ' ' N ' ' C' ' 72' ' ' VAL . 3.1 m -129.03 88.09 52.55 Favored Pre-proline 0 C--O 1.255 1.373 0 CA-C-N 114.804 -1.089 . . . . 132.78 112.003 -168.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -6.96 48.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.169 0 N-CA-C 121.066 3.449 . . . . 139.04 121.066 141.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' VAL . . . . . 0.592 ' N ' ' O ' ' C' ' 70' ' ' THR . 12.2 t -115.29 -38.45 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 119.292 -2.13 . . . . 136.61 111.964 166.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.19 32.99 0.61 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.014 0.825 . . . . 132.09 111.978 159.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -62.85 -25.3 68.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.15 -0.62 . . . . 141.86 111.976 -170.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.86 -55.14 21.3 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.773 -0.771 . . . . 130.23 110.314 169.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 6.7 p -104.98 49.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.423 0.527 . . . . 138.1 112.423 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -112.99 6.48 17.73 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.976 -1.078 . . . . 125.98 111.232 159.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.45 13.67 1.89 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.787 0.435 . . . . 123.88 111.159 148.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -121.07 -28.43 4.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.139 1.776 . . . . 129.07 112.09 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 26.1 mt -82.86 -42.97 17.15 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 122.479 0.311 . . . . 112.31 111.4 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -67.46 -32.98 74.21 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.654 -0.418 . . . . 105.71 111.798 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -73.73 -36.86 65.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.176 -0.609 . . . . 109.59 110.882 -176.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -75.2 -21.28 58.8 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.092 0.404 . . . . 136.72 112.092 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 48.1 tp -80.12 -29.95 39.03 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.609 -0.437 . . . . 91.89 111.527 171.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -62.61 -34.11 76.36 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.278 -0.569 . . . . 84.74 111.366 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.25 58.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.036 0.384 . . . . 66.34 112.036 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.1 96.32 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.498 -0.481 . . . . 67.29 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.52 -35.93 58.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.273 -0.571 . . . . 80.1 111.175 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.1 -36.16 67.86 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.823 -0.351 . . . . 62.55 111.091 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' ARG . . . . . . . . . . . . . 93.3 mtm-85 -74.89 -43.88 51.92 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.301 -0.559 . . . . 75.21 111.212 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -52.92 -49.9 65.06 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.827 0.346 . . . . 65.55 110.984 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.2 -36.13 92.49 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.057 -1.068 . . . . 47.75 112.692 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.28 -37.64 83.77 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.227 -0.572 . . . . 45.47 111.274 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.03 -48.22 82.62 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.517 -0.473 . . . . 55.93 110.866 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' MET . . . . . . . . . . . . . 28.3 mtp -73.33 -27.98 61.82 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.579 -0.448 . . . . 49.57 111.841 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -67.89 -38.59 83.2 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.609 -0.836 . . . . 57.88 110.858 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -69.48 -35.87 75.99 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.579 -0.449 . . . . 39.11 111.415 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 13.7 t -55.32 -41.89 63.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.285 0.565 . . . . 45.74 110.204 173.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' ARG . . . . . 0.42 ' NH2' ' O ' ' C' ' 201' ' ' HOH . 14.0 ttt-85 -70.48 -45.81 64.97 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.082 -0.386 . . . . 69.74 111.272 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' GLY . . . . . . . . . . . . . . . -64.62 -37.83 94.9 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.092 -1.052 . . . . 49.74 112.848 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -57.94 -31.86 67.25 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.324 -0.516 . . . . 59.21 111.571 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.97 -24.92 28.09 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.835 0.68 . . . . 45.15 112.835 176.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 30.8 t -66.28 -36.8 78.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.397 -0.521 . . . . 49.42 110.16 170.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -66.89 -42.7 85.08 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.937 -0.477 . . . . 52.02 111.441 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -56.33 -47.34 78.95 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.511 -0.476 . . . . 48.75 110.659 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -57.55 -41.12 80.38 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.602 -0.439 . . . . 70.32 111.01 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.69 -36.07 91.86 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.147 -1.025 . . . . 39.22 112.989 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.13 -46.84 54.97 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.119 -0.636 . . . . 54.96 111.15 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -62.63 -31.83 53.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.564 -0.454 . . . . 54.48 110.769 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.68 -36.16 82.92 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.826 -0.547 . . . . 49.86 111.182 175.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.19 -21.34 60.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.515 -0.474 . . . . 60.87 112.13 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' MET . . . . . . . . . . . . . 9.8 mtp -94.87 22.65 6.23 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.668 0.618 . . . . 65.14 112.668 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' LEU . . . . . . . . . . . . . 7.0 mt 61.95 33.28 17.49 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.168 0.587 . . . . 67.89 111.112 174.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' GLY . . . . . . . . . . . . . . . 88.71 -13.68 61.99 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 115.136 0.814 . . . . 71.4 115.136 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -85.43 156.2 20.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.632 1.216 . . . . 92.73 110.555 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 19.1 t -132.94 125.02 28.9 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.23 -0.895 . . . . 72.11 109.021 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' THR . . . . . . . . . . . . . 69.2 p -78.48 167.63 21.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.991 0.9 . . . . 63.19 110.565 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -85.48 -27.99 25.3 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.293 -0.867 . . . . 92.11 111.376 170.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -53.82 -37.48 63.6 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.734 -0.386 . . . . 63.72 110.756 170.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' LEU . . . . . . . . . . . . . 41.9 tp -75.16 -46.11 36.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 121.027 -0.269 . . . . 42.04 111.344 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' ARG . . . . . . . . . . . . . 27.2 mtm-85 -67.08 -37.66 84.38 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.198 -0.601 . . . . 61.49 111.521 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' VAL . . . . . . . . . . . . . 88.2 t -63.52 -38.29 81.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.173 -0.611 . . . . 51.86 110.12 172.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ARG . . . . . . . . . . . . . 34.6 ttp85 -67.43 -40.84 85.5 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 121.991 -0.443 . . . . 52.32 111.32 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.72 -44.48 85.94 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.559 -0.456 . . . . 49.1 111.31 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.45 -27.07 67.23 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.614 -0.434 . . . . 41.62 111.589 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' SER . . . . . . . . . . . . . 63.0 m -70.83 -35.8 72.63 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.33 -0.548 . . . . 45.85 111.095 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -78.2 -38.93 42.12 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.672 -0.411 . . . . 49.02 111.53 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 42.8 mt -62.03 -42.36 99.09 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.258 -0.577 . . . . 39.05 111.155 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.81 -40.04 87.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.516 -0.474 . . . . 55.75 110.43 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.04 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.95 -0.469 . . . . 41.96 111.015 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.27 -37.3 71.91 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.321 -0.551 . . . . 36.15 111.359 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' GLN . . . . . 0.464 ' NE2' ' OH ' ' D' ' 67' ' ' TYR . 21.5 mt-30 -53.0 -49.75 65.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.095 0.474 . . . . 73.24 110.937 173.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' LEU . . . . . . . . . . . . . 90.3 mt -64.6 -45.87 85.09 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.805 0.336 . . . . 48.95 111.114 179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.76 -35.14 79.4 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.085 -0.646 . . . . 53.46 111.203 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -61.62 2.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.358 -0.537 . . . . 58.96 110.361 174.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' ILE . . . . . . . . . . . . . 93.6 mt -61.89 -30.16 47.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 116.729 -0.214 . . . . 59.07 111.163 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' GLY . . . . . . . . . . . . . . . -63.54 -63.37 4.53 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.54 -0.624 . . . . 65.81 111.54 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' ASP . . . . . 0.419 ' OD1' ' NE ' ' D' ' 105' ' ' ARG . 11.5 m-20 -67.01 2.79 1.31 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 118.245 -0.883 . . . . 78.4 112.084 167.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' ALA . . . . . . . . . . . . . . . -95.3 23.19 6.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.123 0.569 . . . . 102.18 111.789 160.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -122.33 -47.82 2.11 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.29 1.036 . . . . 94.11 113.384 161.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.01 -26.21 64.33 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.611 0.967 . . . . 100.67 113.611 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' LEU . . . . . 0.621 ' N ' ' CD2' ' C' ' 142' ' ' LEU . 1.3 pt? -58.07 -67.39 0.35 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.728 1.611 . . . . 106.08 111.348 163.787 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' GLN . . . . . 0.675 ' NE2' ' OE1' ' C' ' 14' ' ' GLU . 7.1 tt0 -70.5 -13.87 62.29 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.578 1.951 . . . . 97.15 112.009 -161.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . . . -82.03 -39.74 23.08 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 121.039 -0.264 . . . . 110.22 110.847 163.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 145' ' ' ARG . . . . . . . . . . . . . . . -76.6 -8.33 57.01 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.831 1.049 . . . . 96.31 113.831 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 146' ' ' LEU . . . . . . . . . . . . . 5.2 mp -99.18 -41.14 7.63 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.807 1.185 . . . . 105.75 112.394 171.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.0 -2.12 4.96 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 106.87 112.379 167.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.37 -29.35 3.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.187 -1.412 . . . . 109.11 107.187 167.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 149' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.86 -21.01 60.26 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 119.088 -0.482 . . . . 117.88 112.23 176.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . . . -93.72 -37.06 12.01 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.946 0.794 . . . . 116.5 112.129 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.56 17.54 2.18 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.746 0.647 . . . . 123.68 112.746 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 152' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-N 117.864 0.302 . . . . 112.8 112.879 179.841 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.734 0.302 . . . . 95.93 110.713 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -58.98 -37.16 76.18 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.056 -0.52 . . . . 84.81 111.247 176.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -73.51 -40.52 63.98 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.507 -0.477 . . . . 75.8 112.047 -167.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ARG . . . . . . . . . . . . . . . -61.12 -39.94 91.92 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.906 -0.718 . . . . 66.45 110.789 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -56.31 -47.43 78.74 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.986 0.422 . . . . 96.06 111.558 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.06 -26.78 27.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 O-C-N 122.226 -0.296 . . . . 66.45 111.675 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 t -71.52 -53.45 20.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 121.649 -0.657 . . . . 76.27 110.958 -171.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' MET . . . . . . . . . . . . . 4.0 tpp -68.35 -40.66 81.46 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.383 -0.527 . . . . 89.82 111.826 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.3 -40.81 71.55 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.428 -0.509 . . . . 79.07 110.892 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' TYR . . . . . 0.523 ' OH ' ' OE2' ' D' ' 111' ' ' GLU . 26.6 t80 -69.95 -31.97 69.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.539 -0.464 . . . . 64.15 111.507 175.445 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ILE . . . . . . . . . . . . . 28.2 mm -69.29 -45.14 79.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.658 -0.417 . . . . 81.48 110.543 -178.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -53.4 -58.12 8.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.498 0.666 . . . . 82.5 111.054 175.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' TYR . . . . . 0.481 ' OH ' ' OD2' ' D' ' 61' ' ' ASP . 23.8 t80 -59.79 -38.56 82.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.571 -0.741 . . . . 84.05 111.577 -168.673 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -66.26 -24.67 66.62 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.328 -0.549 . . . . 72.17 112.319 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 21.3 mt -79.88 -26.08 40.4 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.032 0.378 . . . . 83.33 111.928 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' SER . . . . . . . . . . . . . 70.3 m -65.05 -39.65 93.6 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.441 -0.503 . . . . 77.45 111.198 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' GLN . . . . . . . . . . . . . . . -64.15 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.018 0.377 . . . . 88.83 112.018 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . . . -89.52 -0.61 57.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.43 0.53 . . . . 93.82 112.43 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.0 83.39 0.89 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-O 119.925 -0.375 . . . . 93.38 113.171 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -160.48 -148.53 0.17 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 119.465 -0.894 . . . . 101.51 109.293 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -142.89 164.38 30.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.99 1.316 . . . . 95.82 108.533 -168.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' TRP . . . . . . . . . . . . . . . -148.04 160.75 42.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 121.826 0.822 . . . . 106.19 110.767 165.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 114.313 -1.312 . . . . 119.57 111.092 176.322 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.768 0.318 . . . . 108.13 111.731 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' GLU . . . . . . . . . . . . . . . -82.31 18.16 1.5 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 112.32 0.489 . . . . 92.86 112.32 172.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.76 -35.83 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 O-C-N 123.331 0.394 . . . . 82.88 111.032 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' VAL . . . . . . . . . . . . . 3.0 m -73.24 -30.38 30.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 O-C-N 121.936 -0.477 . . . . 76.83 110.355 178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.14 -41.84 94.38 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.938 -0.477 . . . . 81.63 110.858 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.53 -45.42 59.41 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.756 -0.378 . . . . 74.27 111.179 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' THR . . . . . . . . . . . . . 31.6 m -59.17 -41.72 89.08 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.523 -0.471 . . . . 65.75 111.139 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' LEU . . . . . . . . . . . . . 48.4 tp -66.91 -28.21 68.12 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.323 -0.551 . . . . 56.5 111.364 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' ARG . . . . . . . . . . . . . . . -68.14 -40.37 82.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.22 -0.592 . . . . 56.48 111.12 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.78 -47.19 60.89 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.346 -0.541 . . . . 71.24 110.994 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.58 -38.35 63.82 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.816 -0.354 . . . . 57.12 111.08 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' GLY . . . . . 0.413 ' O ' ' N ' ' D' ' 64' ' ' SER . . . -68.26 -47.92 55.56 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.002 -1.094 . . . . 58.19 112.355 175.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' ASP . . . . . 0.481 ' OD2' ' OH ' ' D' ' 21' ' ' TYR . 75.1 m-20 -60.18 -44.54 94.98 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.288 -0.537 . . . . 78.87 111.204 178.359 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.88 -60.32 3.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.242 0.544 . . . . 91.35 110.655 170.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -48.71 -41.95 33.51 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.99 -0.55 . . . . 75.81 111.47 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' SER . . . . . 0.413 ' N ' ' O ' ' D' ' 60' ' ' GLY . 7.9 t -71.53 -23.47 61.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.588 0.588 . . . . 78.44 112.588 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ARG . . . . . . . . . . . . . 79.3 mtm-85 -83.66 -13.72 53.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.996 0.739 . . . . 86.83 112.996 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -88.74 -33.5 17.47 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.504 0.593 . . . . 106.7 111.737 167.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' TYR . . . . . 0.464 ' OH ' ' NE2' ' C' ' 132' ' ' GLN . 17.9 t80 -66.4 -64.3 0.89 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 110.048 -0.353 . . . . 95.04 110.048 175.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' ARG . . . . . . . . . . . . . 5.4 mpt_? -67.65 1.23 2.56 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.237 0.458 . . . . 107.1 112.237 -178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . . . -73.2 -44.8 59.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.461 -0.496 . . . . 95.16 110.94 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -105.52 -34.07 7.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 114.273 1.212 . . . . 111.63 114.273 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -103.3 -54.31 2.63 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.601 0.637 . . . . 90.19 110.47 -176.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' ALA . . . . . . . . . . . . . . . 63.42 38.62 9.87 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.979 0.912 . . . . 96.79 112.514 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . . . -144.59 -83.18 0.15 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.383 1.253 . . . . 91.73 114.383 -174.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' MET . . . . . . . . . . . . . 34.4 ttm 43.84 32.59 0.62 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.456 1.102 . . . . 97.12 110.351 -153.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 4.5 p -78.62 2.35 19.66 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.161 -1.016 . . . . 98.61 111.023 157.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.42 3.32 28.56 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.347 1.059 . . . . 94.15 112.942 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' GLN . . . . . . . . . . . . . . . -66.73 84.26 0.11 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.86 -1.163 . . . . 92.89 107.86 167.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 16.7 mt -75.35 136.55 40.81 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.078 0.466 . . . . 91.49 111.552 -165.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' HIS . . . . . . . . . . . . . . . 51.24 51.56 16.67 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.39 -0.823 . . . . 82.13 111.331 177.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 20.0 tp -78.29 95.38 5.0 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.055 -1.091 . . . . 71.43 108.055 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 19.0 p -101.5 167.67 10.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 124.512 1.125 . . . . 51.51 109.92 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -61.95 -19.04 64.53 Favored 'Trans proline' 0 C--O 1.237 0.452 0 N-CA-C 113.755 0.636 . . . . 49.85 113.755 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -98.28 -33.89 10.91 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.361 0.874 . . . . 52.91 113.361 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 71.6 p -89.41 -5.42 57.44 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.0 0.741 . . . . 43.8 113.0 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.36 -43.74 96.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.243 0.474 . . . . 41.55 111.352 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -67.4 -28.16 67.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.252 -0.579 . . . . 63.67 111.271 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.2 -44.38 53.42 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.137 -1.03 . . . . 47.86 112.617 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.54 -47.73 77.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.214 -0.58 . . . . 74.14 110.869 176.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -51.23 -43.31 61.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.621 0.248 . . . . 38.78 111.429 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.71 70.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.7 -0.4 . . . . 35.7 111.447 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' THR . . . . . . . . . . . . . 34.2 m -59.69 -38.7 82.26 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.469 -0.493 . . . . 39.63 111.229 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 50.4 t -78.0 -46.82 25.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.152 -0.342 . . . . 40.67 110.971 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' VAL . . . . . . . . . . . . . 49.9 t -63.95 -37.93 81.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.882 -0.511 . . . . 38.82 110.636 -177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -60.75 -53.58 55.72 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.896 -0.502 . . . . 49.06 111.103 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -67.76 -26.47 66.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.887 -0.325 . . . . 66.7 111.874 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 5.4 tt -64.13 -37.87 89.03 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.515 -0.474 . . . . 44.01 111.082 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.48 12.17 29.9 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.008 0.744 . . . . 54.07 113.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -55.18 -56.84 15.41 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.294 0.497 . . . . 54.7 111.711 -172.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -102.78 44.56 1.01 Allowed 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.507 0.558 . . . . 73.96 112.507 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' GLY . . . . . . . . . . . . . . . 123.76 168.79 13.04 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-O 122.512 1.062 . . . . 72.15 112.437 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' VAL . . . . . . . . . . . . . 44.8 t -133.42 142.98 40.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 113.956 -1.122 . . . . 69.15 108.614 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -153.07 -170.64 3.68 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.119 -1.067 . . . . 55.87 108.119 173.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' TRP . . . . . . . . . . . . . 44.0 m95 -77.87 -41.28 37.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.934 -0.706 . . . . 58.56 111.901 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' GLY . . . . . . . . . . . . . . . -62.35 -25.92 67.33 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.188 -1.006 . . . . 47.73 113.144 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' ARG . . . . . 0.419 ' NE ' ' OD1' ' C' ' 138' ' ' ASP . 99.4 mtt180 -82.94 -31.39 27.7 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 122.311 -0.523 . . . . 67.91 111.896 177.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.93 -36.2 76.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.338 -0.545 . . . . 45.23 110.162 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.56 -45.68 98.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.174 0.511 . . . . 42.63 110.195 173.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.39 -37.3 74.99 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.576 -0.45 . . . . 36.68 110.986 174.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.04 -40.56 96.15 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 121.142 -0.223 . . . . 45.77 111.264 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -72.81 -35.87 67.43 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.121 -0.632 . . . . 39.68 111.153 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' GLU . . . . . 0.523 ' OE2' ' OH ' ' D' ' 18' ' ' TYR . 31.9 mm-40 -65.31 -43.46 91.0 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.263 -0.575 . . . . 50.29 111.205 176.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -62.85 -46.55 87.35 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.3 -0.56 . . . . 41.09 111.146 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.36 -39.44 96.17 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 119.85 -1.167 . . . . 54.39 112.385 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.73 -41.35 99.59 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.249 -0.976 . . . . 52.72 112.975 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' VAL . . . . . . . . . . . . . 38.6 t -68.4 -40.59 82.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 119.919 -0.712 . . . . 67.81 110.607 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' MET . . . . . 0.422 ' O ' ' OG ' ' D' ' 120' ' ' SER . 10.1 mmm -52.4 -26.87 13.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.975 -0.453 . . . . 63.82 111.27 173.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' CYS . . . . . . . . . . . . . 97.8 m -84.41 -22.31 30.