data_6hnl_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 6hnl _Structure_validation_residue.Date_analyzed 2019-11-01 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 ' 7' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.176 0 N-CA-C 112.89 0.7 . . . . 79.530000000000001 112.89 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.3 -40.05 71.98 Favored 'Trans proline' 0 C--N 1.357 1.0 0 N-CA-C 114.069 0.757 . . . . 70.609999999999999 114.069 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.6 m -52.56 -41.82 63.91 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.763 1.023 . . . . 73.530000000000001 113.763 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -67.51 -42.52 82.67 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.503 0.502 . . . . 85.510000000000005 112.093 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 84.8 m -53.81 -45.17 70.71 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.481 0.549 . . . . 62.649999999999999 112.481 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mm -75.38 -40.07 42.08 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 CA-C-N 115.924 -0.58 . . . . 58.299999999999997 110.537 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.43 91.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.647 -0.421 . . . . 62.200000000000003 110.939 172.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.18 -34.27 87.42 Favored Glycine 0 N--CA 1.474 1.191 0 N-CA-C 115.33 0.892 . . . . 59.270000000000003 115.33 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.32 -49.48 75.46 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.581 0.586 . . . . 63.170000000000002 112.581 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -69.37 -36.23 76.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 118.943 -0.551 . . . . 71.450000000000003 112.351 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -54.83 -49.81 70.14 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 110.019 -0.363 . . . . 71.349999999999994 110.019 168.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.39 90.13 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.652 0.982 . . . . 55.810000000000002 113.652 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -62.15 -45.44 93.43 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.754 0.279 . . . . 52.460000000000001 111.754 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -59.64 -43.14 93.98 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 112.821 0.674 . . . . 55.5 112.821 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 97.0 p -80.59 -10.02 59.75 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.048 1.499 . . . . 64.579999999999998 115.048 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.31 32.22 60.34 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 118.103 0.41 . . . . 62.509999999999998 112.441 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -94.18 85.95 4.81 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.08 0.552 . . . . 62.700000000000003 110.075 -170.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 mt -59.66 -37.26 78.24 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.392 1.256 . . . . 73.060000000000002 114.392 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . . . -63.08 -46.64 86.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.231 0.332 . . . . 59.840000000000003 111.467 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.2 m -67.3 -39.4 85.93 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.397 -0.365 . . . . 58.670000000000002 111.42 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 mt -56.4 -46.43 80.15 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.584 0.23 . . . . 51.75 111.259 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -70.63 -22.04 62.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 115.065 1.505 . . . . 60.25 115.065 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -74.55 -42.31 59.03 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.142 0.423 . . . . 72.200000000000003 112.142 168.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 91.9 mt -82.25 -18.13 43.56 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.944 1.461 . . . . 55.039999999999999 114.944 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.0 mt -116.26 124.45 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 109.093 -0.706 . . . . 45.030000000000001 109.093 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.7 98.03 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 109.439 -0.578 . . . . 47.390000000000001 109.439 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -55.61 -32.65 84.1 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 121.418 1.412 . . . . 44.909999999999997 114.612 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -101.21 18.57 19.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.325 0.65 . . . . 57.060000000000002 112.124 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.63 146.84 34.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.457 -0.572 . . . . 39.990000000000002 109.457 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.8 t -96.9 107.54 20.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 108.245 -1.02 . . . . 40.68 108.245 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.0 mm -107.64 112.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.011 -0.366 . . . . 36.640000000000001 110.011 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -95.73 100.07 11.83 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.934 -0.765 . . . . 46.859999999999999 108.934 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.9 mt -94.04 156.97 38.58 Favored Pre-proline 0 N--CA 1.435 -1.204 0 N-CA-C 108.264 -1.013 . . . . 50.909999999999997 108.264 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.63 163.83 36.4 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 O-C-N 122.856 0.924 . . . . 46.289999999999999 112.505 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -55.25 -28.58 50.36 Favored Glycine 0 N--CA 1.467 0.735 0 N-CA-C 115.304 0.882 . . . . 55.890000000000001 115.304 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -57.8 -32.04 67.17 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 117.715 0.757 . . . . 74.260000000000005 113.021 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.48 -1.37 50.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.611 0.967 . . . . 