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.024 0.75 . . . . 74.59 113.024 176.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' VAL . . . . . . . . . . . . . 3.2 m -97.9 -38.35 7.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 118.828 0.74 . . . . 89.79 111.674 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 30.6 tp10 -62.1 -26.95 68.58 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.518 -0.473 . . . . 82.0 110.825 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' D' ' 116' ' ' MET . 34.6 m -63.56 -50.61 68.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.801 0.334 . . . . 82.15 110.993 173.008 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' VAL . . . . . . . . . . . . . 21.2 t -58.02 -44.8 87.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.031 0.443 . . . . 82.76 110.835 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -71.71 -11.45 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.849 0.685 . . . . 92.19 112.849 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . . . -122.19 25.91 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.434 0.561 . . . . 79.55 111.769 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 70.73 31.86 2.65 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.099 0.96 . . . . 103.26 112.893 167.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' MET . . . . . . . . . . . . . 5.0 mtm -125.94 136.59 53.2 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.299 -1.0 . . . . 76.89 108.299 173.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' SER . . . . . . . . . . . . . 44.8 m -135.21 -46.02 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 116.842 -1.943 . . . . 87.67 113.737 -178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -62.91 -20.87 72.52 Favored 'Trans proline' 0 C--O 1.238 0.498 0 CA-C-N 120.997 1.392 . . . . 79.19 113.024 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' LEU . . . . . . . . . . . . . 3.3 mt -39.66 -42.48 1.22 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.201 1.0 . . . . 72.73 111.232 167.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 32.0 t -51.73 -38.08 21.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 115.903 -0.589 . . . . 69.01 111.001 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -43.01 75.34 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.014 -0.674 . . . . 79.04 111.55 -178.737 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -65.51 -44.75 86.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.055 -0.658 . . . . 86.21 111.04 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 68.3 mt -53.51 -41.71 46.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.16 0.505 . . . . 46.85 110.271 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.0 -39.28 85.23 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.69 -0.404 . . . . 51.5 111.174 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 tt -72.5 -45.44 59.39 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.079 -0.648 . . . . 63.5 110.763 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -54.1 -50.7 66.23 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.838 0.351 . . . . 48.97 110.837 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' MET . . . . . . . . . . . . . 61.3 mtp -62.44 -50.99 69.26 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.802 -0.359 . . . . 52.68 111.333 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' THR . . . . . . . . . . . . . 62.2 m -55.15 -52.97 61.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.17 0.509 . . . . 54.32 110.794 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' GLU . . . . . 0.64 ' OE1' ' NH2' ' D' ' 142' ' ' ARG . 5.4 tp10 -67.88 -33.2 74.28 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 120.387 -0.525 . . . . 88.06 111.404 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -67.47 -37.81 83.46 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.49 -0.884 . . . . 52.14 111.142 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' LEU . . . . . . . . . . . . . 11.3 mt -62.42 -42.29 99.33 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.673 -0.411 . . . . 64.76 111.344 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -75.08 -27.86 60.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.705 0.631 . . . . 71.3 112.705 -171.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' ARG . . . . . 0.64 ' NH2' ' OE1' ' D' ' 138' ' ' GLU . 49.5 mtt180 -96.48 -60.71 1.55 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.45 -0.9 . . . . 81.11 112.61 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -99.9 -13.49 19.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.538 0.94 . . . . 68.96 113.538 -166.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 35.8 mt -105.87 -19.53 13.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.061 0.763 . . . . 72.12 113.061 172.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -55.83 -45.86 78.28 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.871 0.367 . . . . 108.28 111.669 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' THR . . . . . . . . . . . . . 17.3 m -65.5 -38.09 88.7 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.436 -0.506 . . . . 84.63 111.643 -173.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 147' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -66.78 -36.57 82.7 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.331 -0.948 . . . . 77.41 111.528 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 148' ' ' ILE . . . . . . . . . . . . . 21.2 mt -69.72 -48.51 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 120.375 -0.53 . . . . 96.52 110.609 -173.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 149' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 -58.38 -15.25 9.87 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.711 0.634 . . . . 118.94 112.711 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.16 -26.33 13.7 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.615 0.968 . . . . 94.94 113.615 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 151' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -88.44 16.51 6.36 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.707 0.685 . . . . 85.08 112.085 169.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 152' ' ' GLY . . . . . . . . . . . . . . . 108.62 13.4 18.77 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 115.984 1.154 . . . . 103.47 115.984 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 153' ' ' GLY . . . . . . . . . . . . . . . 67.08 -168.46 37.34 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 118.807 1.303 . . . . 80.45 111.788 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 154' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -71.06 -34.57 71.33 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.482 -0.859 . . . . 82.73 111.949 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 155' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -72.69 -7.89 52.66 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.713 0.635 . . . . 92.63 112.713 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.26 -26.0 33.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.09 -0.644 . . . . 76.69 111.313 167.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 157' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -63.22 -41.87 99.19 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.287 -0.565 . . . . 66.58 110.957 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 158' ' ' VAL . . . . . . . . . . . . . 33.4 m -71.87 -32.2 43.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 C-N-CA 119.552 -0.859 . . . . 78.04 111.063 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 159' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.67 -19.84 62.75 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 118.326 -1.35 . . . . 100.73 112.178 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 160' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -98.43 -29.91 12.85 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 113.415 0.894 . . . . 85.97 113.415 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 161' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -114.93 11.57 16.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.9 0.704 . . . . 91.37 112.9 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 162' ' ' GLY . . . . . . . . . . . . . . . -97.66 -69.89 0.99 Allowed Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 115.019 0.767 . . . . 104.17 115.019 -170.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 163' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -65.27 5.88 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 CA-C-N 117.523 0.662 . . . . 122.94 113.041 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 164' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--N 1.33 -0.281 0 C-N-CA 122.716 0.406 . . . . 127.43 109.972 171.512 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . 0.579 ' O1 ' ' NH2' ' A' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . 0.42 ' O ' ' NH2' ' C' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 120.919 0.177 . . . . 87.68 113.023 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -94.84 56.88 2.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 105.89 111.898 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptm85 -136.26 -48.12 0.65 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 119.088 -1.045 . . . . 97.36 112.157 172.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -59.05 -29.02 67.0 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 118.571 -1.251 . . . . 68.64 110.155 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -68.08 -35.24 77.85 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 121.23 -0.188 . . . . 81.24 111.274 173.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 16.5 mt -71.86 -42.53 66.77 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.93 -0.708 . . . . 74.52 111.091 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -40.35 85.63 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.433 -0.507 . . . . 60.21 110.936 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.42 -45.77 91.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.679 -0.408 . . . . 52.68 110.871 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.69 -23.56 55.6 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.908 -0.663 . . . . 57.56 113.696 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 25.3 mtp-105 -81.27 -34.54 31.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.813 0.806 . . . . 64.42 111.165 174.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.7 -50.78 69.8 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.398 -0.521 . . . . 58.76 110.683 171.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.07 -41.35 98.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.935 -0.306 . . . . 59.53 111.429 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -62.78 -38.04 89.04 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.533 -0.467 . . . . 101.05 111.259 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.38 -48.39 56.47 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.986 -0.686 . . . . 62.62 110.906 176.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD12 HG11 ' A' ' 98' ' ' VAL . 6.0 tt -51.95 -40.72 61.28 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.641 0.258 . . . . 64.36 110.853 173.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -52.43 -43.16 64.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.681 0.276 . . . . 72.53 111.341 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 29' ' ' THR . 39.6 t90 -70.1 -31.01 68.37 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 119.904 -0.718 . . . . 61.5 111.734 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.03 -31.56 35.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 118.873 -1.131 . . . . 60.09 110.36 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 m -64.71 -21.13 66.68 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.431 0.53 . . . . 57.34 112.431 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 26' ' ' TRP . 1.2 t -64.05 -23.14 67.22 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.783 -0.767 . . . . 72.59 111.501 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.4 mt 49.49 39.52 16.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.531 0.681 . . . . 69.81 111.354 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.4 p -71.11 162.12 29.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.95 0.881 . . . . 76.32 110.456 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 32' ' ' GLU . 6.0 mp0 -46.85 -42.16 16.86 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.845 -1.071 . . . . 87.7 110.491 168.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -58.71 -47.17 85.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.335 -0.393 . . . . 88.08 111.082 172.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.5 t -67.28 -45.81 85.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.883 0.373 . . . . 72.21 110.787 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -61.33 -40.19 93.3 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.339 -0.544 . . . . 66.64 111.303 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.69 -41.27 97.35 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.333 -0.547 . . . . 88.71 110.962 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -64.81 -41.02 96.11 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.563 -0.455 . . . . 91.4 111.287 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.73 -13.72 36.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.268 0.84 . . . . 58.86 113.268 -175.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.739 HD22 HG21 ' A' ' 109' ' ' VAL . 6.1 mt -88.14 -1.36 57.96 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.757 0.708 . . . . 64.48 112.213 176.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -106.95 176.29 5.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.1 0.96 . . . . 64.13 108.992 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.3 p -99.71 15.02 28.15 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.633 -0.712 . . . . 60.42 112.363 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -81.47 -27.83 34.41 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.378 0.51 . . . . 66.31 112.378 -178.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -80.27 -38.93 18.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 120.104 -0.638 . . . . 54.56 110.77 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.7 p -75.32 -30.38 60.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.052 -0.659 . . . . 48.2 111.899 176.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -65.94 -41.83 90.82 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.142 -0.623 . . . . 65.78 110.989 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.84 -39.97 94.41 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.471 -0.492 . . . . 58.13 111.214 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 mt -61.39 -37.98 85.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.675 -0.41 . . . . 56.5 111.48 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.3 ttp85 -66.36 -37.01 84.32 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.002 -0.679 . . . . 86.01 111.238 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.07 -54.71 37.53 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.979 0.419 . . . . 48.2 111.008 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.1 mt -62.19 -28.35 69.61 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.672 -0.411 . . . . 48.89 111.632 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.4 ttp -74.36 -48.6 27.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.718 -0.393 . . . . 56.73 110.935 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -65.55 -17.18 64.38 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.128 0.418 . . . . 53.97 112.128 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -81.46 -45.72 15.59 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 117.941 0.337 . . . . 54.03 110.788 170.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.2 m -56.46 -46.26 80.47 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.814 0.34 . . . . 45.4 111.057 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.88 -32.35 71.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.417 -0.513 . . . . 49.67 111.689 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -65.55 -52.01 55.6 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.375 -0.53 . . . . 57.15 111.023 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -63.93 -28.6 69.94 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.56 -0.456 . . . . 78.05 111.621 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 tp -76.41 -42.97 42.4 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.992 -0.283 . . . . 66.64 111.504 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.1 ttpp -65.58 -37.77 87.6 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.735 -0.386 . . . . 64.79 111.354 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.92 -12.94 60.81 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.717 0.636 . . . . 59.17 112.717 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TYR . . . . . 0.433 ' HE2' HD13 ' A' ' 146' ' ' LEU . 64.3 t80 -93.77 -29.91 15.13 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.643 0.608 . . . . 90.78 112.643 -178.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . 0.787 ' NZ ' ' OE2' ' A' ' 66' ' ' GLU . 34.9 tttm -69.01 -35.78 77.04 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.096 -0.642 . . . . 87.61 110.605 170.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.2 m -65.22 -40.46 94.13 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.452 -0.499 . . . . 80.77 111.152 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -59.68 -34.63 73.12 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.645 -0.422 . . . . 84.96 111.51 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.7 mt -74.06 -44.65 53.41 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.23 -0.588 . . . . 95.34 110.949 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.787 ' OE2' ' NZ ' ' A' ' 62' ' ' LYS . 26.1 mt-10 -53.23 -11.74 0.32 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.424 0.898 . . . . 113.41 113.424 178.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -89.4 -58.63 2.46 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.456 0.571 . . . . 110.56 111.151 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -75.79 -18.43 59.51 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.767 0.655 . . . . 111.89 112.767 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 101.87 0.42 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.788 -0.819 . . . . 119.17 108.788 170.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . 0.496 ' H ' ' HD3' ' A' ' 71' ' ' PRO . 7.8 p -112.41 -16.7 0.12 Allowed Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 116.348 1.981 . . . . 127.87 116.348 -173.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . 0.496 ' HD3' ' H ' ' A' ' 70' ' ' THR . 45.6 Cg_exo -65.14 -39.1 24.86 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 CA-C-N 121.646 1.624 . . . . 129.12 113.966 -177.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . 0.468 ' HB ' ' OE2' ' A' ' 74' ' ' GLU . 33.0 m 47.24 61.99 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 126.608 1.963 . . . . 126.61 114.574 170.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.46 113.74 16.74 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.384 -1.339 . . . . 121.31 107.384 161.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HB ' ' A' ' 72' ' ' VAL . 4.0 mt-10 -104.23 -14.38 15.85 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 115.312 1.597 . . . . 134.03 115.312 -160.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -65.06 -30.83 71.82 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 119.396 0.998 . . . . 150.56 111.212 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 m -107.21 -1.42 21.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.643 0.609 . . . . 145.56 112.643 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . 0.713 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 3.4 mtp-105 -90.52 -18.57 25.06 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.233 0.827 . . . . 131.93 113.233 178.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.34 -0.03 9.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.948 -0.701 . . . . 128.88 111.577 160.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -109.42 -35.77 6.17 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.164 1.386 . . . . 133.18 112.421 167.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' A' ' 77' ' ' ARG . 4.6 mt -61.09 -69.69 0.22 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.577 0.751 . . . . 119.22 112.273 179.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.3 m -61.35 -31.7 71.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.604 -0.439 . . . . 110.54 111.697 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -65.48 -31.6 72.76 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.392 -0.523 . . . . 114.98 111.624 176.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -71.23 -30.03 65.85 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.718 -0.393 . . . . 116.27 111.52 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.8 tp -92.98 -32.75 14.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.438 0.533 . . . . 82.92 112.438 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -63.32 -23.58 67.48 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.565 0.209 . . . . 95.25 111.565 169.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -88.6 -28.0 20.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.453 0.538 . . . . 82.27 112.453 170.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.57 -18.4 51.8 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.344 0.498 . . . . 72.72 112.344 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -82.06 -27.37 33.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.378 -0.529 . . . . 95.45 111.017 162.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.8 -29.11 69.94 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.535 -0.466 . . . . 58.81 111.242 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -74.94 -34.93 62.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.138 -0.625 . . . . 65.38 111.886 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.7 tp -68.61 -47.49 66.55 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.78 -0.768 . . . . 59.9 110.88 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -60.03 -27.28 64.54 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 119.909 -1.139 . . . . 50.34 112.641 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.64 -48.4 60.06 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.207 0.504 . . . . 41.78 111.192 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.93 -43.26 81.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.457 -0.497 . . . . 55.06 111.155 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.2 mtm -70.89 -29.96 66.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.379 -0.528 . . . . 48.03 111.696 -177.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.43 -38.62 81.36 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.697 -0.801 . . . . 58.91 110.898 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . 0.488 ' OD2' ' NH2' ' A' ' 134' ' ' ARG . 91.9 m-20 -65.75 -42.33 91.07 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.818 -0.353 . . . . 47.18 111.54 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . 0.407 HG11 HD12 ' A' ' 24' ' ' LEU . 22.2 t -55.18 -42.59 66.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 121.252 0.549 . . . . 46.74 110.305 175.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ARG . . . . . 0.579 ' NH2' ' O1 ' ' A' ' 202' ' ' SO4 . 8.7 ttt-85 -65.2 -42.84 93.16 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 122.104 -0.372 . . . . 78.51 111.232 178.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.38 90.97 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.102 -1.047 . . . . 41.29 112.991 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . 0.489 ' HD2' ' CD2' ' A' ' 127' ' ' HIS . 11.6 tpp180 -59.81 -27.72 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.236 -0.567 . . . . 60.68 111.59 179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.8 mt -91.12 -14.04 31.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.873 0.694 . . . . 51.24 112.873 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.2 -39.64 43.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.367 -0.533 . . . . 47.58 110.153 167.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -64.17 -41.53 97.09 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 122.124 -0.36 . . . . 56.98 111.343 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -58.68 -41.94 87.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.129 -0.628 . . . . 59.06 110.925 175.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -62.96 -53.74 49.32 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.639 -0.424 . . . . 72.82 111.067 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.71 -22.46 59.63 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.646 -0.788 . . . . 36.79 113.882 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -78.82 -42.46 27.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 117.773 0.786 . . . . 43.04 111.468 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.739 HG21 HD22 ' A' ' 39' ' ' LEU . 3.8 m -73.43 -22.94 19.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.097 -0.641 . . . . 43.98 111.532 177.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -66.08 -31.46 72.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.121 -0.632 . . . . 59.79 111.221 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 0.09 35.42 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.666 0.617 . . . . 57.93 112.666 173.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 36.9 mtp -113.75 18.29 17.54 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.002 0.521 . . . . 62.6 111.784 173.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mt 58.81 48.46 11.26 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.594 0.711 . . . . 71.87 111.009 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 78.25 -10.85 26.21 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.403 0.921 . . . . 71.24 115.403 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -81.98 165.72 20.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 118.695 1.247 . . . . 100.8 110.246 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.7 t -153.71 116.67 4.51 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.689 -0.687 . . . . 77.58 109.339 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.4 p -77.18 164.46 25.61 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.744 0.783 . . . . 65.96 110.743 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -76.93 -30.95 56.32 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.436 -0.802 . . . . 92.83 111.69 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -54.4 -34.64 61.71 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.54 -0.464 . . . . 51.13 111.195 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.83 -43.76 57.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.724 -0.39 . . . . 49.79 111.369 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -69.53 -35.07 75.13 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.394 -0.522 . . . . 72.85 111.879 -177.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 74.4 t -66.33 -38.37 81.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 120.18 -0.608 . . . . 41.22 110.167 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 26.7 ttp85 -67.21 -41.66 85.4 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.958 -0.464 . . . . 53.76 111.345 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.43 -43.36 94.57 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.223 -0.591 . . . . 46.63 111.124 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.59 -35.09 73.62 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.591 -0.443 . . . . 36.95 111.145 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . 0.406 ' HA ' HD21 ' B' ' 78' ' ' LEU . 2.2 m -57.58 -49.43 76.43 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.021 0.439 . . . . 56.04 110.79 174.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HIS . . . . . 0.489 ' CD2' ' HD2' ' A' ' 101' ' ' ARG . 27.7 m-70 -70.85 -37.52 73.14 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.708 -0.397 . . . . 60.94 111.317 -175.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 132' ' ' GLN . 49.2 mt -61.85 -43.65 98.41 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.09 -0.644 . . . . 34.37 111.086 178.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ILE . . . . . 0.508 HD11 ' O ' ' B' ' 76' ' ' SER . 61.9 mt -62.92 -46.13 97.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.046 0.45 . . . . 44.52 110.493 178.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.59 -39.48 70.78 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.568 -0.453 . . . . 43.24 111.132 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.6 mt -75.47 -45.43 38.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.783 -0.367 . . . . 47.5 111.706 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 128' ' ' LEU . 17.1 mt-30 -50.91 -49.31 59.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.079 0.466 . . . . 59.31 110.966 174.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' B' ' 112' ' ' PHE . 82.9 mt -60.27 -54.37 46.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.784 0.326 . . . . 51.58 111.138 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ARG . . . . . 0.488 ' NH2' ' OD2' ' A' ' 97' ' ' ASP . 9.1 ttp180 -63.1 -32.13 73.43 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.306 -0.558 . . . . 