65.120000000000005 113.611 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.85 164.77 38.74 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-O 123.301 1.5 . . . . 72.019999999999996 111.613 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.8 169.56 24.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.018 -1.091 . . . . 82.439999999999998 108.76 -162.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.97 -41.68 88.1 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.946 0.721 . . . . 66.780000000000001 112.946 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -85.2 -26.68 26.6 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.552 1.316 . . . . 81.959999999999994 114.552 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -122.55 91.79 49.28 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.381 0.672 . . . . 61.380000000000003 110.399 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -64.06 153.2 77.48 Favored 'Trans proline' 0 C--N 1.349 0.605 0 O-C-N 123.312 1.164 . . . . 69.469999999999999 113.208 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.76 139.97 48.0 Favored 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 122.307 2.005 . . . . 74.650000000000006 113.775 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.75 -0.6 76.73 Favored Glycine 0 N--CA 1.468 0.78 0 N-CA-C 116.72 1.448 . . . . 60.869999999999997 116.72 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.8 m -83.59 124.22 75.62 Favored Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 119.0 1.4 . . . . 59.520000000000003 109.264 170.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -65.21 150.34 87.66 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 120.484 0.79 . . . . 44.979999999999997 112.861 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -109.48 167.23 10.28 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.47 -0.937 . . . . 51.93 108.47 174.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -93.28 -177.89 4.59 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 109.15 -0.685 . . . . 43.079999999999998 109.15 165.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -54.71 -52.52 62.19 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.914 1.079 . . . . 47.149999999999999 113.914 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -66.97 -28.22 68.09 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.623 0.601 . . . . 50.539999999999999 112.623 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.39 -44.69 94.99 Favored Glycine 0 N--CA 1.467 0.713 0 N-CA-C 110.831 -0.908 . . . . 43.340000000000003 110.831 170.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -62.87 -49.69 73.85 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.906 0.335 . . . . 43.469999999999999 111.906 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.35 -34.47 75.35 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.007 -0.521 . . . . 47.950000000000003 112.394 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.39 95.96 Favored Glycine 0 N--CA 1.48 1.577 0 N-CA-C 115.529 0.972 . . . . 46.619999999999997 115.529 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.1 t -68.3 -41.69 83.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 121.498 0.666 . . . . 48.18 110.647 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.86 -41.06 99.22 Favored 'General case' 0 C--O 1.202 -1.432 0 CA-C-N 115.877 -0.601 . . . . 66.0 112.037 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.32 -37.99 85.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 119.714 1.143 . . . . 71.030000000000001 112.884 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -61.85 -49.6 75.62 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.35 0.523 . . . . 55.710000000000001 110.889 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.1 m -58.92 -36.03 74.06 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 113.365 0.876 . . . . 55.119999999999997 113.365 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . . . -66.47 -45.33 80.06 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.633 1.206 . . . . 55.399999999999999 111.062 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.79 -32.82 74.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.344 -0.844 . . . . 54.149999999999999 110.819 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -77.28 -35.88 54.78 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.479 1.288 . . . . 62.560000000000002 114.479 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -126.02 76.67 71.57 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.416 -0.957 . . . . 62.859999999999999 108.416 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -64.48 -22.27 65.55 Favored 'Trans proline' 0 C--O 1.247 0.929 0 N-CA-C 116.47 1.681 . . . . 60.350000000000001 116.47 -171.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -100.25 7.52 44.39 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.481 1.66 . . . . 77.739999999999995 115.481 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MSE . . . . . . . . . . . . . 60.2 ttp -71.38 135.05 47.1 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 108.56 -0.904 . . . . 79.159999999999997 108.56 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.3 p -127.28 153.19 46.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.071 -0.968 . . . . 50.899999999999999 110.293 167.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.98 127.3 55.9 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.416 -0.957 . . . . 55.460000000000001 108.416 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.3 m -119.43 129.42 54.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.01 -0.737 . . . . 51.020000000000003 109.01 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.3 t -75.85 119.88 24.65 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 N-CA-C 109.389 -0.597 . . . . 46.079999999999998 109.389 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -97.89 -37.59 9.76 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.757 0.823 . . . . 62.640000000000001 113.049 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -142.59 142.25 32.11 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 107.788 -1.19 . . . . 59.960000000000001 107.788 178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.0 tt -141.55 132.18 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 107.512 -1.292 . . . . 54.549999999999997 107.512 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.7 m -129.29 141.26 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 108.07 -1.085 . . . . 49.859999999999999 108.07 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -136.77 136.57 39.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.166 0.586 . . . . 72.450000000000003 109.791 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.9 m -147.97 108.81 4.21 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.432 -2.062 . . . . 61.520000000000003 105.432 171.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.67 -125.62 23.21 Favored Glycine 0 C--O 1.237 0.331 0 O-C-N 123.498 0.499 . . . . 59.780000000000001 112.055 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.57 2.95 56.41 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.115 1.154 . . . . 79.180000000000007 114.115 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.42 133.49 45.96 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 122.858 0.463 . . . . 63.469999999999999 111.461 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -128.89 125.12 62.47 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 N-CA-C 108.059 -1.089 . . . . 50.07 108.059 175.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.8 30.62 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.896 -0.779 . . . . 42.689999999999998 108.896 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.7 p -138.45 143.78 39.81 Favored 'General case' 0 C--O 1.25 1.081 0 O-C-N 123.72 0.637 . . . . 48.25 112.101 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -106.61 124.91 50.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 106.197 -1.779 . . . . 49.640000000000001 106.197 165.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 68.4 m -119.95 156.52 30.66 Favored 'General case' 0 N--CA 1.443 -0.794 0 O-C-N 123.871 0.732 . . . . 51.049999999999997 110.217 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.6 t -114.95 125.14 72.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.709 -1.219 . . . . 52.520000000000003 107.709 168.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.77 121.06 33.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.278 -1.379 . . . . 56.100000000000001 107.278 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.7 mtt85 -123.16 143.24 50.14 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 124.172 0.92 . . . . 69.709999999999994 110.489 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.31 173.87 46.2 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.91 -0.876 . . . . 68.209999999999994 110.91 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -125.78 115.37 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 103.009 -2.96 . . . . 81.689999999999998 103.009 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -112.56 116.88 30.92 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 109.771 -0.455 . . . . 87.799999999999997 109.771 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.0 t 46.99 51.89 12.34 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 124.155 0.91 . . . . 79.209999999999994 111.638 -173.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.03 5.55 65.72 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 118.71 2.244 . . . . 73.359999999999999 118.71 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . . . -111.09 119.28 46.13 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 118.64 1.22 . . . . 75.969999999999999 110.173 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -76.61 147.52 28.24 Favored 'Trans proline' 0 N--CA 1.48 0.721 0 N-CA-C 113.45 0.519 . . . . 76.409999999999997 113.45 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -142.67 149.49 38.95 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.882 0.697 . . . . 64.730000000000004 112.882 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -138.03 114.43 10.32 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 125.549 1.54 . . . . 82.379999999999995 108.068 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' MSE . . . . . . . . . . . . . 3.3 ptt? -127.47 135.47 50.44 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.702 0.763 . . . . 75.810000000000002 110.527 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 99.9 m -76.0 142.04 42.0 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.157 -0.929 . . . . 61.579999999999998 110.025 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' MSE . . . . . . . . . . . . . 4.1 mtp -129.97 140.58 50.89 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.321 -0.992 . . . . 97.370000000000005 108.321 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.6 mt -121.49 135.48 55.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 107.19 -1.411 . . . . 48.149999999999999 107.19 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -136.35 154.28 50.89 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 109.391 -0.596 . . . . 46.240000000000002 109.391 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' MSE . . . . . . . . . . . . . 36.4 ttm -143.75 132.02 21.98 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.712 -1.588 . . . . 76.319999999999993 106.712 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.3 m -132.3 142.2 49.27 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.241 -0.436 . . . . 47.289999999999999 110.896 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -102.43 130.09 49.12 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.58 -1.637 . . . . 79.420000000000002 106.58 167.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.02 133.93 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.402 0.681 . . . . 54.329999999999998 109.256 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . . . -139.31 125.7 20.33 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.858 -1.164 . . . . 61.119999999999997 107.858 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 54.45 40.94 32.18 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.561 0.696 . . . . 76.680000000000007 112.762 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.5 21.77 72.77 Favored Glycine 0 CA--C 1.521 0.412 0 N-CA-C 116.627 1.411 . . . . 56.460000000000001 116.627 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -131.95 144.44 50.82 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.858 0.829 . . . . 61.649999999999999 110.973 175.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 83.2 mt -70.02 123.6 24.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.369 -0.974 . . . . 52.219999999999999 108.369 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.32 -18.1 7.