56.95 111.623 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.04 -55.05 28.9 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.369 -0.532 . . . . 61.41 110.754 176.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 72.3 mt -58.88 -46.74 91.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-O 121.148 0.499 . . . . 59.27 110.397 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -61.23 -41.06 99.38 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.18 -1.01 . . . . 66.24 112.877 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -64.64 -39.68 94.11 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.18 -0.608 . . . . 65.14 111.094 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.68 -22.21 64.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.156 0.428 . . . . 59.64 112.156 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -48.74 18.5 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 117.892 0.314 . . . . 90.14 111.085 175.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -57.07 -18.01 12.69 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 111.922 0.342 . . . . 95.61 111.922 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.5 tp -87.21 -60.08 2.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.066 0.395 . . . . 94.36 112.066 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -54.16 -30.66 50.05 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.84 0.311 . . . . 103.5 111.84 -175.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . . . -71.19 -41.2 70.6 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.186 -0.606 . . . . 100.66 111.08 170.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . . . -74.52 -10.56 59.67 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.646 0.609 . . . . 93.02 112.646 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . 0.433 HD13 ' HE2' ' A' ' 61' ' ' TYR . 47.6 mt -93.74 11.72 28.13 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.359 0.527 . . . . 98.3 112.003 168.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.9 -14.05 9.45 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.318 0.647 . . . . 108.2 112.675 169.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.78 -32.69 12.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 118.436 0.562 . . . . 118.95 109.618 163.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.99 -50.78 70.7 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.761 0.315 . . . . 123.18 110.816 171.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -80.5 -43.06 21.4 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.523 -0.871 . . . . 132.08 112.042 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.264 0 O-C-N 121.579 -0.7 . . . . 133.68 110.774 -178.656 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.676 0.274 . . . . 96.46 111.045 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -59.18 -49.05 79.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.915 -0.584 . . . . 91.41 111.309 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -64.25 -30.83 71.87 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.206 0.447 . . . . 81.86 112.206 -166.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ARG . . . . . 0.742 ' NH1' ' O ' ' B' ' 12' ' ' ARG . 38.1 tpt85 -59.46 -44.99 92.86 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 83.99 110.943 175.38 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . . . -68.45 -41.21 80.57 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.477 -0.489 . . . . 83.57 111.523 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 60.9 mt -59.85 -40.96 84.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 CA-C-O 120.946 0.403 . . . . 66.85 110.691 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' VAL . . . . . 0.709 ' O ' HG12 ' B' ' 19' ' ' ILE . 59.7 t -66.01 -42.99 92.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 120.028 -0.669 . . . . 58.17 110.398 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' MET . . . . . 0.618 ' HB2' HH12 ' B' ' 12' ' ' ARG . 15.4 ttp -51.83 -56.33 14.59 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.96 -0.462 . . . . 107.34 111.79 -176.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . 0.434 ' HA ' ' HB2' ' B' ' 20' ' ' HIS . 2.8 mmmm -72.79 -31.89 65.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.124 -0.63 . . . . 65.02 111.85 -174.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -67.23 -37.38 83.49 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.332 -0.947 . . . . 60.13 110.997 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ILE . . . . . 0.709 HG12 ' O ' ' B' ' 15' ' ' VAL . 15.5 mm -72.04 -47.81 52.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 119.701 -0.799 . . . . 78.02 109.612 176.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' HIS . . . . . 0.434 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 1.4 m-70 -34.53 -54.24 0.53 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.557 1.143 . . . . 94.73 112.238 167.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -71.72 -38.59 70.47 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.296 -0.866 . . . . 88.04 111.617 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . 0.432 ' HA ' ' HD3' ' B' ' 22' ' ' LYS . 16.9 mmtt -65.18 -18.27 65.17 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.97 0.73 . . . . 78.32 112.97 -177.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . . . -70.22 -37.04 74.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.764 -0.774 . . . . 90.55 111.446 173.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 26.9 m -58.54 -43.34 89.21 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.803 -0.359 . . . . 79.16 111.427 -170.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.9 -13.49 61.76 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 113.421 0.897 . . . . 101.95 113.421 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . . . -109.7 27.94 9.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 118.871 0.76 . . . . 96.65 112.056 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.39 43.39 97.43 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.825 -0.702 . . . . 95.34 113.013 -177.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -147.37 164.45 33.24 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.999 -1.111 . . . . 96.44 107.999 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . . . -174.89 141.22 0.59 Allowed 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.301 -0.629 . . . . 98.01 109.301 166.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' TRP . . . . . 0.697 ' HH2' HG22 ' B' ' 19' ' ' ILE . 0.9 OUTLIER -146.03 174.71 11.05 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.525 0.679 . . . . 117.79 109.355 -178.582 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.9 t0 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 125.916 1.686 . . . . 92.2 114.362 178.431 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.56 0.219 . . . . 103.05 111.285 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLU . . . . . 0.492 ' HA ' ' ND1' ' B' ' 53' ' ' HIS . 3.0 tt0 -87.91 1.37 54.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.419 0.525 . . . . 101.78 112.419 176.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 5.2 p -69.62 -25.09 27.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.055 0.389 . . . . 80.39 110.882 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 45.4 t -65.98 -49.53 76.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.04 0.448 . . . . 71.49 110.382 173.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' HIS . . . . . 0.492 ' ND1' ' HA ' ' B' ' 50' ' ' GLU . 7.1 m80 -63.14 -32.15 73.47 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.079 -0.388 . . . . 79.51 111.59 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.38 -48.88 20.9 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.639 -0.424 . . . . 77.65 111.055 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 96.7 m -59.56 -43.27 93.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.657 -0.417 . . . . 64.93 111.239 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.6 tp -63.3 -34.04 76.82 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.386 -0.526 . . . . 53.29 111.48 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -64.92 -42.29 94.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.381 -0.528 . . . . 58.29 111.135 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -71.89 -39.11 69.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.563 -0.455 . . . . 87.55 111.287 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.58 82.86 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.679 -0.408 . . . . 57.97 110.793 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.49 -21.16 62.15 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.78 -0.724 . . . . 64.61 113.746 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -82.14 -49.31 10.31 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 117.832 0.816 . . . . 76.09 111.288 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.04 -43.74 66.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.402 -0.519 . . . . 83.42 110.573 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -61.52 -46.0 91.82 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.754 0.311 . . . . 73.42 111.182 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 71.2 p -76.35 -25.76 55.01 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.77 0.656 . . . . 87.76 112.77 -170.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -91.6 9.08 33.68 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.411 0.55 . . . . 86.9 112.165 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -91.88 -36.56 13.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.639 0.776 . . . . 112.44 109.591 152.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' B' ' 71' ' ' PHE . 10.5 t80 -60.48 -85.4 0.01 OUTLIER 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.175 0.59 . . . . 108.41 110.277 171.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -62.25 1.3 0.34 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.478 0.918 . . . . 108.32 113.478 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . . . -66.04 -73.93 0.12 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.928 -0.397 . . . . 97.89 109.928 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.26 51.43 0.75 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.981 -0.377 . . . . 88.92 109.981 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' B' ' 67' ' ' TYR . 10.2 m-85 -144.53 -156.36 0.69 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.253 -1.388 . . . . 101.05 107.253 170.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.37 170.05 17.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.605 -1.628 . . . . 101.63 106.605 162.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . 0.57 ' C ' ' H ' ' B' ' 75' ' ' SER . . . -66.53 -126.24 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.982 1.475 . . . . 102.02 114.982 -161.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . . . -73.69 41.28 0.12 Allowed 'General case' 0 C--O 1.236 0.362 0 N-CA-C 106.971 -1.492 . . . . 97.19 106.971 164.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . 0.57 ' H ' ' C ' ' B' ' 73' ' ' GLU . 1.9 t -95.44 -33.82 12.33 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 126.862 2.065 . . . . 99.22 113.334 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . 0.508 ' O ' HD11 ' A' ' 129' ' ' ILE . 10.3 m -81.04 34.88 0.36 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.013 -1.106 . . . . 101.5 108.013 172.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . . . -73.63 -174.29 1.7 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 122.553 1.168 . . . . 99.93 111.764 -157.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . 0.456 HD11 HD12 ' A' ' 129' ' ' ILE . 1.9 mp -125.82 179.58 5.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.415 -1.266 . . . . 102.96 108.338 173.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -86.33 103.37 14.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 107.74 -1.207 . . . . 89.68 107.74 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -107.95 109.93 21.54 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.032 0.533 . . . . 77.91 109.805 -172.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 p -108.64 170.07 5.85 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 124.933 1.293 . . . . 54.41 109.258 169.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -63.33 -20.11 69.67 Favored 'Trans proline' 0 C--O 1.238 0.485 0 N-CA-C 113.578 0.568 . . . . 49.25 113.578 172.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -96.55 -24.62 15.97 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.429 0.9 . . . . 46.58 113.429 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 26.6 p -96.08 -9.17 31.49 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.092 0.775 . . . . 43.77 113.092 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.58 88.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.216 0.462 . . . . 43.93 111.489 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -67.94 -27.57 66.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.8 -0.76 . . . . 68.3 111.304 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.09 -44.65 17.87 Favored Glycine 0 C--N 1.335 0.527 0 C-N-CA 120.135 -1.031 . . . . 42.7 112.479 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.37 -36.56 79.38 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.268 -0.573 . . . . 77.12 111.018 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -58.56 -45.49 88.85 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.257 -0.577 . . . . 43.17 110.735 173.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ALA . . . . . 0.444 ' HB2' ' HG2' ' C' ' 112' ' ' MET . . . -69.24 -45.63 69.31 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.909 -0.316 . . . . 32.36 111.53 -176.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 20.2 m -56.01 -49.2 74.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.663 -0.415 . . . . 36.79 110.941 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.13 -44.16 88.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.738 -0.385 . . . . 37.85 110.898 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.59 -35.56 70.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 O-C-N 121.776 -0.578 . . . . 40.98 110.846 -174.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -59.48 -56.29 23.86 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.769 -0.582 . . . . 45.01 110.683 174.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -64.03 -24.93 67.9 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 111.832 0.308 . . . . 60.84 111.832 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.83 -41.09 92.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.685 -0.406 . . . . 55.57 111.107 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -107.49 19.18 20.59 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.549 0.574 . . . . 63.22 112.549 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -55.7 -35.22 65.82 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.988 0.366 . . . . 68.31 111.988 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -133.34 60.74 1.7 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.747 0.784 . . . . 78.99 110.336 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 111.44 170.98 19.03 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 122.554 1.085 . . . . 73.42 112.482 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.75 132.92 61.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 114.103 -1.048 . . . . 76.78 108.469 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -140.94 174.93 10.04 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.667 -0.864 . . . . 58.55 108.667 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' TRP . . . . . . . . . . . . . 54.3 m95 -68.64 -38.43 80.47 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.095 -0.642 . . . . 59.34 111.577 -177.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . -63.02 -28.75 72.59 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.143 -1.027 . . . . 51.72 113.115 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -79.65 -31.02 41.44 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.28 0.54 . . . . 64.19 112.156 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.09 -35.14 70.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 120.103 -0.639 . . . . 48.41 110.207 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.18 -44.05 94.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 O-C-N 121.986 -0.446 . . . . 44.22 110.25 171.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 133' ' ' LEU . . . -59.04 -43.17 91.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.584 -0.446 . . . . 37.31 110.962 173.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -58.38 -41.92 85.9 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 120.529 0.204 . . . . 50.42 111.248 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -69.01 -43.58 74.5 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.258 -0.577 . . . . 40.13 111.164 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.35 -44.29 95.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.409 -0.517 . . . . 47.28 111.169 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' PHE . . . . . 0.527 ' HB2' HD13 ' A' ' 133' ' ' LEU . 43.4 t80 -61.61 -45.96 91.86 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.456 -0.497 . . . . 43.13 111.215 178.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.37 76.13 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 119.986 -1.102 . . . . 52.05 112.357 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -69.75 -42.28 71.28 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.039 -1.076 . . . . 54.74 112.479 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.85 -32.44 43.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 O-C-N 122.313 -0.522 . . . . 61.45 110.586 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 7.2 mmt -59.86 -51.58 69.09 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 72.31 111.125 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' CYS . . . . . . . . . . . . . 56.9 m -69.29 -38.28 78.23 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.994 0.368 . . . . 64.26 111.994 -169.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 4.9 m -77.83 -25.25 14.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.557 -0.857 . . . . 78.8 111.823 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -70.03 -24.33 63.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.312 0.505 . . . . 80.16 111.272 167.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 21.1 m -66.1 -57.53 7.48 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.93 -0.308 . . . . 67.51 111.219 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 1.3 m -68.11 -28.67 41.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 119.745 -0.782 . . . . 81.73 110.749 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . . . -74.07 -13.01 60.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 121.732 -0.605 . . . . 78.3 112.296 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . . . -123.38 22.28 9.31 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.08 0.552 . . . . 83.97 111.835 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 74.59 37.45 0.54 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.434 0.902 . . . . 88.82 113.434 164.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' MET . . . . . . . . . . . . . 27.8 mtm -136.85 151.3 48.96 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 108.183 -1.044 . . . . 85.49 108.183 171.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' SER . . . . . 0.619 ' H ' ' HD2' ' B' ' 127' ' ' PRO . 6.2 m -155.56 -36.03 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.309 0 C-N-CA 117.551 -1.659 . . . . 92.77 114.786 177.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' PRO . . . . . 0.619 ' HD2' ' H ' ' B' ' 126' ' ' SER . 15.2 Cg_endo -58.16 -16.02 25.79 Favored 'Trans proline' 0 C--O 1.24 0.589 0 CA-C-N 121.486 1.566 . . . . 74.25 112.398 168.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.49 -35.32 62.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.642 0.258 . . . . 70.0 111.282 165.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' VAL . . . . . 0.604 HG11 ' CZ2' ' B' ' 30' ' ' TRP . 27.6 t -56.1 -44.35 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.986 0.422 . . . . 73.55 110.616 -176.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.59 -38.53 87.88 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.192 -0.603 . . . . 82.55 110.936 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -62.69 -50.76 69.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.487 -0.485 . . . . 78.0 110.75 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 37.2 mt -55.25 -40.56 56.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-O 121.071 0.462 . . . . 46.01 110.258 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.6 97.28 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.084 -0.385 . . . . 55.52 111.245 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' LEU . . . . . 0.586 ' O ' HD23 ' B' ' 134' ' ' LEU . 7.9 tt -84.11 8.54 15.22 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 119.929 -0.708 . . . . 76.81 111.721 169.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' TRP . . . . . 0.504 ' C ' ' OE2' ' B' ' 138' ' ' GLU . 54.0 m0 -100.57 0.16 38.86 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.1 -1.84 . . . . 69.54 112.546 167.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' MET . . . . . . . . . . . . . 60.3 mtp -110.3 -37.98 5.38 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.118 0.784 . . . . 61.34 113.118 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' THR . . . . . 0.428 HG22 ' ND2' ' B' ' 141' ' ' ASN . 61.2 m -57.61 -72.98 0.08 Allowed 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.207 1.003 . . . . 63.91 113.134 -178.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' GLU . . . . . 1.0 ' N ' ' OE1' ' B' ' 138' ' ' GLU . 1.3 pm0 -46.37 -37.53 7.67 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.104 0.962 . . . . 92.43 113.532 173.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -67.56 -33.84 75.85 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 118.865 -1.134 . . . . 51.23 110.45 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' B' ' 144' ' ' LEU . 5.8 mt -67.78 -42.42 81.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.44 -0.504 . . . . 66.72 110.807 165.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ASN . . . . . 0.576 ' HB2' ' HA ' ' B' ' 138' ' ' GLU . 82.1 m-20 -66.06 -40.03 90.59 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.052 0.39 . . . . 65.22 112.052 -175.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -93.11 -57.42 2.63 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.939 -0.476 . . . . 81.28 112.027 -173.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -104.45 -10.13 17.91 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.879 1.066 . . . . 60.91 113.879 -168.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LEU . . . . . 0.823 ' HB2' ' HA ' ' B' ' 140' ' ' LEU . 31.8 mt -110.47 -28.5 8.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 113.675 0.991 . . . . 72.97 113.675 174.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 145' ' ' HIS . . . . . 0.576 ' N ' ' O ' ' B' ' 140' ' ' LEU . 23.6 t-160 -51.8 -33.98 38.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.122 0.419 . . . . 108.97 112.113 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 38.5 m -67.22 -42.99 83.15 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.644 -0.422 . . . . 84.52 111.515 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -74.17 -23.86 59.3 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.391 0.515 . . . . 75.59 112.391 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 144' ' ' LEU . 23.4 mm -64.44 -53.17 46.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.007 0.432 . . . . 96.41 110.622 -175.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -69.35 -18.67 63.82 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.845 0.683 . . . . 111.43 112.845 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -45.47 56.02 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.127 -0.629 . . . . 93.56 111.346 -178.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -87.29 17.88 4.1 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.707 0.632 . . . . 92.21 112.707 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLY . . . . . . . . . . . . . . . 114.4 11.5 11.79 Favored Glycine 0 C--N 1.333 0.381 0 N-CA-C 116.138 1.215 . . . . 97.42 116.138 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . 71.63 -174.63 42.07 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.166 -1.016 . . . . 87.7 112.054 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' TRP . . . . . . . . . . . . . 5.3 m95 -67.97 -35.23 78.02 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.677 -0.761 . . . . 77.54 111.474 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -65.49 -12.48 53.11 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.636 0.606 . . . . 90.13 112.636 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.54 -33.46 60.69 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.092 -0.643 . . . . 84.09 111.505 170.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -62.03 -44.52 96.53 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.453 -0.499 . . . . 75.87 110.932 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 23.5 m -66.92 -32.12 56.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 119.582 -0.847 . . . . 85.41 110.761 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -70.91 -27.41 63.76 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.625 -0.83 . . . . 102.49 111.692 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.7 -20.26 19.69 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.528 0.936 . . . . 84.38 113.528 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -121.37 9.97 10.45 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.381 0.512 . . . . 90.41 112.381 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -80.23 -82.28 0.75 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 118.403 0.547 . . . . 119.43 113.884 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.75 16.68 0.13 Allowed 'Trans proline' 0 C--O 1.236 0.398 0 N-CA-C 113.914 0.698 . . . . 121.43 113.914 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.841 0.353 . . . . 122.58 110.536 176.708 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 10' ' ' GLY . . . . . 0.408 ' HA2' ' CZ ' ' C' ' 61' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.451 0 N-CA-C 113.387 0.115 . . . . 80.96 113.387 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLN . . . . . 0.424 ' HA ' ' OE2' ' C' ' 14' ' ' GLU . . . -86.82 -27.28 23.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.416 0.895 . . . . 89.29 113.416 -165.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ARG . . . . . 0.478 ' HD3' ' OE1' ' C' ' 57' ' ' GLU . 5.5 ttt180 -62.99 -42.1 99.76 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.972 -0.691 . . . . 110.93 111.93 -161.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' TRP . . . . . 0.802 ' CH2' HD12 ' C' ' 142' ' ' LEU . 18.2 p-90 -69.64 -34.29 73.81 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 117.977 -1.489 . . . . 72.31 110.961 173.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLU . . . . . 0.535 ' OE1' ' OE1' ' C' ' 143' ' ' GLN . 13.9 mt-10 -63.59 -36.54 84.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.502 -0.479 . . . . 73.24 111.085 177.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' C' ' 19' ' ' ARG . 11.0 mt -61.83 -39.52 92.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.078 -0.649 . . . . 71.45 110.684 174.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.96 94.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.574 -0.45 . . . . 53.23 111.203 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 37.1 tp -64.33 -40.55 96.12 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.402 -0.519 . . . . 52.35 111.09 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.34 71.69 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.384 -0.912 . . . . 54.61 113.223 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' C' ' 15' ' ' LEU . 30.3 mtp-105 -73.63 -42.11 61.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.196 -0.601 . . . . 64.39 111.006 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 20' ' ' PHE . . . . . 0.42 ' HD1' ' HB2' ' C' ' 50' ' ' LEU . 68.6 t80 -57.01 -41.96 79.47 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.552 -0.459 . . . . 55.45 110.905 172.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.01 -42.37 99.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.637 -0.425 . . . . 49.25 111.154 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -64.36 -37.25 86.83 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.43 -0.508 . . . . 86.83 111.305 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -70.08 -43.95 70.1 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.748 -0.781 . . . . 57.47 110.849 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 49.9 tp -55.84 -27.14 50.1 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.025 -0.27 . . . . 67.57 111.327 173.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' SER . . . . . 0.441 ' HA ' ' CD1' ' D' ' 71' ' ' PHE . 35.1 t -62.03 -55.43 29.3 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.192 0.52 . . . . 76.71 111.132 178.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' TRP . . . . . . . . . . . . . 34.4 t90 -56.47 -31.55 64.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.244 -0.435 . . . . 75.56 111.742 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -74.58 -40.81 48.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.597 -0.441 . . . . 65.04 110.764 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' SER . . . . . 