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 113.376 0.88 . . . . 49.619999999999997 113.376 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -149.14 144.32 26.54 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.848 -0.797 . . . . 52.240000000000002 108.848 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -149.37 134.27 17.95 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.325 0.65 . . . . 41.420000000000002 110.581 -176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 24.9 m-90 -119.74 137.0 54.21 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.709 -1.589 . . . . 47.689999999999998 106.709 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 10.2 t -144.2 144.05 31.35 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.273 0.358 . . . . 46.130000000000003 110.869 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.4 mt -142.84 138.1 27.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.315 -1.365 . . . . 55.079999999999998 107.315 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 62.1 m -116.49 152.01 34.93 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.941 -0.572 . . . . 64.969999999999999 110.644 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -85.68 69.94 10.67 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.523 -0.762 . . . . 70.379999999999995 110.275 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.04 -35.86 81.65 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.068 1.136 . . . . 73.969999999999999 114.068 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.3 -40.12 85.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 117.614 0.188 . . . . 75.5 111.199 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 48.1 m -61.79 -40.53 95.51 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 123.048 0.217 . . . . 78.25 111.357 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' MSE . . . . . . . . . . . . . 22.4 ttp -65.99 -44.4 84.95 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 112.272 0.471 . . . . 108.90000000000001 112.272 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . . . -60.65 -39.89 89.98 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.204 0.315 . . . . 96.769999999999996 111.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.19 -40.48 90.2 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.585 0.587 . . . . 93.489999999999995 112.585 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -68.34 -30.06 68.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.792 1.034 . . . . 89.150000000000006 113.792 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.3 mt -91.21 -32.86 15.62 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.234 0.828 . . . . 92.219999999999999 113.234 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.619 0 C-N-CA 123.672 0.653 . . . . 88.349999999999994 111.895 -175.772 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.38 0.882 . . . . 90.579999999999998 113.38 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -72.9 -45.14 8.71 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 113.781 1.03 . . . . 92.480000000000004 113.781 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.07 -40.1 73.74 Favored 'Trans proline' 0 C--N 1.354 0.825 0 N-CA-C 113.96 0.715 . . . . 64.359999999999999 113.96 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -53.49 -40.93 65.76 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 113.866 1.061 . . . . 58.539999999999999 113.866 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -68.75 -41.94 78.2 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 122.482 0.313 . . . . 60.829999999999998 111.349 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.7 m -53.85 -45.26 70.88 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.744 0.646 . . . . 51.439999999999998 112.744 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 50.1 mm -75.24 -40.2 43.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 110.068 -0.345 . . . . 55.390000000000001 110.068 -175.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.44 91.22 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 121.096 -0.242 . . . . 45.549999999999997 110.86 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.89 -34.37 88.56 Favored Glycine 0 N--CA 1.465 0.628 0 N-CA-C 115.245 0.858 . . . . 44.75 115.245 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.2 -49.83 74.22 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 112.475 0.546 . . . . 50.890000000000001 112.475 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -68.65 -36.96 79.26 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.474 0.484 . . . . 56.259999999999998 112.008 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -55.31 -49.32 72.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.432 0.458 . . . . 69.400000000000006 110.694 169.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.27 90.3 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 113.673 0.99 . . . . 45.950000000000003 113.673 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -61.89 -45.19 94.83 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.163 0.431 . . . . 47.649999999999999 112.163 171.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.83 -42.81 98.47 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.2 0.313 . . . . 46.619999999999997 111.22 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.7 m -80.04 -11.42 59.78 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.122 1.527 . . . . 52.719999999999999 115.122 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.88 68.59 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 118.505 0.593 . . . . 51.009999999999998 112.077 -174.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -92.33 86.6 5.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.071 0.548 . . . . 55.399999999999999 109.728 -172.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 33.9 mt -58.74 -38.7 78.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.814 1.413 . . . . 66.079999999999998 114.814 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -62.63 -47.63 82.92 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.73 0.644 . . . . 78.170000000000002 111.013 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 93.6 m -67.2 -39.73 86.38 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 123.716 0.635 . . . . 52.460000000000001 111.667 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.4 mt -55.82 -47.3 77.