0.446 ' OG ' ' NE2' ' C' ' 132' ' ' GLN . 41.9 m -65.58 -10.87 39.09 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.165 0.802 . . . . 67.19 113.165 -176.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 73.4 p -68.38 -26.18 65.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.961 -0.696 . . . . 77.97 111.102 169.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' LEU . . . . . . . . . . . . . 78.6 mt 52.05 36.58 19.14 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.548 0.689 . . . . 73.77 110.489 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -61.34 168.37 2.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.902 0.858 . . . . 84.88 109.968 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -63.2 -36.72 84.59 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.703 -0.799 . . . . 109.94 110.889 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.53 -36.23 75.73 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 111.939 0.348 . . . . 100.84 111.939 169.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 16.8 t -71.67 -49.57 45.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.853 0.358 . . . . 70.09 110.673 -173.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -59.18 -39.64 83.19 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.583 -0.447 . . . . 65.59 110.973 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -61.46 -38.27 86.6 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.603 0.24 . . . . 102.0 111.24 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.83 -37.14 56.23 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 122.171 -0.331 . . . . 87.27 111.878 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 71.9 mt -61.7 -15.34 39.53 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.383 0.512 . . . . 57.59 112.383 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.69 -2.32 25.74 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.764 0.653 . . . . 59.14 112.764 173.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' SER . . . . . . . . . . . . . 98.7 p -116.29 178.84 4.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.628 0.771 . . . . 62.38 109.684 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' SER . . . . . . . . . . . . . 9.6 m -91.76 -3.07 56.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.467 -0.788 . . . . 68.03 112.646 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -68.54 -41.22 80.14 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.171 0.441 . . . . 76.83 111.815 -171.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 46.0 t -69.48 -41.69 80.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 119.968 -0.693 . . . . 51.37 110.755 -174.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -74.46 -34.13 63.07 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.753 -0.779 . . . . 51.47 111.736 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -68.93 -41.0 78.69 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.033 -0.667 . . . . 84.68 111.035 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -60.44 -43.93 96.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.415 -0.514 . . . . 52.85 110.963 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' LEU . . . . . . . . . . . . . 17.6 mt -56.44 -32.14 64.62 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 111.839 0.311 . . . . 57.7 111.839 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -72.94 -37.54 67.1 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.507 -0.477 . . . . 71.68 111.251 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.17 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.555 -0.458 . . . . 48.88 111.35 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LEU . . . . . 0.42 ' HB2' ' HD1' ' C' ' 20' ' ' PHE . 11.0 mt -71.34 -30.8 66.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.372 -0.531 . . . . 45.37 111.251 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 51' ' ' MET . . . . . . . . . . . . . 61.7 ttp -67.51 -52.78 34.98 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.692 0.282 . . . . 54.17 110.964 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -62.88 -30.21 71.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.517 -0.473 . . . . 47.94 111.609 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -67.81 -47.52 68.85 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.49 -0.484 . . . . 50.72 110.905 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 32.5 m -58.27 -44.78 88.57 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 53.8 111.027 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' MET . . . . . . . . . . . . . 92.1 mmm -69.85 -36.61 75.67 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.519 -0.473 . . . . 49.22 111.278 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -61.81 -45.03 95.59 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.483 -0.487 . . . . 58.63 110.883 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLU . . . . . 0.478 ' OE1' ' HD3' ' C' ' 12' ' ' ARG . 73.1 mm-40 -66.62 -42.57 86.59 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.493 -0.483 . . . . 76.89 111.328 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . 29.4 tp -64.95 -36.28 83.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.596 -0.441 . . . . 55.59 111.311 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -67.51 -39.63 85.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.216 -0.594 . . . . 72.97 111.148 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.61 -19.81 62.81 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.182 0.438 . . . . 56.23 112.182 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' TYR . . . . . 0.408 ' CZ ' ' HA2' ' C' ' 10' ' ' GLY . 55.6 t80 -80.78 -43.76 19.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.467 -0.493 . . . . 83.53 111.305 176.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 62' ' ' LYS . . . . . 0.57 ' O ' ' HG2' ' C' ' 66' ' ' GLU . 25.7 tttp -56.07 -49.07 74.83 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.551 -0.459 . . . . 86.88 110.684 173.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 63' ' ' SER . . . . . . . . . . . . . 65.5 m -57.35 -40.44 78.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.875 -0.33 . . . . 82.89 111.347 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.7 -41.97 96.29 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.46 . . . . 89.84 111.121 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.7 -23.07 63.38 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.371 -0.532 . . . . 88.83 112.166 177.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' C' ' 62' ' ' LYS . 4.5 mm-40 -67.24 9.45 0.22 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-O 118.536 -0.745 . . . . 99.42 112.922 174.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -110.23 -57.75 2.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.181 0.9 . . . . 106.27 111.836 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' GLN . . . . . 0.434 ' O ' ' NE2' ' C' ' 68' ' ' GLN . 6.7 tp60 -82.59 7.23 15.18 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.023 0.529 . . . . 116.52 112.112 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 69' ' ' LEU . . . . . 0.525 HD21 ' O ' ' C' ' 149' ' ' TYR . 1.2 mt -65.1 160.12 21.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.911 0.863 . . . . 121.88 111.174 173.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 70' ' ' THR . . . . . 0.579 ' O ' ' N ' ' C' ' 72' ' ' VAL . 3.1 m -129.03 88.09 52.55 Favored Pre-proline 0 C--O 1.255 1.373 0 CA-C-N 114.804 -1.089 . . . . 132.78 112.003 -168.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 71' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -6.96 48.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.169 0 N-CA-C 121.066 3.449 . . . . 139.04 121.066 141.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' VAL . . . . . 0.579 ' N ' ' O ' ' C' ' 70' ' ' THR . 12.2 t -115.29 -38.45 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 119.292 -2.13 . . . . 136.61 111.964 166.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.19 32.99 0.61 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.014 0.825 . . . . 132.09 111.978 159.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' GLU . . . . . 0.541 ' HA ' ' HG2' ' C' ' 77' ' ' ARG . 8.7 tt0 -62.85 -25.3 68.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.15 -0.62 . . . . 141.86 111.976 -170.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.86 -55.14 21.3 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.773 -0.771 . . . . 130.23 110.314 169.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 6.7 p -104.98 49.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.423 0.527 . . . . 138.1 112.423 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' C' ' 74' ' ' GLU . 3.3 ptm180 -112.99 6.48 17.73 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.976 -1.078 . . . . 125.98 111.232 159.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.45 13.67 1.89 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.787 0.435 . . . . 123.88 111.159 148.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -121.07 -28.43 4.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.139 1.776 . . . . 129.07 112.09 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 26.1 mt -82.86 -42.97 17.15 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 122.479 0.311 . . . . 112.31 111.4 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -67.46 -32.98 74.21 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.654 -0.418 . . . . 105.71 111.798 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' LYS . . . . . 0.443 ' N ' ' HD3' ' C' ' 82' ' ' LYS . 1.1 mmtp -73.73 -36.86 65.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.176 -0.609 . . . . 109.59 110.882 -176.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -75.2 -21.28 58.8 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.092 0.404 . . . . 136.72 112.092 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 48.1 tp -80.12 -29.95 39.03 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.609 -0.437 . . . . 91.89 111.527 171.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -62.61 -34.11 76.36 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.278 -0.569 . . . . 84.74 111.366 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.25 58.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.036 0.384 . . . . 66.34 112.036 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.1 96.32 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.498 -0.481 . . . . 67.29 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -76.52 -35.93 58.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.273 -0.571 . . . . 80.1 111.175 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.1 -36.16 67.86 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.823 -0.351 . . . . 62.55 111.091 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' ARG . . . . . . . . . . . . . 93.3 mtm-85 -74.89 -43.88 51.92 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.301 -0.559 . . . . 75.21 111.212 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -52.92 -49.9 65.06 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.827 0.346 . . . . 65.55 110.984 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.2 -36.13 92.49 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.057 -1.068 . . . . 47.75 112.692 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.28 -37.64 83.77 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.227 -0.572 . . . . 45.47 111.274 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.03 -48.22 82.62 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.517 -0.473 . . . . 55.93 110.866 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' MET . . . . . . . . . . . . . 28.3 mtp -73.33 -27.98 61.82 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.579 -0.448 . . . . 49.57 111.841 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -67.89 -38.59 83.2 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.609 -0.836 . . . . 57.88 110.858 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -69.48 -35.87 75.99 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.579 -0.449 . . . . 39.11 111.415 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 13.7 t -55.32 -41.89 63.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.285 0.565 . . . . 45.74 110.204 173.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' ARG . . . . . 0.42 ' NH2' ' O ' ' C' ' 201' ' ' HOH . 14.0 ttt-85 -70.48 -45.81 64.97 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.082 -0.386 . . . . 69.74 111.272 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 100' ' ' GLY . . . . . . . . . . . . . . . -64.62 -37.83 94.9 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.092 -1.052 . . . . 49.74 112.848 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' ARG . . . . . 0.475 ' HD2' ' CD2' ' C' ' 127' ' ' HIS . 17.8 tpp180 -57.94 -31.86 67.25 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.324 -0.516 . . . . 59.21 111.571 178.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.97 -24.92 28.09 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.835 0.68 . . . . 45.15 112.835 176.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 30.8 t -66.28 -36.8 78.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.397 -0.521 . . . . 49.42 110.16 170.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -66.89 -42.7 85.08 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.937 -0.477 . . . . 52.02 111.441 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -56.33 -47.34 78.95 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.511 -0.476 . . . . 48.75 110.659 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -57.55 -41.12 80.38 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.602 -0.439 . . . . 70.32 111.01 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.69 -36.07 91.86 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.147 -1.025 . . . . 39.22 112.989 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.13 -46.84 54.97 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.119 -0.636 . . . . 54.96 111.15 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -62.63 -31.83 53.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.564 -0.454 . . . . 54.48 110.769 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.68 -36.16 82.92 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.826 -0.547 . . . . 49.86 111.182 175.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.19 -21.34 60.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.515 -0.474 . . . . 60.87 112.13 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' MET . . . . . 0.444 ' HG2' ' HB2' ' B' ' 90' ' ' ALA . 9.8 mtp -94.87 22.65 6.23 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.668 0.618 . . . . 65.14 112.668 176.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 113' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' B' ' 138' ' ' GLU . 7.0 mt 61.95 33.28 17.49 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.168 0.587 . . . . 67.89 111.112 174.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 114' ' ' GLY . . . . . . . . . . . . . . . 88.71 -13.68 61.99 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 115.136 0.814 . . . . 71.4 115.136 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -85.43 156.2 20.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.632 1.216 . . . . 92.73 110.555 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 19.1 t -132.94 125.02 28.9 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.23 -0.895 . . . . 72.11 109.021 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' THR . . . . . . . . . . . . . 69.2 p -78.48 167.63 21.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.991 0.9 . . . . 63.19 110.565 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -85.48 -27.99 25.3 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.293 -0.867 . . . . 92.11 111.376 170.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -53.82 -37.48 63.6 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.734 -0.386 . . . . 63.72 110.756 170.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' LEU . . . . . . . . . . . . . 41.9 tp -75.16 -46.11 36.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 121.027 -0.269 . . . . 42.04 111.344 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 121' ' ' ARG . . . . . . . . . . . . . 27.2 mtm-85 -67.08 -37.66 84.38 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.198 -0.601 . . . . 61.49 111.521 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' VAL . . . . . . . . . . . . . 88.2 t -63.52 -38.29 81.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.173 -0.611 . . . . 51.86 110.12 172.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ARG . . . . . . . . . . . . . 34.6 ttp85 -67.43 -40.84 85.5 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 121.991 -0.443 . . . . 52.32 111.32 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.72 -44.48 85.94 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.559 -0.456 . . . . 49.1 111.31 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.45 -27.07 67.23 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.614 -0.434 . . . . 41.62 111.589 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 126' ' ' SER . . . . . . . . . . . . . 63.0 m -70.83 -35.8 72.63 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.33 -0.548 . . . . 45.85 111.095 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' HIS . . . . . 0.475 ' CD2' ' HD2' ' C' ' 101' ' ' ARG . 28.9 m-70 -78.2 -38.93 42.12 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.672 -0.411 . . . . 49.02 111.53 178.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 42.8 mt -62.03 -42.36 99.09 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.258 -0.577 . . . . 39.05 111.155 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.81 -40.04 87.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.516 -0.474 . . . . 55.75 110.43 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.04 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.95 -0.469 . . . . 41.96 111.015 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.27 -37.3 71.91 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.321 -0.551 . . . . 36.15 111.359 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 132' ' ' GLN . . . . . 0.446 ' NE2' ' OG ' ' C' ' 28' ' ' SER . 52.5 mt-30 -53.0 -49.75 65.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.095 0.474 . . . . 73.24 110.937 173.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 133' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' D' ' 112' ' ' PHE . 90.3 mt -64.6 -45.87 85.09 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.805 0.336 . . . . 48.95 111.114 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.76 -35.14 79.4 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.085 -0.646 . . . . 53.46 111.203 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -61.62 2.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.358 -0.537 . . . . 58.96 110.361 174.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 136' ' ' ILE . . . . . 0.797 ' HA ' ' HB3' ' C' ' 139' ' ' ALA . 93.6 mt -61.89 -30.16 47.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 116.729 -0.214 . . . . 59.07 111.163 178.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 137' ' ' GLY . . . . . . . . . . . . . . . -63.54 -63.37 4.53 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.54 -0.624 . . . . 65.81 111.54 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 138' ' ' ASP . . . . . 0.718 ' O ' HD22 ' C' ' 142' ' ' LEU . 11.5 m-20 -67.01 2.79 1.31 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 118.245 -0.883 . . . . 78.4 112.084 167.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 139' ' ' ALA . . . . . 0.801 ' C ' HD21 ' C' ' 142' ' ' LEU . . . -95.3 23.19 6.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.123 0.569 . . . . 102.18 111.789 160.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 140' ' ' PHE . . . . . 0.546 ' N ' HD21 ' C' ' 142' ' ' LEU . 1.2 m-85 -122.33 -47.82 2.11 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.29 1.036 . . . . 94.11 113.384 161.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 141' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.01 -26.21 64.33 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.611 0.967 . . . . 100.67 113.611 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 142' ' ' LEU . . . . . 1.016 ' H ' HD23 ' C' ' 142' ' ' LEU . 1.3 pt? -58.07 -67.39 0.35 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.728 1.611 . . . . 106.08 111.348 163.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 143' ' ' GLN . . . . . 0.805 ' N ' ' HG ' ' C' ' 142' ' ' LEU . 35.0 tt0 -70.5 -13.87 62.29 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.578 1.951 . . . . 97.15 112.009 -161.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . . . -82.03 -39.74 23.08 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 121.039 -0.264 . . . . 110.22 110.847 163.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 145' ' ' ARG . . . . . . . . . . . . . . . -76.6 -8.33 57.01 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.831 1.049 . . . . 96.31 113.831 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 146' ' ' LEU . . . . . 0.552 HD12 ' O ' ' C' ' 142' ' ' LEU . 5.2 mp -99.18 -41.14 7.63 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.807 1.185 . . . . 105.75 112.394 171.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.0 -2.12 4.96 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 106.87 112.379 167.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.37 -29.35 3.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.187 -1.412 . . . . 109.11 107.187 167.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 149' ' ' TYR . . . . . 0.525 ' O ' HD21 ' C' ' 69' ' ' LEU . 0.6 OUTLIER -73.86 -21.01 60.26 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 119.088 -0.482 . . . . 117.88 112.23 176.899 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . . . -93.72 -37.06 12.01 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.946 0.794 . . . . 116.5 112.129 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.56 17.54 2.18 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.746 0.647 . . . . 123.68 112.746 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 152' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-N 117.864 0.302 . . . . 112.8 112.879 179.841 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.734 0.302 . . . . 95.93 110.713 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -58.98 -37.16 76.18 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.056 -0.52 . . . . 84.81 111.247 176.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -73.51 -40.52 63.98 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.507 -0.477 . . . . 75.8 112.047 -167.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ARG . . . . . . . . . . . . . . . -61.12 -39.94 91.92 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.906 -0.718 . . . . 66.45 110.789 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -56.31 -47.43 78.74 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.986 0.422 . . . . 96.06 111.558 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.06 -26.78 27.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 O-C-N 122.226 -0.296 . . . . 66.45 111.675 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' VAL . . . . . 0.442 ' O ' HG12 ' D' ' 19' ' ' ILE . 25.7 t -71.52 -53.45 20.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 121.649 -0.657 . . . . 76.27 110.958 -171.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 16' ' ' MET . . . . . . . . . . . . . 4.0 tpp -68.35 -40.66 81.46 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.383 -0.527 . . . . 89.82 111.826 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.3 -40.81 71.55 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.428 -0.509 . . . . 79.07 110.892 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' TYR . . . . . 0.461 ' OH ' ' OE2' ' D' ' 111' ' ' GLU . 26.6 t80 -69.95 -31.97 69.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.539 -0.464 . . . . 64.15 111.507 175.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ILE . . . . . 0.442 HG12 ' O ' ' D' ' 15' ' ' VAL . 28.2 mm -69.29 -45.14 79.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.658 -0.417 . . . . 81.48 110.543 -178.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 20' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -53.4 -58.12 8.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.498 0.666 . . . . 82.5 111.054 175.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' TYR . . . . . 0.409 ' OH ' ' OD2' ' D' ' 61' ' ' ASP . 23.8 t80 -59.79 -38.56 82.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.571 -0.741 . . . . 84.05 111.577 -168.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -66.26 -24.67 66.62 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.328 -0.549 . . . . 72.17 112.319 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' LEU . . . . . 0.609 HD23 HG12 ' D' ' 118' ' ' VAL . 21.3 mt -79.88 -26.08 40.4 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.032 0.378 . . . . 83.33 111.928 175.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 24' ' ' SER . . . . . . . . . . . . . 70.3 m -65.05 -39.65 93.6 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.441 -0.503 . . . . 77.45 111.198 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' GLN . . . . . . . . . . . . . . . -64.15 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.018 0.377 . . . . 88.83 112.018 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . . . -89.52 -0.61 57.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.43 0.53 . . . . 93.82 112.43 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.0 83.39 0.89 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-O 119.925 -0.375 . . . . 93.38 113.171 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -160.48 -148.53 0.17 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 119.465 -0.894 . . . . 101.51 109.293 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' GLU . . . . . 0.568 ' HG2' ' N ' ' D' ' 30' ' ' TRP . 55.2 tt0 -142.89 164.38 30.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.99 1.316 . . . . 95.82 108.533 -168.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 30' ' ' TRP . . . . . 0.568 ' N ' ' HG2' ' D' ' 29' ' ' GLU . . . -148.04 160.75 42.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 121.826 0.822 . . . . 106.19 110.767 165.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 114.313 -1.312 . . . . 119.57 111.092 176.322 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.768 0.318 . . . . 108.13 111.731 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 50' ' ' GLU . . . . . 0.428 ' HA ' ' CD2' ' D' ' 53' ' ' HIS . . . -82.31 18.16 1.5 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 112.32 0.489 . . . . 92.86 112.32 172.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 51' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.76 -35.83 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 O-C-N 123.331 0.394 . . . . 82.88 111.032 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' VAL . . . . . 0.444 HG12 HG11 ' D' ' 158' ' ' VAL . 3.0 m -73.24 -30.38 30.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 O-C-N 121.936 -0.477 . . . . 76.83 110.355 178.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 53' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' D' ' 50' ' ' GLU . 6.0 m-70 -65.14 -41.84 94.38 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.938 -0.477 . . . . 81.63 110.858 176.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' D' ' 58' ' ' GLN . 0.6 OUTLIER -72.53 -45.42 59.41 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.756 -0.378 . . . . 74.27 111.179 -179.516 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 55' ' ' THR . . . . . . . . . . . . . 31.6 m -59.17 -41.72 89.08 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.523 -0.471 . . . . 65.75 111.139 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' LEU . . . . . . . . . . . . . 48.4 tp -66.91 -28.21 68.12 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.323 -0.551 . . . . 56.5 111.364 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' ARG . . . . . . . . . . . . . . . -68.14 -40.37 82.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.22 -0.592 . . . . 56.48 111.12 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 58' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' D' ' 54' ' ' LEU . 7.6 mt-30 -70.78 -47.19 60.89 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.346 -0.541 . . . . 71.24 110.994 177.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.58 -38.35 63.82 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.816 -0.354 . . . . 57.12 111.08 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.26 -47.92 55.56 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.002 -1.094 . . . . 58.19 112.355 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' ASP . . . . . 0.409 ' OD2' ' OH ' ' D' ' 21' ' ' TYR . 75.1 m-20 -60.18 -44.54 94.98 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.288 -0.537 . . . . 78.87 111.204 178.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 62' ' ' ASP . . . . . 0.425 ' HB3' ' HZ ' ' C' ' 140' ' ' PHE . 2.0 m-20 -52.88 -60.32 3.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.242 0.544 . . . . 91.35 110.655 170.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 63' ' ' PHE . . . . . 0.448 ' CD1' ' HG3' ' D' ' 111' ' ' GLU . 26.2 t80 -48.71 -41.95 33.51 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.99 -0.55 . . . . 75.81 111.47 175.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -71.53 -23.47 61.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.588 0.588 . . . . 78.44 112.588 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ARG . . . . . . . . . . . . . 79.3 mtm-85 -83.66 -13.72 53.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.996 0.739 . . . . 86.83 112.996 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -88.74 -33.5 17.47 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.504 0.593 . . . . 106.7 111.737 167.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -66.4 -64.3 0.89 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 110.048 -0.353 . . . . 95.04 110.048 175.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' ARG . . . . . 0.589 ' HG3' ' HA ' ' D' ' 72' ' ' ALA . 5.4 mpt_? -67.65 1.23 2.56 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.237 0.458 . . . . 107.1 112.237 -178.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . . . -73.2 -44.8 59.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.461 -0.496 . . . . 95.16 110.94 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -105.52 -34.07 7.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 114.273 1.212 . . . . 111.63 114.273 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' PHE . . . . . 0.441 ' CD1' ' HA ' ' C' ' 25' ' ' SER . 11.6 m-85 -103.3 -54.31 2.63 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.601 0.637 . . . . 90.19 110.47 -176.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 72' ' ' ALA . . . . . 0.589 ' HA ' ' HG3' ' D' ' 68' ' ' ARG . . . 63.42 38.62 9.87 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.979 0.912 . . . . 96.79 112.514 175.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . . . -144.59 -83.18 0.15 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.383 1.253 . . . . 91.73 114.383 -174.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 74' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' D' ' 74' ' ' MET . 34.4 ttm 43.84 32.59 0.62 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.456 1.102 . . . . 97.12 110.351 -153.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 4.5 p -78.62 2.35 19.66 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.161 -1.016 . . . . 98.61 111.023 157.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.42 3.32 28.56 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.347 1.059 . . . . 94.15 112.942 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 77' ' ' GLN . . . . . . . . . . . . . . . -66.73 84.26 0.11 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.86 -1.163 . . . . 92.89 107.86 167.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 16.7 mt -75.35 136.55 40.81 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.078 0.466 . . . . 91.49 111.552 -165.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' HIS . . . . . . . . . . . . . . . 51.24 51.56 16.67 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.39 -0.823 . . . . 82.13 111.331 177.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 20.0 tp -78.29 95.38 5.0 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.055 -1.091 . . . . 71.43 108.055 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 19.0 p -101.5 167.67 10.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 124.512 1.125 . . . . 51.51 109.92 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -61.95 -19.04 64.53 Favored 'Trans proline' 0 C--O 1.237 0.452 0 N-CA-C 113.755 0.636 . . . . 49.85 113.755 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -98.28 -33.89 10.91 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.361 0.874 . . . . 52.91 113.361 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 71.6 p -89.41 -5.42 57.44 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.0 0.741 . . . . 43.8 113.0 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.36 -43.74 96.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.243 0.474 . . . . 41.55 111.352 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -67.4 -28.16 67.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.252 -0.579 . . . . 63.67 111.271 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.2 -44.38 53.42 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.137 -1.03 . . . . 47.86 112.617 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.54 -47.73 77.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.214 -0.58 . . . . 74.14 110.869 176.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 89' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -51.23 -43.31 61.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.621 0.248 . . . . 38.78 111.429 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.71 70.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.7 -0.4 . . . . 35.7 111.447 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' THR . . . . . . . . . . . . . 34.2 m -59.69 -38.7 82.26 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.469 -0.493 . . . . 39.63 111.229 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 50.4 t -78.0 -46.82 25.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.152 -0.342 . . . . 40.67 110.971 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' VAL . . . . . . . . . . . . . 49.9 t -63.95 -37.93 81.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.882 -0.511 . . . . 38.82 110.636 -177.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -60.75 -53.58 55.72 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.896 -0.502 . . . . 49.06 111.103 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -67.76 -26.47 66.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.887 -0.325 . . . . 66.7 111.874 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 5.4 tt -64.13 -37.87 89.03 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.515 -0.474 . . . . 44.01 111.082 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.48 12.17 29.9 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.008 0.744 . . . . 54.07 113.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -55.18 -56.84 15.41 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.294 0.497 . . . . 54.7 111.711 -172.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -102.78 44.56 1.01 Allowed 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.507 0.558 . . . . 73.96 112.507 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' GLY . . . . . . . . . . . . . . . 123.76 168.79 13.04 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-O 122.512 1.062 . . . . 72.15 112.437 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' VAL . . . . . . . . . . . . . 44.8 t -133.42 142.98 40.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 113.956 -1.122 . . . . 69.15 108.614 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -153.07 -170.64 3.68 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.119 -1.067 . . . . 55.87 108.119 173.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' TRP . . . . . 0.403 ' HH2' HG23 ' D' ' 148' ' ' ILE . 44.0 m95 -77.87 -41.28 37.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.934 -0.706 . . . . 58.56 111.901 -178.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 104' ' ' GLY . . . . . . . . . . . . . . . -62.35 -25.92 67.33 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.188 -1.006 . . . . 47.73 113.144 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -82.94 -31.39 27.7 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 122.311 -0.523 . . . . 67.91 111.896 177.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.93 -36.2 76.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.338 -0.545 . . . . 45.23 110.162 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 107' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.56 -45.68 98.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.174 0.511 . . . . 42.63 110.195 173.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.39 -37.3 74.99 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.576 -0.45 . . . . 36.68 110.986 174.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' PHE . . . . . 0.42 ' HZ ' ' HA ' ' D' ' 136' ' ' MET . 64.6 t80 -62.04 -40.56 96.15 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 121.142 -0.223 . . . . 45.77 111.264 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 110' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -72.81 -35.87 67.43 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.121 -0.632 . . . . 39.68 111.153 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' GLU . . . . . 0.461 ' OE2' ' OH ' ' D' ' 18' ' ' TYR . 31.9 mm-40 -65.31 -43.46 91.0 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.263 -0.575 . . . . 50.29 111.205 176.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 112' ' ' PHE . . . . . 0.451 ' HB2' HD13 ' C' ' 133' ' ' LEU . 51.3 t80 -62.85 -46.55 87.35 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.3 -0.56 . . . . 41.09 111.146 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 113' ' ' GLY . . . . . 0.446 ' HA3' ' SD ' ' D' ' 136' ' ' MET . . . -60.36 -39.44 96.17 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 119.85 -1.167 . . . . 54.39 112.385 178.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.73 -41.35 99.59 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.249 -0.976 . . . . 52.72 112.975 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' D' ' 118' ' ' VAL . 38.6 t -68.4 -40.59 82.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 119.919 -0.712 . . . . 67.81 110.607 -179.341 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 116' ' ' MET . . . . . . . . . . . . . 10.1 mmm -52.4 -26.87 13.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.975 -0.453 . . . . 63.82 111.27 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 117' ' ' CYS . . . . . . . . . . . . . 97.8 m -84.41 -22.31 30.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.024 0.75 . . . . 74.59 113.024 176.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' VAL . . . . . 0.609 HG12 HD23 ' D' ' 23' ' ' LEU . 3.2 m -97.9 -38.35 7.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 118.828 0.74 . . . . 89.79 111.674 178.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 30.6 tp10 -62.1 -26.95 68.58 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.518 -0.473 . . . . 82.0 110.825 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 120' ' ' SER . . . . . . . . . . . . . 34.6 m -63.56 -50.61 68.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.801 0.334 . . . . 82.15 110.993 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 121' ' ' VAL . . . . . . . . . . . . . 21.2 t -58.02 -44.8 87.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.031 0.443 . . . . 82.76 110.835 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -71.71 -11.45 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.849 0.685 . . . . 92.19 112.849 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . . . -122.19 25.91 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.434 0.561 . . . . 79.55 111.769 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 70.73 31.86 2.65 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.099 0.96 . . . . 103.26 112.893 167.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' MET . . . . . . . . . . . . . 5.0 mtm -125.94 136.59 53.2 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.299 -1.0 . . . . 76.89 108.299 173.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 126' ' ' SER . . . . . 0.588 ' H ' ' HD2' ' D' ' 127' ' ' PRO . 44.8 m -135.21 -46.02 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 116.842 -1.943 . . . . 87.67 113.737 -178.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 127' ' ' PRO . . . . . 0.588 ' HD2' ' H ' ' D' ' 126' ' ' SER . 12.0 Cg_endo -62.91 -20.87 72.52 Favored 'Trans proline' 0 C--O 1.238 0.498 0 CA-C-N 120.997 1.392 . . . . 79.19 113.024 179.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 128' ' ' LEU . . . . . . . . . . . . . 3.3 mt -39.66 -42.48 1.22 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.201 1.0 . . . . 72.73 111.232 167.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 32.0 t -51.73 -38.08 21.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 115.903 -0.589 . . . . 69.01 111.001 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -43.01 75.34 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.014 -0.674 . . . . 79.04 111.55 -178.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -65.51 -44.75 86.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.055 -0.658 . . . . 86.21 111.04 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 68.3 mt -53.51 -41.71 46.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.16 0.505 . . . . 46.85 110.271 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.0 -39.28 85.23 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.69 -0.404 . . . . 51.5 111.174 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 tt -72.5 -45.44 59.39 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.079 -0.648 . . . . 63.5 110.763 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 135' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -54.1 -50.7 66.23 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.838 0.351 . . . . 48.97 110.837 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' MET . . . . . 0.446 ' SD ' ' HA3' ' D' ' 113' ' ' GLY . 61.3 mtp -62.44 -50.99 69.26 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.802 -0.359 . . . . 52.68 111.333 178.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 137' ' ' THR . . . . . . . . . . . . . 62.2 m -55.15 -52.97 61.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.17 0.509 . . . . 54.32 110.794 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 138' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' D' ' 142' ' ' ARG . 5.4 tp10 -67.88 -33.2 74.28 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 120.387 -0.525 . . . . 88.06 111.404 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 139' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -67.47 -37.81 83.46 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.49 -0.884 . . . . 52.14 111.142 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' LEU . . . . . . . . . . . . . 11.3 mt -62.42 -42.29 99.33 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.673 -0.411 . . . . 64.76 111.344 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -75.08 -27.86 60.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.705 0.631 . . . . 71.3 112.705 -171.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 142' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' D' ' 138' ' ' GLU . 49.5 mtt180 -96.48 -60.71 1.55 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.45 -0.9 . . . . 81.11 112.61 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -99.9 -13.49 19.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.538 0.94 . . . . 68.96 113.538 -166.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 35.8 mt -105.87 -19.53 13.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.061 0.763 . . . . 72.12 113.061 172.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 145' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -55.83 -45.86 78.28 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.871 0.367 . . . . 108.28 111.669 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' THR . . . . . . . . . . . . . 17.3 m -65.5 -38.09 88.7 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.436 -0.506 . . . . 84.63 111.643 -173.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 147' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -66.78 -36.57 82.7 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.331 -0.948 . . . . 77.41 111.528 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 148' ' ' ILE . . . . . 0.403 HG23 ' HH2' ' D' ' 103' ' ' TRP . 21.2 mt -69.72 -48.51 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 120.375 -0.53 . . . . 96.52 110.609 -173.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 149' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 -58.38 -15.25 9.87 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.711 0.634 . . . . 118.94 112.711 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.16 -26.33 13.7 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.615 0.968 . . . . 94.94 113.615 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 151' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -88.44 16.51 6.36 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.707 0.685 . . . . 85.08 112.085 169.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 152' ' ' GLY . . . . . . . . . . . . . . . 108.62 13.4 18.77 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 115.984 1.154 . . . . 103.47 115.984 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 153' ' ' GLY . . . . . . . . . . . . . . . 67.08 -168.46 37.34 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 118.807 1.303 . . . . 80.45 111.788 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 154' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -71.06 -34.57 71.33 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.482 -0.859 . . . . 82.73 111.949 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 155' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -72.69 -7.89 52.66 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.713 0.635 . . . . 92.63 112.713 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.26 -26.0 33.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.09 -0.644 . . . . 76.69 111.313 167.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 157' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -63.22 -41.87 99.19 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.287 -0.565 . . . . 66.58 110.957 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 158' ' ' VAL . . . . . 0.444 HG11 HG12 ' D' ' 52' ' ' VAL . 33.4 m -71.87 -32.2 43.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 C-N-CA 119.552 -0.859 . . . . 78.04 111.063 -179.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 159' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.67 -19.84 62.75 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 118.326 -1.35 . . . . 100.73 112.178 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 160' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -98.43 -29.91 12.85 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 113.415 0.894 . . . . 85.97 113.415 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 161' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -114.93 11.57 16.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.9 0.704 . . . . 91.37 112.9 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 162' ' ' GLY . . . . . . . . . . . . . . . -97.66 -69.89 0.99 Allowed Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 115.019 0.767 . . . . 104.17 115.019 -170.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 163' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -65.27 5.88 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 CA-C-N 117.523 0.662 . . . . 122.94 113.041 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 164' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--N 1.33 -0.281 0 C-N-CA 122.716 0.406 . . . . 127.43 109.972 171.512 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . 0.579 ' O1 ' ' NH2' ' A' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . 0.42 ' O ' ' NH2' ' C' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 120.919 0.177 . . . . 87.68 113.023 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -94.84 56.88 2.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 105.89 111.898 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptm85 -136.26 -48.12 0.65 Allowed 'General case' 0 C--O 1.235 0.294 0 C-N-CA 119.088 -1.045 . . . . 97.36 112.157 172.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -59.05 -29.02 67.0 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 118.571 -1.251 . . . . 68.64 110.155 166.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -68.08 -35.24 77.85 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 121.23 -0.188 . . . . 81.24 111.274 173.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.416 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 16.5 mt -71.86 -42.53 66.77 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.93 -0.708 . . . . 74.52 111.091 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.23 -40.35 85.63 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.433 -0.507 . . . . 60.21 110.936 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.42 -45.77 91.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.679 -0.408 . . . . 52.68 110.871 174.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.69 -23.56 55.6 Favored Glycine 0 C--N 1.335 0.493 0 C-N-CA 120.908 -0.663 . . . . 57.56 113.696 175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 25.3 mtp-105 -81.27 -34.54 31.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 117.813 0.806 . . . . 64.42 111.165 174.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -62.7 -50.78 69.8 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.398 -0.521 . . . . 58.76 110.683 171.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.07 -41.35 98.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 120.935 -0.306 . . . . 59.53 111.429 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -62.78 -38.04 89.04 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.533 -0.467 . . . . 101.05 111.259 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -70.38 -48.39 56.47 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.986 -0.686 . . . . 62.62 110.906 176.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.407 HD12 HG11 ' A' ' 98' ' ' VAL . 6.0 tt -51.95 -40.72 61.28 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.641 0.258 . . . . 64.36 110.853 173.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.7 t -52.43 -43.16 64.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.681 0.276 . . . . 72.53 111.341 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.475 ' O ' HG22 ' A' ' 29' ' ' THR . 39.6 t90 -70.1 -31.01 68.37 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 119.904 -0.718 . . . . 61.5 111.734 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.03 -31.56 35.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 118.873 -1.131 . . . . 60.09 110.36 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.7 m -64.71 -21.13 66.68 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.431 0.53 . . . . 57.34 112.431 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 26' ' ' TRP . 1.2 t -64.05 -23.14 67.22 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.783 -0.767 . . . . 72.59 111.501 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.4 mt 49.49 39.52 16.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.531 0.681 . . . . 69.81 111.354 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 89.4 p -71.11 162.12 29.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.95 0.881 . . . . 76.32 110.456 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 32' ' ' GLU . 6.0 mp0 -46.85 -42.16 16.86 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.845 -1.071 . . . . 87.7 110.491 168.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -58.71 -47.17 85.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.335 -0.393 . . . . 88.08 111.082 172.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.5 t -67.28 -45.81 85.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-O 120.883 0.373 . . . . 72.21 110.787 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -61.33 -40.19 93.3 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.339 -0.544 . . . . 66.64 111.303 -177.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.69 -41.27 97.35 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.333 -0.547 . . . . 88.71 110.962 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -64.81 -41.02 96.11 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.563 -0.455 . . . . 91.4 111.287 177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 41.2 mt -62.73 -13.72 36.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.268 0.84 . . . . 58.86 113.268 -175.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.739 HD22 HG21 ' A' ' 109' ' ' VAL . 6.1 mt -88.14 -1.36 57.96 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.757 0.708 . . . . 64.48 112.213 176.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -106.95 176.29 5.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.1 0.96 . . . . 64.13 108.992 172.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 16.3 p -99.71 15.02 28.15 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.633 -0.712 . . . . 60.42 112.363 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -81.47 -27.83 34.41 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.378 0.51 . . . . 66.31 112.378 -178.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.6 t -80.27 -38.93 18.61 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 120.104 -0.638 . . . . 54.56 110.77 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.7 p -75.32 -30.38 60.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.052 -0.659 . . . . 48.2 111.899 176.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -65.94 -41.83 90.82 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.142 -0.623 . . . . 65.78 110.989 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.84 -39.97 94.41 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.471 -0.492 . . . . 58.13 111.214 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.0 mt -61.39 -37.98 85.38 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.675 -0.41 . . . . 56.5 111.48 -179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.3 ttp85 -66.36 -37.01 84.32 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.002 -0.679 . . . . 86.01 111.238 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.07 -54.71 37.53 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.979 0.419 . . . . 48.2 111.008 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.1 mt -62.19 -28.35 69.61 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.672 -0.411 . . . . 48.89 111.632 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 51.4 ttp -74.36 -48.6 27.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.718 -0.393 . . . . 56.73 110.935 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -65.55 -17.18 64.38 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.128 0.418 . . . . 53.97 112.128 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 tp10 -81.46 -45.72 15.59 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 117.941 0.337 . . . . 54.03 110.788 170.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 62.2 m -56.46 -46.26 80.47 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.814 0.34 . . . . 45.4 111.057 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.88 -32.35 71.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.417 -0.513 . . . . 49.67 111.689 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -65.55 -52.01 55.6 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.375 -0.53 . . . . 57.15 111.023 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -63.93 -28.6 69.94 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.56 -0.456 . . . . 78.05 111.621 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 56.3 tp -76.41 -42.97 42.4 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.992 -0.283 . . . . 66.64 111.504 178.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.1 ttpp -65.58 -37.77 87.6 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.735 -0.386 . . . . 64.79 111.354 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.92 -12.94 60.81 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.717 0.636 . . . . 59.17 112.717 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.433 ' HE2' HD13 ' A' ' 146' ' ' LEU . 64.3 t80 -93.77 -29.91 15.13 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.643 0.608 . . . . 90.78 112.643 -178.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.787 ' NZ ' ' OE2' ' A' ' 66' ' ' GLU . 34.9 tttm -69.01 -35.78 77.04 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.096 -0.642 . . . . 87.61 110.605 170.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.2 m -65.22 -40.46 94.13 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.452 -0.499 . . . . 80.77 111.152 172.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -59.68 -34.63 73.12 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.645 -0.422 . . . . 84.96 111.51 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.7 mt -74.06 -44.65 53.41 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.23 -0.588 . . . . 95.34 110.949 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.787 ' OE2' ' NZ ' ' A' ' 62' ' ' LYS . 26.1 mt-10 -53.23 -11.74 0.32 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 113.424 0.898 . . . . 113.41 113.424 178.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -89.4 -58.63 2.46 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.456 0.571 . . . . 110.56 111.151 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -75.79 -18.43 59.51 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.767 0.655 . . . . 111.89 112.767 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 101.87 0.42 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.788 -0.819 . . . . 119.17 108.788 170.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . 0.496 ' H ' ' HD3' ' A' ' 71' ' ' PRO . 7.8 p -112.41 -16.7 0.12 Allowed Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 116.348 1.981 . . . . 127.87 116.348 -173.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.496 ' HD3' ' H ' ' A' ' 70' ' ' THR . 45.6 Cg_exo -65.14 -39.1 24.86 Favored 'Trans proline' 0 N--CA 1.479 0.642 0 CA-C-N 121.646 1.624 . . . . 129.12 113.966 -177.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.468 ' HB ' ' OE2' ' A' ' 74' ' ' GLU . 33.0 m 47.24 61.99 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 126.608 1.963 . . . . 126.61 114.574 170.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.46 113.74 16.74 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.384 -1.339 . . . . 121.31 107.384 161.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.468 ' OE2' ' HB ' ' A' ' 72' ' ' VAL . 4.0 mt-10 -104.23 -14.38 15.85 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 115.312 1.597 . . . . 134.03 115.312 -160.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . . . -65.06 -30.83 71.82 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 119.396 0.998 . . . . 