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.617 0.246 . . . . 49.729999999999997 111.292 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -71.76 -21.72 61.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.745 1.387 . . . . 52.219999999999999 114.745 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -73.78 -42.86 60.42 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.289 0.477 . . . . 73.099999999999994 112.289 167.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 90.8 mt -82.42 -17.84 44.0 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 115.149 1.537 . . . . 47.609999999999999 115.149 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 19.0 mt -115.47 125.99 72.87 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 N-CA-C 109.245 -0.65 . . . . 48.969999999999999 109.245 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.52 141.8 98.3 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 109.317 -0.623 . . . . 50.07 109.317 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -55.24 -33.05 83.32 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.427 1.418 . . . . 51.869999999999997 115.214 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -102.34 19.63 18.42 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.426 0.69 . . . . 78.980000000000004 111.876 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.53 146.91 38.82 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.409 -0.589 . . . . 52.479999999999997 109.409 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 95.5 t -96.99 107.97 20.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 N-CA-C 108.636 -0.876 . . . . 52.020000000000003 108.636 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 31.0 mm -108.09 113.42 43.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 47.579999999999998 110.175 -172.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -95.77 101.89 13.62 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.094 -0.706 . . . . 51.729999999999997 109.094 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 84.3 mt -93.75 157.74 37.69 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 109.323 -0.621 . . . . 57.280000000000001 109.323 177.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.71 164.04 34.51 Favored 'Trans proline' 0 C--O 1.239 0.558 0 O-C-N 122.788 0.888 . . . . 63.799999999999997 112.045 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.23 -28.94 55.56 Favored Glycine 0 C--N 1.333 0.365 0 N-CA-C 115.878 1.111 . . . . 79.519999999999996 115.878 -174.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 64.7 p -57.83 -31.93 67.11 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 112.914 0.709 . . . . 90.920000000000002 112.914 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.94 -4.66 53.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.247 1.203 . . . . 92.590000000000003 114.247 173.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.99 148.96 50.05 Favored Glycine 0 N--CA 1.467 0.727 0 CA-C-O 119.16 -0.8 . . . . 108.23 112.998 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . 0.261 0.6 OUTLIER -156.63 -168.61 2.74 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 0.724 . . . . 125.37 110.419 -176.117 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.22 99.22 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.623 0.971 . . . . 130.47 113.623 -167.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -87.97 -27.14 22.28 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.03 0.752 . . . . 135.41 113.03 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -121.62 91.57 48.52 Favored Pre-proline 0 C--N 1.344 0.332 0 C-N-CA 122.54 0.336 . . . . 119.94 110.868 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -58.68 154.14 44.98 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 120.74 0.96 . . . . 113.93000000000001 112.879 171.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -37.99 -44.88 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 122.177 3.876 . . . . 107.44 122.177 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -78.07 -2.46 82.73 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 121.46 1.936 . . . . 93.109999999999999 117.128 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 11.4 m -86.4 123.81 70.75 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 123.98 0.912 . . . . 87.75 109.874 -165.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.86 151.3 84.58 Favored 'Trans proline' 0 C--N 1.353 0.786 0 O-C-N 122.448 0.709 . . . . 72.290000000000006 113.231 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 35.7 mtt-85 -108.85 168.18 9.54 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.37 -0.604 . . . . 84.810000000000002 109.37 170.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 45.0 p30 -94.19 -176.63 4.04 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 123.711 0.632 . . . . 61.25 109.719 166.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -51.94 -53.93 35.46 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.39 1.256 . . . . 53.549999999999997 114.39 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.7 -27.36 65.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.414 -0.812 . . . . 57.109999999999999 112.308 -174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.59 -43.34 96.63 Favored Glycine 0 C--O 1.213 -1.213 0 N-CA-C 110.788 -0.925 . . . . 48.490000000000002 110.788 169.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -63.78 -49.59 72.35 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 111.761 0.282 . . . . 50.560000000000002 111.761 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.44 -34.24 75.08 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.143 0.423 . . . . 52.159999999999997 112.143 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.45 -43.5 97.43 Favored Glycine 0 N--CA 1.476 1.302 0 N-CA-C 115.577 0.991 . . . . 49.289999999999999 115.577 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 50.0 t -67.63 -41.27 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 122.343 -0.504 . . . . 52.780000000000001 110.725 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -57.92 -48.13 80.8 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 116.392 -0.367 . . . . 52.0 111.965 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -62.53 -37.41 85.99 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.038 1.125 . . . . 62.57 114.038 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.79 -49.17 77.