150.56 111.212 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.7 m -107.21 -1.42 21.85 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.643 0.609 . . . . 145.56 112.643 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.713 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 3.4 mtp-105 -90.52 -18.57 25.06 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 113.233 0.827 . . . . 131.93 113.233 178.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.34 -0.03 9.18 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.948 -0.701 . . . . 128.88 111.577 160.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.7 ttt85 -109.42 -35.77 6.17 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.164 1.386 . . . . 133.18 112.421 167.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' A' ' 77' ' ' ARG . 4.6 mt -61.09 -69.69 0.22 Allowed 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.577 0.751 . . . . 119.22 112.273 179.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 61.3 m -61.35 -31.7 71.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.604 -0.439 . . . . 110.54 111.697 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -65.48 -31.6 72.76 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.392 -0.523 . . . . 114.98 111.624 176.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -71.23 -30.03 65.85 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.718 -0.393 . . . . 116.27 111.52 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.8 tp -92.98 -32.75 14.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.438 0.533 . . . . 82.92 112.438 -176.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -63.32 -23.58 67.48 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 111.565 0.209 . . . . 95.25 111.565 169.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -88.6 -28.0 20.98 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 112.453 0.538 . . . . 82.27 112.453 170.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -79.57 -18.4 51.8 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.344 0.498 . . . . 72.72 112.344 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -82.06 -27.37 33.0 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.378 -0.529 . . . . 95.45 111.017 162.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.8 -29.11 69.94 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.535 -0.466 . . . . 58.81 111.242 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 95.4 mtm-85 -74.94 -34.93 62.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.138 -0.625 . . . . 65.38 111.886 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 6.7 tp -68.61 -47.49 66.55 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.78 -0.768 . . . . 59.9 110.88 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -60.03 -27.28 64.54 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 119.909 -1.139 . . . . 50.34 112.641 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.64 -48.4 60.06 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 117.207 0.504 . . . . 41.78 111.192 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -56.93 -43.26 81.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.457 -0.497 . . . . 55.06 111.155 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.2 mtm -70.89 -29.96 66.18 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.379 -0.528 . . . . 48.03 111.696 -177.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -68.43 -38.62 81.36 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.697 -0.801 . . . . 58.91 110.898 170.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.488 ' OD2' ' NH2' ' A' ' 134' ' ' ARG . 91.9 m-20 -65.75 -42.33 91.07 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.818 -0.353 . . . . 47.18 111.54 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.407 HG11 HD12 ' A' ' 24' ' ' LEU . 22.2 t -55.18 -42.59 66.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 CA-C-O 121.252 0.549 . . . . 46.74 110.305 175.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.579 ' NH2' ' O1 ' ' A' ' 202' ' ' SO4 . 8.7 ttt-85 -65.2 -42.84 93.16 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 122.104 -0.372 . . . . 78.51 111.232 178.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -67.42 -38.38 90.97 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.102 -1.047 . . . . 41.29 112.991 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.489 ' HD2' ' CD2' ' A' ' 127' ' ' HIS . 11.6 tpp180 -59.81 -27.72 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 122.236 -0.567 . . . . 60.68 111.59 179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.8 mt -91.12 -14.04 31.94 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.873 0.694 . . . . 51.24 112.873 176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.2 -39.64 43.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.367 -0.533 . . . . 47.58 110.153 167.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -64.17 -41.53 97.09 Favored 'General case' 0 C--O 1.237 0.411 0 O-C-N 122.124 -0.36 . . . . 56.98 111.343 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -58.68 -41.94 87.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.129 -0.628 . . . . 59.06 110.925 175.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -62.96 -53.74 49.32 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.639 -0.424 . . . . 72.82 111.067 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.71 -22.46 59.63 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.646 -0.788 . . . . 36.79 113.882 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -78.82 -42.46 27.58 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 117.773 0.786 . . . . 43.04 111.468 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.739 HG21 HD22 ' A' ' 39' ' ' LEU . 3.8 m -73.43 -22.94 19.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.097 -0.641 . . . . 43.98 111.532 177.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -66.08 -31.46 72.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.121 -0.632 . . . . 59.79 111.221 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -80.57 0.09 35.42 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.666 0.617 . . . . 57.93 112.666 173.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 36.9 mtp -113.75 18.29 17.54 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.002 0.521 . . . . 62.6 111.784 173.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.7 mt 58.81 48.46 11.26 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.594 0.711 . . . . 71.87 111.009 177.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 78.25 -10.85 26.21 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 115.403 0.921 . . . . 71.24 115.403 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -81.98 165.72 20.45 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 118.695 1.247 . . . . 100.8 110.246 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.7 t -153.71 116.67 4.51 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.689 -0.687 . . . . 77.58 109.339 -172.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.4 p -77.18 164.46 25.61 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.744 0.783 . . . . 65.96 110.743 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -76.93 -30.95 56.32 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.436 -0.802 . . . . 92.83 111.69 174.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -54.4 -34.64 61.71 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.54 -0.464 . . . . 51.13 111.195 172.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 54.7 tp -73.83 -43.76 57.75 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.724 -0.39 . . . . 49.79 111.369 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -69.53 -35.07 75.13 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.394 -0.522 . . . . 72.85 111.879 -177.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 74.4 t -66.33 -38.37 81.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 120.18 -0.608 . . . . 41.22 110.167 174.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 26.7 ttp85 -67.21 -41.66 85.4 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.958 -0.464 . . . . 53.76 111.345 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.43 -43.36 94.57 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.223 -0.591 . . . . 46.63 111.124 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.59 -35.09 73.62 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.591 -0.443 . . . . 36.95 111.145 177.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . 0.406 ' HA ' HD21 ' B' ' 78' ' ' LEU . 2.2 m -57.58 -49.43 76.43 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.021 0.439 . . . . 56.04 110.79 174.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HIS . . . . . 0.489 ' CD2' ' HD2' ' A' ' 101' ' ' ARG . 27.7 m-70 -70.85 -37.52 73.14 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.708 -0.397 . . . . 60.94 111.317 -175.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 132' ' ' GLN . 49.2 mt -61.85 -43.65 98.41 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.09 -0.644 . . . . 34.37 111.086 178.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.508 HD11 ' O ' ' B' ' 76' ' ' SER . 61.9 mt -62.92 -46.13 97.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 121.046 0.45 . . . . 44.52 110.493 178.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.59 -39.48 70.78 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.568 -0.453 . . . . 43.24 111.132 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.6 mt -75.47 -45.43 38.57 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.783 -0.367 . . . . 47.5 111.706 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 128' ' ' LEU . 17.1 mt-30 -50.91 -49.31 59.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.079 0.466 . . . . 59.31 110.966 174.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.527 HD13 ' HB2' ' B' ' 112' ' ' PHE . 82.9 mt -60.27 -54.37 46.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.784 0.326 . . . . 51.58 111.138 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.488 ' NH2' ' OD2' ' A' ' 97' ' ' ASP . 9.1 ttp180 -63.1 -32.13 73.43 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.306 -0.558 . . . . 56.95 111.623 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.04 -55.05 28.9 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.369 -0.532 . . . . 61.41 110.754 176.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 72.3 mt -58.88 -46.74 91.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 CA-C-O 121.148 0.499 . . . . 59.27 110.397 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -61.23 -41.06 99.38 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 120.18 -1.01 . . . . 66.24 112.877 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -64.64 -39.68 94.11 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.18 -0.608 . . . . 65.14 111.094 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.68 -22.21 64.39 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.156 0.428 . . . . 59.64 112.156 175.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -76.5 -48.74 18.5 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 117.892 0.314 . . . . 90.14 111.085 175.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -57.07 -18.01 12.69 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 111.922 0.342 . . . . 95.61 111.922 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 10.5 tp -87.21 -60.08 2.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 112.066 0.395 . . . . 94.36 112.066 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -54.16 -30.66 50.05 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.84 0.311 . . . . 103.5 111.84 -175.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . . . -71.19 -41.2 70.6 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.186 -0.606 . . . . 100.66 111.08 170.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . . . -74.52 -10.56 59.67 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.646 0.609 . . . . 93.02 112.646 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.433 HD13 ' HE2' ' A' ' 61' ' ' TYR . 47.6 mt -93.74 11.72 28.13 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 118.359 0.527 . . . . 98.3 112.003 168.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -118.9 -14.05 9.45 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.318 0.647 . . . . 108.2 112.675 169.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.78 -32.69 12.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 CA-C-N 118.436 0.562 . . . . 118.95 109.618 163.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.99 -50.78 70.7 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.761 0.315 . . . . 123.18 110.816 171.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -80.5 -43.06 21.4 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.523 -0.871 . . . . 132.08 112.042 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.264 0 O-C-N 121.579 -0.7 . . . . 133.68 110.774 -178.656 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.676 0.274 . . . . 96.46 111.045 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -59.18 -49.05 79.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.915 -0.584 . . . . 91.41 111.309 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -64.25 -30.83 71.87 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.206 0.447 . . . . 81.86 112.206 -166.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ARG . . . . . 0.742 ' NH1' ' O ' ' B' ' 12' ' ' ARG . 38.1 tpt85 -59.46 -44.99 92.86 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 83.99 110.943 175.38 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . . . -68.45 -41.21 80.57 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.477 -0.489 . . . . 83.57 111.523 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 60.9 mt -59.85 -40.96 84.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 CA-C-O 120.946 0.403 . . . . 66.85 110.691 -177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.709 ' O ' HG12 ' B' ' 19' ' ' ILE . 59.7 t -66.01 -42.99 92.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 120.028 -0.669 . . . . 58.17 110.398 177.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' MET . . . . . 0.618 ' HB2' HH12 ' B' ' 12' ' ' ARG . 15.4 ttp -51.83 -56.33 14.59 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 121.96 -0.462 . . . . 107.34 111.79 -176.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.434 ' HA ' ' HB2' ' B' ' 20' ' ' HIS . 2.8 mmmm -72.79 -31.89 65.18 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.124 -0.63 . . . . 65.02 111.85 -174.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -67.23 -37.38 83.49 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.332 -0.947 . . . . 60.13 110.997 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ILE . . . . . 0.709 HG12 ' O ' ' B' ' 15' ' ' VAL . 15.5 mm -72.04 -47.81 52.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 119.701 -0.799 . . . . 78.02 109.612 176.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' HIS . . . . . 0.434 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 1.4 m-70 -34.53 -54.24 0.53 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.557 1.143 . . . . 94.73 112.238 167.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -71.72 -38.59 70.47 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.296 -0.866 . . . . 88.04 111.617 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . 0.432 ' HA ' ' HD3' ' B' ' 22' ' ' LYS . 16.9 mmtt -65.18 -18.27 65.17 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.97 0.73 . . . . 78.32 112.97 -177.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . . . -70.22 -37.04 74.93 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.764 -0.774 . . . . 90.55 111.446 173.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 26.9 m -58.54 -43.34 89.21 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.803 -0.359 . . . . 79.16 111.427 -170.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.9 -13.49 61.76 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 113.421 0.897 . . . . 101.95 113.421 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . . . -109.7 27.94 9.06 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 118.871 0.76 . . . . 96.65 112.056 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 59.39 43.39 97.43 Favored Glycine 0 C--O 1.238 0.367 0 C-N-CA 120.825 -0.702 . . . . 95.34 113.013 -177.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -147.37 164.45 33.24 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.999 -1.111 . . . . 96.44 107.999 -171.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . . . -174.89 141.22 0.59 Allowed 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.301 -0.629 . . . . 98.01 109.301 166.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' TRP . . . . . 0.697 ' HH2' HG22 ' B' ' 19' ' ' ILE . 0.9 OUTLIER -146.03 174.71 11.05 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.525 0.679 . . . . 117.79 109.355 -178.582 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.9 t0 . . . . . 0 N--CA 1.466 0.347 0 C-N-CA 125.916 1.686 . . . . 92.2 114.362 178.431 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.56 0.219 . . . . 103.05 111.285 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.492 ' HA ' ' ND1' ' B' ' 53' ' ' HIS . 3.0 tt0 -87.91 1.37 54.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 112.419 0.525 . . . . 101.78 112.419 176.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 5.2 p -69.62 -25.09 27.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 118.055 0.389 . . . . 80.39 110.882 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 45.4 t -65.98 -49.53 76.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.04 0.448 . . . . 71.49 110.382 173.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' HIS . . . . . 0.492 ' ND1' ' HA ' ' B' ' 50' ' ' GLU . 7.1 m80 -63.14 -32.15 73.47 Favored 'General case' 0 C--O 1.237 0.419 0 O-C-N 122.079 -0.388 . . . . 79.51 111.59 -178.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -75.38 -48.88 20.9 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.639 -0.424 . . . . 77.65 111.055 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 96.7 m -59.56 -43.27 93.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.657 -0.417 . . . . 64.93 111.239 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.6 tp -63.3 -34.04 76.82 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.386 -0.526 . . . . 53.29 111.48 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -64.92 -42.29 94.83 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.381 -0.528 . . . . 58.29 111.135 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -71.89 -39.11 69.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.563 -0.455 . . . . 87.55 111.287 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.24 -46.58 82.86 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.679 -0.408 . . . . 57.97 110.793 177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.49 -21.16 62.15 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.78 -0.724 . . . . 64.61 113.746 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -82.14 -49.31 10.31 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 117.832 0.816 . . . . 76.09 111.288 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.04 -43.74 66.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.402 -0.519 . . . . 83.42 110.573 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -61.52 -46.0 91.82 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.754 0.311 . . . . 73.42 111.182 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 71.2 p -76.35 -25.76 55.01 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 112.77 0.656 . . . . 87.76 112.77 -170.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 mtm-85 -91.6 9.08 33.68 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.411 0.55 . . . . 86.9 112.165 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 -91.88 -36.56 13.41 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.639 0.776 . . . . 112.44 109.591 152.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' B' ' 71' ' ' PHE . 10.5 t80 -60.48 -85.4 0.01 OUTLIER 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.175 0.59 . . . . 108.41 110.277 171.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -62.25 1.3 0.34 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 113.478 0.918 . . . . 108.32 113.478 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . . . -66.04 -73.93 0.12 Allowed 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.928 -0.397 . . . . 97.89 109.928 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.26 51.43 0.75 Allowed 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.981 -0.377 . . . . 88.92 109.981 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PHE . . . . . 0.547 ' HB2' ' O ' ' B' ' 67' ' ' TYR . 10.2 m-85 -144.53 -156.36 0.69 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.253 -1.388 . . . . 101.05 107.253 170.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -145.37 170.05 17.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.605 -1.628 . . . . 101.63 106.605 162.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.57 ' C ' ' H ' ' B' ' 75' ' ' SER . . . -66.53 -126.24 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 N-CA-C 114.982 1.475 . . . . 102.02 114.982 -161.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . . . -73.69 41.28 0.12 Allowed 'General case' 0 C--O 1.236 0.362 0 N-CA-C 106.971 -1.492 . . . . 97.19 106.971 164.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . 0.57 ' H ' ' C ' ' B' ' 73' ' ' GLU . 1.9 t -95.44 -33.82 12.33 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 126.862 2.065 . . . . 99.22 113.334 -178.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . 0.508 ' O ' HD11 ' A' ' 129' ' ' ILE . 10.3 m -81.04 34.88 0.36 Allowed 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.013 -1.106 . . . . 101.5 108.013 172.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . . . -73.63 -174.29 1.7 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 122.553 1.168 . . . . 99.93 111.764 -157.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.456 HD11 HD12 ' A' ' 129' ' ' ILE . 1.9 mp -125.82 179.58 5.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.415 -1.266 . . . . 102.96 108.338 173.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -86.33 103.37 14.85 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 107.74 -1.207 . . . . 89.68 107.74 175.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -107.95 109.93 21.54 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.032 0.533 . . . . 77.91 109.805 -172.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 p -108.64 170.07 5.85 Favored Pre-proline 0 C--N 1.324 -0.532 0 C-N-CA 124.933 1.293 . . . . 54.41 109.258 169.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -63.33 -20.11 69.67 Favored 'Trans proline' 0 C--O 1.238 0.485 0 N-CA-C 113.578 0.568 . . . . 49.25 113.578 172.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -96.55 -24.62 15.97 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.429 0.9 . . . . 46.58 113.429 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 26.6 p -96.08 -9.17 31.49 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.092 0.775 . . . . 43.77 113.092 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.58 88.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.216 0.462 . . . . 43.93 111.489 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -67.94 -27.57 66.72 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.8 -0.76 . . . . 68.3 111.304 175.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.09 -44.65 17.87 Favored Glycine 0 C--N 1.335 0.527 0 C-N-CA 120.135 -1.031 . . . . 42.7 112.479 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.37 -36.56 79.38 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.268 -0.573 . . . . 77.12 111.018 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -58.56 -45.49 88.85 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.257 -0.577 . . . . 43.17 110.735 173.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ALA . . . . . 0.444 ' HB2' ' HG2' ' C' ' 112' ' ' MET . . . -69.24 -45.63 69.31 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.909 -0.316 . . . . 32.36 111.53 -176.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 20.2 m -56.01 -49.2 74.32 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.663 -0.415 . . . . 36.79 110.941 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 55.5 t -67.13 -44.16 88.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.738 -0.385 . . . . 37.85 110.898 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.59 -35.56 70.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.474 0 O-C-N 121.776 -0.578 . . . . 40.98 110.846 -174.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -59.48 -56.29 23.86 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.769 -0.582 . . . . 45.01 110.683 174.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -64.03 -24.93 67.9 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 111.832 0.308 . . . . 60.84 111.832 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.83 -41.09 92.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.685 -0.406 . . . . 55.57 111.107 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -107.49 19.18 20.59 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.549 0.574 . . . . 63.22 112.549 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ARG . . . . . . . . . . . . . 32.4 ttm180 -55.7 -35.22 65.82 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.988 0.366 . . . . 68.31 111.988 -172.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -133.34 60.74 1.7 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 121.747 0.784 . . . . 78.99 110.336 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLY . . . . . . . . . . . . . . . 111.44 170.98 19.03 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-O 122.554 1.085 . . . . 73.42 112.482 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.75 132.92 61.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-N 114.103 -1.048 . . . . 76.78 108.469 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -140.94 174.93 10.04 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.667 -0.864 . . . . 58.55 108.667 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' TRP . . . . . . . . . . . . . 54.3 m95 -68.64 -38.43 80.47 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.095 -0.642 . . . . 59.34 111.577 -177.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . -63.02 -28.75 72.59 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 120.143 -1.027 . . . . 51.72 113.115 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -79.65 -31.02 41.44 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 117.28 0.54 . . . . 64.19 112.156 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.09 -35.14 70.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 120.103 -0.639 . . . . 48.41 110.207 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' VAL . . . . . . . . . . . . . 86.4 t -60.18 -44.05 94.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 O-C-N 121.986 -0.446 . . . . 44.22 110.25 171.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ALA . . . . . 0.477 ' HB1' ' HB3' ' A' ' 133' ' ' LEU . . . -59.04 -43.17 91.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.584 -0.446 . . . . 37.31 110.962 173.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -58.38 -41.92 85.9 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 120.529 0.204 . . . . 50.42 111.248 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -69.01 -43.58 74.5 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.258 -0.577 . . . . 40.13 111.164 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -60.35 -44.29 95.69 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.409 -0.517 . . . . 47.28 111.169 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' PHE . . . . . 0.527 ' HB2' HD13 ' A' ' 133' ' ' LEU . 43.4 t80 -61.61 -45.96 91.86 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.456 -0.497 . . . . 43.13 111.215 178.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.37 76.13 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 119.986 -1.102 . . . . 52.05 112.357 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -69.75 -42.28 71.28 Favored Glycine 0 C--N 1.335 0.483 0 C-N-CA 120.039 -1.076 . . . . 54.74 112.479 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 74.8 t -57.85 -32.44 43.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 O-C-N 122.313 -0.522 . . . . 61.45 110.586 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' MET . . . . . . . . . . . . . 7.2 mmt -59.86 -51.58 69.09 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 121.975 -0.453 . . . . 72.31 111.125 173.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' CYS . . . . . . . . . . . . . 56.9 m -69.29 -38.28 78.23 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.994 0.368 . . . . 64.26 111.994 -169.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 4.9 m -77.83 -25.25 14.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 119.557 -0.857 . . . . 78.8 111.823 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -70.03 -24.33 63.25 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.312 0.505 . . . . 80.16 111.272 167.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 21.1 m -66.1 -57.53 7.48 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.93 -0.308 . . . . 67.51 111.219 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 1.3 m -68.11 -28.67 41.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 119.745 -0.782 . . . . 81.73 110.749 -176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . . . -74.07 -13.01 60.78 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 121.732 -0.605 . . . . 78.3 112.296 172.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . . . -123.38 22.28 9.31 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.08 0.552 . . . . 83.97 111.835 174.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 74.59 37.45 0.54 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.434 0.902 . . . . 88.82 113.434 164.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' MET . . . . . . . . . . . . . 27.8 mtm -136.85 151.3 48.96 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 108.183 -1.044 . . . . 85.49 108.183 171.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' SER . . . . . 0.619 ' H ' ' HD2' ' B' ' 127' ' ' PRO . 6.2 m -155.56 -36.03 0.0 OUTLIER Pre-proline 0 C--O 1.235 0.309 0 C-N-CA 117.551 -1.659 . . . . 92.77 114.786 177.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' PRO . . . . . 0.619 ' HD2' ' H ' ' B' ' 126' ' ' SER . 15.2 Cg_endo -58.16 -16.02 25.79 Favored 'Trans proline' 0 C--O 1.24 0.589 0 CA-C-N 121.486 1.566 . . . . 74.25 112.398 168.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.49 -35.32 62.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.642 0.258 . . . . 70.0 111.282 165.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' VAL . . . . . 0.604 HG11 ' CZ2' ' B' ' 30' ' ' TRP . 27.6 t -56.1 -44.35 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 120.986 0.422 . . . . 73.55 110.616 -176.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -61.59 -38.53 87.88 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.192 -0.603 . . . . 82.55 110.936 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -62.69 -50.76 69.88 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.487 -0.485 . . . . 78.0 110.75 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ILE . . . . . . . . . . . . . 37.2 mt -55.25 -40.56 56.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 CA-C-O 121.071 0.462 . . . . 46.01 110.258 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.6 97.28 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.084 -0.385 . . . . 55.52 111.245 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.586 ' O ' HD23 ' B' ' 134' ' ' LEU . 7.9 tt -84.11 8.54 15.22 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 119.929 -0.708 . . . . 76.81 111.721 169.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' TRP . . . . . 0.504 ' C ' ' OE2' ' B' ' 138' ' ' GLU . 54.0 m0 -100.57 0.16 38.86 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.1 -1.84 . . . . 69.54 112.546 167.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' MET . . . . . . . . . . . . . 60.3 mtp -110.3 -37.98 5.38 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.118 0.784 . . . . 61.34 113.118 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' THR . . . . . 0.428 HG22 ' ND2' ' B' ' 141' ' ' ASN . 61.2 m -57.61 -72.98 0.08 Allowed 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.207 1.003 . . . . 63.91 113.134 -178.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' GLU . . . . . 1.0 ' N ' ' OE1' ' B' ' 138' ' ' GLU . 1.3 pm0 -46.37 -37.53 7.67 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.104 0.962 . . . . 92.43 113.532 173.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -67.56 -33.84 75.85 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 118.865 -1.134 . . . . 51.23 110.45 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' LEU . . . . . 0.823 ' HA ' ' HB2' ' B' ' 144' ' ' LEU . 5.8 mt -67.78 -42.42 81.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 120.44 -0.504 . . . . 66.72 110.807 165.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ASN . . . . . 0.576 ' HB2' ' HA ' ' B' ' 138' ' ' GLU . 82.1 m-20 -66.06 -40.03 90.59 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.052 0.39 . . . . 65.22 112.052 -175.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 90.8 mtt180 -93.11 -57.42 2.63 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.939 -0.476 . . . . 81.28 112.027 -173.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -104.45 -10.13 17.91 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 113.879 1.066 . . . . 60.91 113.879 -168.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LEU . . . . . 0.823 ' HB2' ' HA ' ' B' ' 140' ' ' LEU . 31.8 mt -110.47 -28.5 8.5 Favored 'General case' 0 CA--C 1.52 -0.178 0 N-CA-C 113.675 0.991 . . . . 72.97 113.675 174.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' HIS . . . . . 0.576 ' N ' ' O ' ' B' ' 140' ' ' LEU . 23.6 t-160 -51.8 -33.98 38.0 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.122 0.419 . . . . 108.97 112.113 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' THR . . . . . . . . . . . . . 38.5 m -67.22 -42.99 83.15 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.644 -0.422 . . . . 84.52 111.515 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' TRP . . . . . . . . . . . . . 87.6 t90 -74.17 -23.86 59.3 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.391 0.515 . . . . 75.59 112.391 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 144' ' ' LEU . 23.4 mm -64.44 -53.17 46.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.007 0.432 . . . . 96.41 110.622 -175.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -69.35 -18.67 63.82 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.845 0.683 . . . . 111.43 112.845 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -45.47 56.02 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.127 -0.629 . . . . 93.56 111.346 -178.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -87.29 17.88 4.1 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 112.707 0.632 . . . . 92.21 112.707 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLY . . . . . . . . . . . . . . . 114.4 11.5 11.79 Favored Glycine 0 C--N 1.333 0.381 0 N-CA-C 116.138 1.215 . . . . 97.42 116.138 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . 71.63 -174.63 42.07 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.166 -1.016 . . . . 87.7 112.054 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' TRP . . . . . . . . . . . . . 5.3 m95 -67.97 -35.23 78.02 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.677 -0.761 . . . . 77.54 111.474 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -65.49 -12.48 53.11 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.636 0.606 . . . . 90.13 112.636 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . -75.54 -33.46 60.69 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.092 -0.643 . . . . 84.09 111.505 170.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -62.03 -44.52 96.53 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.453 -0.499 . . . . 75.87 110.932 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' VAL . . . . . . . . . . . . . 23.5 m -66.92 -32.12 56.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 119.582 -0.847 . . . . 85.41 110.761 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -70.91 -27.41 63.76 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 119.625 -0.83 . . . . 102.49 111.692 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.7 -20.26 19.69 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.528 0.936 . . . . 84.38 113.528 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -121.37 9.97 10.45 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.381 0.512 . . . . 90.41 112.381 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . -80.23 -82.28 0.75 Allowed Glycine 0 N--CA 1.445 -0.759 0 CA-C-N 118.403 0.547 . . . . 119.43 113.884 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.75 16.68 0.13 Allowed 'Trans proline' 0 C--O 1.236 0.398 0 N-CA-C 113.914 0.698 . . . . 121.43 113.914 -174.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 87.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-O 120.841 0.353 . . . . 122.58 110.536 176.708 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' GLY . . . . . 0.408 ' HA2' ' CZ ' ' C' ' 61' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.451 0 N-CA-C 113.387 0.115 . . . . 80.96 113.387 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLN . . . . . 0.424 ' HA ' ' OE2' ' C' ' 14' ' ' GLU . . . -86.82 -27.28 23.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.416 0.895 . . . . 89.29 113.416 -165.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ARG . . . . . 0.478 ' HD3' ' OE1' ' C' ' 57' ' ' GLU . 5.5 ttt180 -62.99 -42.1 99.76 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.972 -0.691 . . . . 110.93 111.93 -161.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' TRP . . . . . 0.802 ' CH2' HD12 ' C' ' 142' ' ' LEU . 18.2 p-90 -69.64 -34.29 73.81 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 117.977 -1.489 . . . . 72.31 110.961 173.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLU . . . . . 0.675 ' OE1' ' NE2' ' C' ' 143' ' ' GLN . 13.9 mt-10 -63.59 -36.54 84.15 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.502 -0.479 . . . . 73.24 111.085 177.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' C' ' 19' ' ' ARG . 11.0 mt -61.83 -39.52 92.1 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.078 -0.649 . . . . 71.45 110.684 174.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.96 94.75 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.574 -0.45 . . . . 53.23 111.203 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 37.1 tp -64.33 -40.55 96.12 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.402 -0.519 . . . . 52.35 111.09 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.55 -30.34 71.69 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.384 -0.912 . . . . 54.61 113.223 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' C' ' 15' ' ' LEU . 30.3 mtp-105 -73.63 -42.11 61.89 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.196 -0.601 . . . . 64.39 111.006 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' PHE . . . . . 0.42 ' HD1' ' HB2' ' C' ' 50' ' ' LEU . 68.6 t80 -57.01 -41.96 79.47 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.552 -0.459 . . . . 55.45 110.905 172.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.01 -42.37 99.81 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.637 -0.425 . . . . 49.25 111.154 174.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -64.36 -37.25 86.83 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.43 -0.508 . . . . 86.83 111.305 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -70.08 -43.95 70.1 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.748 -0.781 . . . . 57.47 110.849 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 49.9 tp -55.84 -27.14 50.1 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 121.025 -0.27 . . . . 67.57 111.327 173.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' SER . . . . . 0.441 ' HA ' ' CD1' ' D' ' 71' ' ' PHE . 35.1 t -62.03 -55.43 29.3 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.192 0.52 . . . . 76.71 111.132 178.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' TRP . . . . . . . . . . . . . 34.4 t90 -56.47 -31.55 64.13 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.244 -0.435 . . . . 75.56 111.742 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' VAL . . . . . . . . . . . . . 48.5 t -74.58 -40.81 48.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.597 -0.441 . . . . 65.04 110.764 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' SER . . . . . . . . . . . . . 41.9 m -65.58 -10.87 39.09 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 113.165 0.802 . . . . 67.19 113.165 -176.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 73.4 p -68.38 -26.18 65.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 119.961 -0.696 . . . . 77.97 111.102 169.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' LEU . . . . . . . . . . . . . 78.6 mt 52.05 36.58 19.14 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.548 0.689 . . . . 73.77 110.489 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -61.34 168.37 2.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.902 0.858 . . . . 84.88 109.968 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -63.2 -36.72 84.59 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.703 -0.799 . . . . 109.94 110.889 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.53 -36.23 75.73 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 111.939 0.348 . . . . 100.84 111.939 169.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 16.8 t -71.67 -49.57 45.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 120.853 0.358 . . . . 70.09 110.673 -173.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -59.18 -39.64 83.19 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.583 -0.447 . . . . 65.59 110.973 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -61.46 -38.27 86.6 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 120.603 0.24 . . . . 102.0 111.24 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.83 -37.14 56.23 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 122.171 -0.331 . . . . 87.27 111.878 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 71.9 mt -61.7 -15.34 39.53 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.383 0.512 . . . . 57.59 112.383 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.69 -2.32 25.74 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.764 0.653 . . . . 59.14 112.764 173.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' SER . . . . . . . . . . . . . 98.7 p -116.29 178.84 4.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.628 0.771 . . . . 62.38 109.684 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' SER . . . . . . . . . . . . . 9.6 m -91.76 -3.07 56.62 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.467 -0.788 . . . . 68.03 112.646 176.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -68.54 -41.22 80.14 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 118.171 0.441 . . . . 76.83 111.815 -171.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 46.0 t -69.48 -41.69 80.65 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 119.968 -0.693 . . . . 51.37 110.755 -174.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -74.46 -34.13 63.07 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 119.753 -0.779 . . . . 51.47 111.736 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -68.93 -41.0 78.69 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.033 -0.667 . . . . 84.68 111.035 175.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -60.44 -43.93 96.31 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.415 -0.514 . . . . 52.85 110.963 173.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' LEU . . . . . . . . . . . . . 17.6 mt -56.44 -32.14 64.62 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 111.839 0.311 . . . . 57.7 111.839 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -72.94 -37.54 67.1 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.507 -0.477 . . . . 71.68 111.251 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.17 87.74 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.555 -0.458 . . . . 48.88 111.35 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LEU . . . . . 0.42 ' HB2' ' HD1' ' C' ' 20' ' ' PHE . 11.0 mt -71.34 -30.8 66.63 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.372 -0.531 . . . . 45.37 111.251 177.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' MET . . . . . . . . . . . . . 61.7 ttp -67.51 -52.78 34.98 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.692 0.282 . . . . 54.17 110.964 175.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -62.88 -30.21 71.35 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.517 -0.473 . . . . 47.94 111.609 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' GLU . . . . . . . . . . . . . 33.4 tp10 -67.81 -47.52 68.85 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.49 -0.484 . . . . 50.72 110.905 174.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 32.5 m -58.27 -44.78 88.57 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 53.8 111.027 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' MET . . . . . . . . . . . . . 92.1 mmm -69.85 -36.61 75.67 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.519 -0.473 . . . . 49.22 111.278 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 43.8 tttm -61.81 -45.03 95.59 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.483 -0.487 . . . . 58.63 110.883 175.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLU . . . . . 0.478 ' OE1' ' HD3' ' C' ' 12' ' ' ARG . 73.1 mm-40 -66.62 -42.57 86.59 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.493 -0.483 . . . . 76.89 111.328 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' LEU . . . . . . . . . . . . . 29.4 tp -64.95 -36.28 83.87 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.596 -0.441 . . . . 55.59 111.311 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -67.51 -39.63 85.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.216 -0.594 . . . . 72.97 111.148 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.61 -19.81 62.81 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.182 0.438 . . . . 56.23 112.182 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' TYR . . . . . 0.408 ' CZ ' ' HA2' ' C' ' 10' ' ' GLY . 55.6 t80 -80.78 -43.76 19.62 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.467 -0.493 . . . . 83.53 111.305 176.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' LYS . . . . . 0.57 ' O ' ' HG2' ' C' ' 66' ' ' GLU . 25.7 tttp -56.07 -49.07 74.83 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.551 -0.459 . . . . 86.88 110.684 173.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' SER . . . . . . . . . . . . . 65.5 m -57.35 -40.44 78.06 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.875 -0.33 . . . . 82.89 111.347 175.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -60.7 -41.97 96.29 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.549 -0.46 . . . . 89.84 111.121 179.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.7 -23.07 63.38 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.371 -0.532 . . . . 88.83 112.166 177.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' C' ' 62' ' ' LYS . 4.5 mm-40 -67.24 9.45 0.22 Allowed 'General case' 0 C--O 1.24 0.558 0 CA-C-O 118.536 -0.745 . . . . 99.42 112.922 174.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -110.23 -57.75 2.16 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.181 0.9 . . . . 106.27 111.836 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' GLN . . . . . 0.434 ' O ' ' NE2' ' C' ' 68' ' ' GLN . 6.7 tp60 -82.59 7.23 15.18 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.023 0.529 . . . . 116.52 112.112 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' LEU . . . . . 0.525 HD21 ' O ' ' C' ' 149' ' ' TYR . 1.2 mt -65.1 160.12 21.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.911 0.863 . . . . 121.88 111.174 173.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' THR . . . . . 0.579 ' O ' ' N ' ' C' ' 72' ' ' VAL . 3.1 m -129.03 88.09 52.55 Favored Pre-proline 0 C--O 1.255 1.373 0 CA-C-N 114.804 -1.089 . . . . 132.78 112.003 -168.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -6.96 48.86 0.0 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.169 0 N-CA-C 121.066 3.449 . . . . 139.04 121.066 141.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' VAL . . . . . 0.579 ' N ' ' O ' ' C' ' 70' ' ' THR . 12.2 t -115.29 -38.45 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 119.292 -2.13 . . . . 136.61 111.964 166.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.19 32.99 0.61 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.014 0.825 . . . . 132.09 111.978 159.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' GLU . . . . . 0.541 ' HA ' ' HG2' ' C' ' 77' ' ' ARG . 8.7 tt0 -62.85 -25.3 68.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.15 -0.62 . . . . 141.86 111.976 -170.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' GLU . . . . . . . . . . . . . . . -64.86 -55.14 21.3 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.773 -0.771 . . . . 130.23 110.314 169.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' THR . . . . . . . . . . . . . 6.7 p -104.98 49.7 0.8 Allowed 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.423 0.527 . . . . 138.1 112.423 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' C' ' 74' ' ' GLU . 3.3 ptm180 -112.99 6.48 17.73 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 120.976 -1.078 . . . . 125.98 111.232 159.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.45 13.67 1.89 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.787 0.435 . . . . 123.88 111.159 148.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -121.07 -28.43 4.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.139 1.776 . . . . 129.07 112.09 171.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 26.1 mt -82.86 -42.97 17.15 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 122.479 0.311 . . . . 112.31 111.4 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -67.46 -32.98 74.21 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.654 -0.418 . . . . 105.71 111.798 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' LYS . . . . . 0.443 ' N ' ' HD3' ' C' ' 82' ' ' LYS . 1.1 mmtp -73.73 -36.86 65.23 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.176 -0.609 . . . . 109.59 110.882 -176.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -75.2 -21.28 58.8 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.092 0.404 . . . . 136.72 112.092 174.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' LEU . . . . . . . . . . . . . 48.1 tp -80.12 -29.95 39.03 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.609 -0.437 . . . . 91.89 111.527 171.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -62.61 -34.11 76.36 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.278 -0.569 . . . . 84.74 111.366 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.25 58.48 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.036 0.384 . . . . 66.34 112.036 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.25 -41.1 96.32 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.498 -0.481 . . . . 67.29 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.52 -35.93 58.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.273 -0.571 . . . . 80.1 111.175 173.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.1 -36.16 67.86 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.823 -0.351 . . . . 62.55 111.091 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' ARG . . . . . . . . . . . . . 93.3 mtm-85 -74.89 -43.88 51.92 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.301 -0.559 . . . . 75.21 111.212 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -52.92 -49.9 65.06 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 120.827 0.346 . . . . 65.55 110.984 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.2 -36.13 92.49 Favored Glycine 0 C--N 1.334 0.425 0 C-N-CA 120.057 -1.068 . . . . 47.75 112.692 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.28 -37.64 83.77 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 122.227 -0.572 . . . . 45.47 111.274 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.03 -48.22 82.62 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.517 -0.473 . . . . 55.93 110.866 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' MET . . . . . . . . . . . . . 28.3 mtp -73.33 -27.98 61.82 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.579 -0.448 . . . . 49.57 111.841 -177.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -67.89 -38.59 83.2 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 119.609 -0.836 . . . . 57.88 110.858 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ASP . . . . . . . . . . . . . 86.5 m-20 -69.48 -35.87 75.99 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.579 -0.449 . . . . 39.11 111.415 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 13.7 t -55.32 -41.89 63.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-O 121.285 0.565 . . . . 45.74 110.204 173.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' ARG . . . . . 0.42 ' NH2' ' O ' ' C' ' 201' ' ' HOH . 14.0 ttt-85 -70.48 -45.81 64.97 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 122.082 -0.386 . . . . 69.74 111.272 -178.509 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' GLY . . . . . . . . . . . . . . . -64.62 -37.83 94.9 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.092 -1.052 . . . . 49.74 112.848 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' ARG . . . . . 0.475 ' HD2' ' CD2' ' C' ' 127' ' ' HIS . 17.8 tpp180 -57.94 -31.86 67.25 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 122.324 -0.516 . . . . 59.21 111.571 178.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.97 -24.92 28.09 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 112.835 0.68 . . . . 45.15 112.835 176.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 30.8 t -66.28 -36.8 78.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 120.397 -0.521 . . . . 49.42 110.16 170.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -66.89 -42.7 85.08 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.937 -0.477 . . . . 52.02 111.441 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -56.33 -47.34 78.95 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.511 -0.476 . . . . 48.75 110.659 176.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -57.55 -41.12 80.38 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.602 -0.439 . . . . 70.32 111.01 175.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.69 -36.07 91.86 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.147 -1.025 . . . . 39.22 112.989 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.13 -46.84 54.97 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.119 -0.636 . . . . 54.96 111.15 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' VAL . . . . . . . . . . . . . 43.6 t -62.63 -31.83 53.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.564 -0.454 . . . . 54.48 110.769 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.68 -36.16 82.92 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.826 -0.547 . . . . 49.86 111.182 175.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' ALA . . . . . . . . . . . . . . . -73.19 -21.34 60.69 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.515 -0.474 . . . . 60.87 112.13 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' MET . . . . . 0.444 ' HG2' ' HB2' ' B' ' 90' ' ' ALA . 9.8 mtp -94.87 22.65 6.23 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.668 0.618 . . . . 65.14 112.668 176.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' B' ' 138' ' ' GLU . 7.0 mt 61.95 33.28 17.49 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.168 0.587 . . . . 67.89 111.112 174.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' GLY . . . . . . . . . . . . . . . 88.71 -13.68 61.99 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 115.136 0.814 . . . . 71.4 115.136 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -85.43 156.2 20.93 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.632 1.216 . . . . 92.73 110.555 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 19.1 t -132.94 125.02 28.9 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.23 -0.895 . . . . 72.11 109.021 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' THR . . . . . . . . . . . . . 69.2 p -78.48 167.63 21.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.991 0.9 . . . . 63.19 110.565 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -85.48 -27.99 25.3 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.293 -0.867 . . . . 92.11 111.376 170.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -53.82 -37.48 63.6 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.734 -0.386 . . . . 63.72 110.756 170.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' LEU . . . . . . . . . . . . . 41.9 tp -75.16 -46.11 36.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 121.027 -0.269 . . . . 42.04 111.344 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' ARG . . . . . . . . . . . . . 27.2 mtm-85 -67.08 -37.66 84.38 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.198 -0.601 . . . . 61.49 111.521 -176.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' VAL . . . . . . . . . . . . . 88.2 t -63.52 -38.29 81.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 C-N-CA 120.173 -0.611 . . . . 51.86 110.12 172.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ARG . . . . . . . . . . . . . 34.6 ttp85 -67.43 -40.84 85.5 Favored 'General case' 0 C--O 1.237 0.432 0 O-C-N 121.991 -0.443 . . . . 52.32 111.32 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.72 -44.48 85.94 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.559 -0.456 . . . . 49.1 111.31 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.45 -27.07 67.23 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.614 -0.434 . . . . 41.62 111.589 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' SER . . . . . . . . . . . . . 63.0 m -70.83 -35.8 72.63 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.33 -0.548 . . . . 45.85 111.095 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' HIS . . . . . 0.475 ' CD2' ' HD2' ' C' ' 101' ' ' ARG . 28.9 m-70 -78.2 -38.93 42.12 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.672 -0.411 . . . . 49.02 111.53 178.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 42.8 mt -62.03 -42.36 99.09 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.258 -0.577 . . . . 39.05 111.155 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' ILE . . . . . . . . . . . . . 18.4 mt -63.81 -40.04 87.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 120.516 -0.474 . . . . 55.75 110.43 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.04 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.95 -0.469 . . . . 41.96 111.015 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -71.27 -37.3 71.91 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.321 -0.551 . . . . 36.15 111.359 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' GLN . . . . . 0.464 ' NE2' ' OH ' ' D' ' 67' ' ' TYR . 21.5 mt-30 -53.0 -49.75 65.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.095 0.474 . . . . 73.24 110.937 173.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' D' ' 112' ' ' PHE . 90.3 mt -64.6 -45.87 85.09 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.805 0.336 . . . . 48.95 111.114 179.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.76 -35.14 79.4 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.085 -0.646 . . . . 53.46 111.203 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -61.62 2.46 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.358 -0.537 . . . . 58.96 110.361 174.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' ILE . . . . . 0.797 ' HA ' ' HB3' ' C' ' 139' ' ' ALA . 93.6 mt -61.89 -30.16 47.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 116.729 -0.214 . . . . 59.07 111.163 178.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' GLY . . . . . . . . . . . . . . . -63.54 -63.37 4.53 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 111.54 -0.624 . . . . 65.81 111.54 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' ASP . . . . . 0.718 ' O ' HD22 ' C' ' 142' ' ' LEU . 11.5 m-20 -67.01 2.79 1.31 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 118.245 -0.883 . . . . 78.4 112.084 167.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' ALA . . . . . 0.801 ' C ' HD21 ' C' ' 142' ' ' LEU . . . -95.3 23.19 6.05 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.123 0.569 . . . . 102.18 111.789 160.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' PHE . . . . . 0.546 ' N ' HD21 ' C' ' 142' ' ' LEU . 1.2 m-85 -122.33 -47.82 2.11 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.29 1.036 . . . . 94.11 113.384 161.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.01 -26.21 64.33 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.611 0.967 . . . . 100.67 113.611 -177.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' LEU . . . . . 1.016 ' H ' HD23 ' C' ' 142' ' ' LEU . 1.3 pt? -58.07 -67.39 0.35 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.728 1.611 . . . . 106.08 111.348 163.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' GLN . . . . . 0.805 ' N ' ' HG ' ' C' ' 142' ' ' LEU . 7.1 tt0 -70.5 -13.87 62.29 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.578 1.951 . . . . 97.15 112.009 -161.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . . . -82.03 -39.74 23.08 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 121.039 -0.264 . . . . 110.22 110.847 163.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 145' ' ' ARG . . . . . . . . . . . . . . . -76.6 -8.33 57.01 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.831 1.049 . . . . 96.31 113.831 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 146' ' ' LEU . . . . . 0.552 HD12 ' O ' ' C' ' 142' ' ' LEU . 5.2 mp -99.18 -41.14 7.63 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 119.807 1.185 . . . . 105.75 112.394 171.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.0 -2.12 4.96 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.568 -0.853 . . . . 106.87 112.379 167.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 t -98.37 -29.35 3.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.187 -1.412 . . . . 109.11 107.187 167.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 149' ' ' TYR . . . . . 0.525 ' O ' HD21 ' C' ' 69' ' ' LEU . 0.6 OUTLIER -73.86 -21.01 60.26 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 119.088 -0.482 . . . . 117.88 112.23 176.899 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 150' ' ' GLN . . . . . . . . . . . . . . . -93.72 -37.06 12.01 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.946 0.794 . . . . 116.5 112.129 177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 151' ' ' ALA . . . . . . . . . . . . . . . -83.56 17.54 2.18 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 112.746 0.647 . . . . 123.68 112.746 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 152' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-N 117.864 0.302 . . . . 112.8 112.879 179.841 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.734 0.302 . . . . 95.93 110.713 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -58.98 -37.16 76.18 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 116.056 -0.52 . . . . 84.81 111.247 176.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -73.51 -40.52 63.98 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.507 -0.477 . . . . 75.8 112.047 -167.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ARG . . . . . . . . . . . . . . . -61.12 -39.94 91.92 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.906 -0.718 . . . . 66.45 110.789 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -56.31 -47.43 78.74 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.986 0.422 . . . . 96.06 111.558 176.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.06 -26.78 27.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 O-C-N 122.226 -0.296 . . . . 66.45 111.675 -173.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' VAL . . . . . 0.442 ' O ' HG12 ' D' ' 19' ' ' ILE . 25.7 t -71.52 -53.45 20.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 O-C-N 121.649 -0.657 . . . . 76.27 110.958 -171.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' MET . . . . . . . . . . . . . 4.0 tpp -68.35 -40.66 81.46 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.383 -0.527 . . . . 89.82 111.826 -170.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -55.3 -40.81 71.55 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.428 -0.509 . . . . 79.07 110.892 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' TYR . . . . . 0.461 ' OH ' ' OE2' ' D' ' 111' ' ' GLU . 26.6 t80 -69.95 -31.97 69.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.539 -0.464 . . . . 64.15 111.507 175.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ILE . . . . . 0.442 HG12 ' O ' ' D' ' 15' ' ' VAL . 28.2 mm -69.29 -45.14 79.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 C-N-CA 120.658 -0.417 . . . . 81.48 110.543 -178.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -53.4 -58.12 8.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.498 0.666 . . . . 82.5 111.054 175.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' TYR . . . . . 0.409 ' OH ' ' OD2' ' D' ' 61' ' ' ASP . 23.8 t80 -59.79 -38.56 82.24 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.571 -0.741 . . . . 84.05 111.577 -168.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmtt -66.26 -24.67 66.62 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.328 -0.549 . . . . 72.17 112.319 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' LEU . . . . . 0.609 HD23 HG12 ' D' ' 118' ' ' VAL . 21.3 mt -79.88 -26.08 40.4 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 118.032 0.378 . . . . 83.33 111.928 175.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' SER . . . . . . . . . . . . . 70.3 m -65.05 -39.65 93.6 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.441 -0.503 . . . . 77.45 111.198 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' GLN . . . . . . . . . . . . . . . -64.15 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 112.018 0.377 . . . . 88.83 112.018 -174.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ARG . . . . . . . . . . . . . . . -89.52 -0.61 57.62 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.43 0.53 . . . . 93.82 112.43 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.0 83.39 0.89 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-O 119.925 -0.375 . . . . 93.38 113.171 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -160.48 -148.53 0.17 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 119.465 -0.894 . . . . 101.51 109.293 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' GLU . . . . . 0.568 ' HG2' ' N ' ' D' ' 30' ' ' TRP . 55.2 tt0 -142.89 164.38 30.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.99 1.316 . . . . 95.82 108.533 -168.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' TRP . . . . . 0.568 ' N ' ' HG2' ' D' ' 29' ' ' GLU . . . -148.04 160.75 42.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 121.826 0.822 . . . . 106.19 110.767 165.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 114.313 -1.312 . . . . 119.57 111.092 176.322 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.768 0.318 . . . . 108.13 111.731 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' GLU . . . . . 0.428 ' HA ' ' CD2' ' D' ' 53' ' ' HIS . . . -82.31 18.16 1.5 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 112.32 0.489 . . . . 92.86 112.32 172.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.76 -35.83 21.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 O-C-N 123.331 0.394 . . . . 82.88 111.032 177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' VAL . . . . . 0.444 HG12 HG11 ' D' ' 158' ' ' VAL . 3.0 m -73.24 -30.38 30.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 O-C-N 121.936 -0.477 . . . . 76.83 110.355 178.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' D' ' 50' ' ' GLU . 6.0 m-70 -65.14 -41.84 94.38 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.938 -0.477 . . . . 81.63 110.858 176.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' D' ' 58' ' ' GLN . 0.6 OUTLIER -72.53 -45.42 59.41 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.756 -0.378 . . . . 74.27 111.179 -179.516 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' THR . . . . . . . . . . . . . 31.6 m -59.17 -41.72 89.08 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.523 -0.471 . . . . 65.75 111.139 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' LEU . . . . . . . . . . . . . 48.4 tp -66.91 -28.21 68.12 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.323 -0.551 . . . . 56.5 111.364 175.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' ARG . . . . . . . . . . . . . . . -68.14 -40.37 82.46 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.22 -0.592 . . . . 56.48 111.12 176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' D' ' 54' ' ' LEU . 7.6 mt-30 -70.78 -47.19 60.89 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.346 -0.541 . . . . 71.24 110.994 177.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.58 -38.35 63.82 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.816 -0.354 . . . . 57.12 111.08 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.26 -47.92 55.56 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.002 -1.094 . . . . 58.19 112.355 175.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' ASP . . . . . 0.409 ' OD2' ' OH ' ' D' ' 21' ' ' TYR . 75.1 m-20 -60.18 -44.54 94.98 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.288 -0.537 . . . . 78.87 111.204 178.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' ASP . . . . . 0.425 ' HB3' ' HZ ' ' C' ' 140' ' ' PHE . 2.0 m-20 -52.88 -60.32 3.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.242 0.544 . . . . 91.35 110.655 170.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' PHE . . . . . 0.448 ' CD1' ' HG3' ' D' ' 111' ' ' GLU . 26.2 t80 -48.71 -41.95 33.51 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.99 -0.55 . . . . 75.81 111.47 175.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' SER . . . . . . . . . . . . . 7.9 t -71.53 -23.47 61.78 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 112.588 0.588 . . . . 78.44 112.588 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ARG . . . . . . . . . . . . . 79.3 mtm-85 -83.66 -13.72 53.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.996 0.739 . . . . 86.83 112.996 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -88.74 -33.5 17.47 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 118.504 0.593 . . . . 106.7 111.737 167.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' TYR . . . . . 0.464 ' OH ' ' NE2' ' C' ' 132' ' ' GLN . 17.9 t80 -66.4 -64.3 0.89 Allowed 'General case' 0 C--O 1.236 0.35 0 N-CA-C 110.048 -0.353 . . . . 95.04 110.048 175.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' ARG . . . . . 0.589 ' HG3' ' HA ' ' D' ' 72' ' ' ALA . 5.4 mpt_? -67.65 1.23 2.56 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.237 0.458 . . . . 107.1 112.237 -178.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . . . -73.2 -44.8 59.13 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.461 -0.496 . . . . 95.16 110.94 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -105.52 -34.07 7.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 114.273 1.212 . . . . 111.63 114.273 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' PHE . . . . . 0.441 ' CD1' ' HA ' ' C' ' 25' ' ' SER . 11.6 m-85 -103.3 -54.31 2.63 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.601 0.637 . . . . 90.19 110.47 -176.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' ALA . . . . . 0.589 ' HA ' ' HG3' ' D' ' 68' ' ' ARG . . . 63.42 38.62 9.87 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.979 0.912 . . . . 96.79 112.514 175.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' GLU . . . . . . . . . . . . . . . -144.59 -83.18 0.15 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 114.383 1.253 . . . . 91.73 114.383 -174.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' D' ' 74' ' ' MET . 34.4 ttm 43.84 32.59 0.62 Allowed 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.456 1.102 . . . . 97.12 110.351 -153.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' SER . . . . . . . . . . . . . 4.5 p -78.62 2.35 19.66 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.161 -1.016 . . . . 98.61 111.023 157.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.42 3.32 28.56 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.347 1.059 . . . . 94.15 112.942 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' GLN . . . . . . . . . . . . . . . -66.73 84.26 0.11 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.86 -1.163 . . . . 92.89 107.86 167.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 16.7 mt -75.35 136.55 40.81 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.078 0.466 . . . . 91.49 111.552 -165.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' HIS . . . . . . . . . . . . . . . 51.24 51.56 16.67 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.39 -0.823 . . . . 82.13 111.331 177.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 20.0 tp -78.29 95.38 5.0 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.055 -1.091 . . . . 71.43 108.055 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 19.0 p -101.5 167.67 10.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 C-N-CA 124.512 1.125 . . . . 51.51 109.92 177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -61.95 -19.04 64.53 Favored 'Trans proline' 0 C--O 1.237 0.452 0 N-CA-C 113.755 0.636 . . . . 49.85 113.755 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -98.28 -33.89 10.91 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 113.361 0.874 . . . . 52.91 113.361 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 71.6 p -89.41 -5.42 57.44 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.0 0.741 . . . . 43.8 113.0 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.36 -43.74 96.79 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.243 0.474 . . . . 41.55 111.352 -177.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -67.4 -28.16 67.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.252 -0.579 . . . . 63.67 111.271 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.2 -44.38 53.42 Favored Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.137 -1.03 . . . . 47.86 112.617 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.54 -47.73 77.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 122.214 -0.58 . . . . 74.14 110.869 176.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -51.23 -43.31 61.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.621 0.248 . . . . 38.78 111.429 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.71 70.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.7 -0.4 . . . . 35.7 111.447 -178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' THR . . . . . . . . . . . . . 34.2 m -59.69 -38.7 82.26 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.469 -0.493 . . . . 39.63 111.229 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 50.4 t -78.0 -46.82 25.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 O-C-N 122.152 -0.342 . . . . 40.67 110.971 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' VAL . . . . . . . . . . . . . 49.9 t -63.95 -37.93 81.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 O-C-N 121.882 -0.511 . . . . 38.82 110.636 -177.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -60.75 -53.58 55.72 Favored 'General case' 0 C--O 1.237 0.423 0 O-C-N 121.896 -0.502 . . . . 49.06 111.103 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -67.76 -26.47 66.14 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.887 -0.325 . . . . 66.7 111.874 -175.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 5.4 tt -64.13 -37.87 89.03 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.515 -0.474 . . . . 44.01 111.082 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.48 12.17 29.9 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 113.008 0.744 . . . . 54.07 113.008 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -55.18 -56.84 15.41 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.294 0.497 . . . . 54.7 111.711 -172.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -102.78 44.56 1.01 Allowed 'General case' 0 C--O 1.235 0.294 0 N-CA-C 112.507 0.558 . . . . 73.96 112.507 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' GLY . . . . . . . . . . . . . . . 123.76 168.79 13.04 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-O 122.512 1.062 . . . . 72.15 112.437 174.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' VAL . . . . . . . . . . . . . 44.8 t -133.42 142.98 40.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 113.956 -1.122 . . . . 69.15 108.614 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 25.9 p30 -153.07 -170.64 3.68 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.119 -1.067 . . . . 55.87 108.119 173.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' TRP . . . . . 0.403 ' HH2' HG23 ' D' ' 148' ' ' ILE . 44.0 m95 -77.87 -41.28 37.35 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.934 -0.706 . . . . 58.56 111.901 -178.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' GLY . . . . . . . . . . . . . . . -62.35 -25.92 67.33 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.188 -1.006 . . . . 47.73 113.144 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -82.94 -31.39 27.7 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 122.311 -0.523 . . . . 67.91 111.896 177.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' ILE . . . . . . . . . . . . . 96.8 mt -65.93 -36.2 76.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.338 -0.545 . . . . 45.23 110.162 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.56 -45.68 98.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.174 0.511 . . . . 42.63 110.195 173.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.39 -37.3 74.99 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.576 -0.45 . . . . 36.68 110.986 174.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' PHE . . . . . 0.42 ' HZ ' ' HA ' ' D' ' 136' ' ' MET . 64.6 t80 -62.04 -40.56 96.15 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 121.142 -0.223 . . . . 45.77 111.264 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -72.81 -35.87 67.43 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.121 -0.632 . . . . 39.68 111.153 176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' GLU . . . . . 0.461 ' OE2' ' OH ' ' D' ' 18' ' ' TYR . 31.9 mm-40 -65.31 -43.46 91.0 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.263 -0.575 . . . . 50.29 111.205 176.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' PHE . . . . . 0.451 ' HB2' HD13 ' C' ' 133' ' ' LEU . 51.3 t80 -62.85 -46.55 87.35 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.3 -0.56 . . . . 41.09 111.146 177.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' GLY . . . . . 0.446 ' HA3' ' SD ' ' D' ' 136' ' ' MET . . . -60.36 -39.44 96.17 Favored Glycine 0 C--N 1.334 0.447 0 C-N-CA 119.85 -1.167 . . . . 54.39 112.385 178.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.73 -41.35 99.59 Favored Glycine 0 C--N 1.334 0.443 0 C-N-CA 120.249 -0.976 . . . . 52.72 112.975 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' D' ' 118' ' ' VAL . 38.6 t -68.4 -40.59 82.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 C-N-CA 119.919 -0.712 . . . . 67.81 110.607 -179.341 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' MET . . . . . . . . . . . . . 10.1 mmm -52.4 -26.87 13.7 Favored 'General case' 0 C--O 1.236 0.389 0 O-C-N 121.975 -0.453 . . . . 63.82 111.27 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' CYS . . . . . . . . . . . . . 97.8 m -84.41 -22.31 30.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.024 0.75 . . . . 74.59 113.024 176.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' VAL . . . . . 0.609 HG12 HD23 ' D' ' 23' ' ' LEU . 3.2 m -97.9 -38.35 7.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 118.828 0.74 . . . . 89.79 111.674 178.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 30.6 tp10 -62.1 -26.95 68.58 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.518 -0.473 . . . . 82.0 110.825 174.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' SER . . . . . . . . . . . . . 34.6 m -63.56 -50.61 68.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.801 0.334 . . . . 82.15 110.993 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' VAL . . . . . . . . . . . . . 21.2 t -58.02 -44.8 87.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 CA-C-O 121.031 0.443 . . . . 82.76 110.835 -177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -71.71 -11.45 60.83 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.849 0.685 . . . . 92.19 112.849 -178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' ARG . . . . . . . . . . . . . . . -122.19 25.91 8.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 118.434 0.561 . . . . 79.55 111.769 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 70.73 31.86 2.65 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.099 0.96 . . . . 103.26 112.893 167.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' MET . . . . . . . . . . . . . 5.0 mtm -125.94 136.59 53.2 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.299 -1.0 . . . . 76.89 108.299 173.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' SER . . . . . 0.588 ' H ' ' HD2' ' D' ' 127' ' ' PRO . 44.8 m -135.21 -46.02 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 116.842 -1.943 . . . . 87.67 113.737 -178.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' PRO . . . . . 0.588 ' HD2' ' H ' ' D' ' 126' ' ' SER . 12.0 Cg_endo -62.91 -20.87 72.52 Favored 'Trans proline' 0 C--O 1.238 0.498 0 CA-C-N 120.997 1.392 . . . . 79.19 113.024 179.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' LEU . . . . . 0.543 ' HA ' HD22 ' D' ' 131' ' ' ASN . 3.3 mt -39.66 -42.48 1.22 Allowed 'General case' 0 C--O 1.235 0.337 0 C-N-CA 124.201 1.0 . . . . 72.73 111.232 167.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 32.0 t -51.73 -38.08 21.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 115.903 -0.589 . . . . 69.01 111.001 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -43.01 75.34 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.014 -0.674 . . . . 79.04 111.55 -178.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' ASN . . . . . 0.543 HD22 ' HA ' ' D' ' 128' ' ' LEU . 4.3 m-80 -65.51 -44.75 86.03 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.055 -0.658 . . . . 86.21 111.04 177.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' ILE . . . . . . . . . . . . . 68.3 mt -53.51 -41.71 46.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 121.16 0.505 . . . . 46.85 110.271 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' ALA . . . . . . . . . . . . . . . -60.0 -39.28 85.23 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.69 -0.404 . . . . 51.5 111.174 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 tt -72.5 -45.44 59.39 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.079 -0.648 . . . . 63.5 110.763 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -54.1 -50.7 66.23 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.838 0.351 . . . . 48.97 110.837 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' MET . . . . . 0.446 ' SD ' ' HA3' ' D' ' 113' ' ' GLY . 61.3 mtp -62.44 -50.99 69.26 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.802 -0.359 . . . . 52.68 111.333 178.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' THR . . . . . . . . . . . . . 62.2 m -55.15 -52.97 61.58 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.17 0.509 . . . . 54.32 110.794 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' D' ' 142' ' ' ARG . 5.4 tp10 -67.88 -33.2 74.28 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 120.387 -0.525 . . . . 88.06 111.404 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -67.47 -37.81 83.46 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 119.49 -0.884 . . . . 52.14 111.142 173.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' LEU . . . . . . . . . . . . . 11.3 mt -62.42 -42.29 99.33 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.673 -0.411 . . . . 64.76 111.344 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -75.08 -27.86 60.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.705 0.631 . . . . 71.3 112.705 -171.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' D' ' 138' ' ' GLU . 49.5 mtt180 -96.48 -60.71 1.55 Allowed 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.45 -0.9 . . . . 81.11 112.61 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -99.9 -13.49 19.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.538 0.94 . . . . 68.96 113.538 -166.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' LEU . . . . . . . . . . . . . 35.8 mt -105.87 -19.53 13.71 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 113.061 0.763 . . . . 72.12 113.061 172.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -55.83 -45.86 78.28 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.871 0.367 . . . . 108.28 111.669 -175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' THR . . . . . . . . . . . . . 17.3 m -65.5 -38.09 88.7 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.436 -0.506 . . . . 84.63 111.643 -173.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 147' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -66.78 -36.57 82.7 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.331 -0.948 . . . . 77.41 111.528 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 148' ' ' ILE . . . . . 0.403 HG23 ' HH2' ' D' ' 103' ' ' TRP . 21.2 mt -69.72 -48.51 64.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 C-N-CA 120.375 -0.53 . . . . 96.52 110.609 -173.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 149' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 -58.38 -15.25 9.87 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.711 0.634 . . . . 118.94 112.711 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 150' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -101.16 -26.33 13.7 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.615 0.968 . . . . 94.94 113.615 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 151' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -88.44 16.51 6.36 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.707 0.685 . . . . 85.08 112.085 169.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 152' ' ' GLY . . . . . . . . . . . . . . . 108.62 13.4 18.77 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 115.984 1.154 . . . . 103.47 115.984 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 153' ' ' GLY . . . . . . . . . . . . . . . 67.08 -168.46 37.34 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 118.807 1.303 . . . . 80.45 111.788 -177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 154' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -71.06 -34.57 71.33 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.482 -0.859 . . . . 82.73 111.949 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 155' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -72.69 -7.89 52.66 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.713 0.635 . . . . 92.63 112.713 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 156' ' ' ALA . . . . . . . . . . . . . . . -82.26 -26.0 33.56 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.09 -0.644 . . . . 76.69 111.313 167.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 157' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -63.22 -41.87 99.19 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.287 -0.565 . . . . 66.58 110.957 173.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 158' ' ' VAL . . . . . 0.444 HG11 HG12 ' D' ' 52' ' ' VAL . 33.4 m -71.87 -32.2 43.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 C-N-CA 119.552 -0.859 . . . . 78.04 111.063 -179.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 159' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.67 -19.84 62.75 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 118.326 -1.35 . . . . 100.73 112.178 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 160' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -98.43 -29.91 12.85 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 113.415 0.894 . . . . 85.97 113.415 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 161' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -114.93 11.57 16.61 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 112.9 0.704 . . . . 91.37 112.9 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 162' ' ' GLY . . . . . . . . . . . . . . . -97.66 -69.89 0.99 Allowed Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 115.019 0.767 . . . . 104.17 115.019 -170.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 163' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -65.27 5.88 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 CA-C-N 117.523 0.662 . . . . 122.94 113.041 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 164' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 C--N 1.33 -0.281 0 C-N-CA 122.716 0.406 . . . . 127.43 109.972 171.512 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . 0.579 ' O1 ' ' NH2' ' A' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . 0.42 ' O ' ' NH2' ' C' ' 99' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_