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.584 -0.28 . . . . 82.299999999999997 111.477 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -61.46 -36.9 81.7 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.837 0.68 . . . . 70.969999999999999 112.837 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . . . -65.8 -36.08 82.5 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 117.528 -1.225 . . . . 75.189999999999998 111.947 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.12 -36.36 70.56 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.273 1.212 . . . . 73.670000000000002 114.273 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -80.66 -35.49 33.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.981 1.104 . . . . 82.629999999999995 113.981 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -125.02 75.79 67.15 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 123.935 0.894 . . . . 75.780000000000001 109.002 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -65.66 -22.03 58.22 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 N-CA-C 115.965 1.486 . . . . 67.159999999999997 115.965 -170.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -102.01 12.81 36.29 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.247 1.203 . . . . 57.659999999999997 114.247 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' MSE . . . . . . . . . . . . . 31.4 ttp -71.57 131.34 43.1 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 109.153 -0.684 . . . . 72.859999999999999 109.153 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 50.5 p -133.77 154.63 50.84 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.496 0.718 . . . . 48.979999999999997 109.953 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.74 132.82 55.68 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 123.649 0.78 . . . . 45.899999999999999 109.46 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -119.8 132.12 55.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.453 -0.573 . . . . 45.140000000000001 109.453 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 99.6 t -78.24 121.52 31.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 109.337 -0.616 . . . . 39.969999999999999 109.337 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -98.15 -37.9 9.53 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.636 0.774 . . . . 52.840000000000003 112.524 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -143.83 146.06 32.79 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.015 0.926 . . . . 46.630000000000003 109.645 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 12.6 tt -143.19 132.93 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 108.332 -0.988 . . . . 48.210000000000001 108.332 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.67 142.58 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 108.395 -0.965 . . . . 57.840000000000003 108.395 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -135.33 136.65 41.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.812 -0.631 . . . . 59.130000000000003 110.04 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -146.4 108.13 4.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 105.435 -2.061 . . . . 54.079999999999998 105.435 171.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.97 -125.08 24.52 Favored Glycine 0 CA--C 1.508 -0.387 0 O-C-N 123.503 0.502 . . . . 52.710000000000001 113.737 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 p-10 -93.29 3.42 55.67 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.702 1.001 . . . . 53.810000000000002 113.702 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 28.7 mt -102.19 133.87 46.37 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.091 0.556 . . . . 49.609999999999999 111.047 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.42 125.4 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 N-CA-C 107.726 -1.213 . . . . 45.299999999999997 107.726 175.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.3 145.6 34.17 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.554 -0.906 . . . . 42.75 108.554 169.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 18.6 p -138.78 143.61 39.03 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.866 -0.606 . . . . 45.829999999999998 111.534 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -107.48 124.23 49.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 106.292 -1.744 . . . . 42.460000000000001 106.292 166.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 81.2 m -120.24 159.29 25.25 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.309 0.575 . . . . 46.969999999999999 110.035 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -115.02 123.56 70.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.469 -1.308 . . . . 50.270000000000003 107.469 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.18 122.08 34.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.119 -1.438 . . . . 44.009999999999998 107.119 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 56.6 mtt85 -119.92 138.14 53.62 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.321 0.648 . . . . 67.319999999999993 109.664 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.35 -178.58 39.14 Favored Glycine 0 C--O 1.231 -0.034 0 N-CA-C 111.174 -0.77 . . . . 61.960000000000001 111.174 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 34.5 p -121.95 143.31 49.54 Favored 'General case' 0 CA--C 1.509 -0.612 0 O-C-N 124.319 0.658 . . . . 71.780000000000001 110.833 166.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -112.46 116.15 29.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.726 -0.842 . . . . 98.870000000000005 108.726 164.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 88.5 p 47.86 51.7 13.92 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 124.082 0.864 . . . . 99.010000000000005 111.797 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.29 8.59 70.79 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 118.402 2.121 . . . . 88.670000000000002 118.402 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -110.96 118.74 47.56 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-N 117.86 0.83 . . . . 82.859999999999999 109.108 176.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -76.94 150.2 29.84 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.051 1.167 . . . . 72.060000000000002 113.494 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -136.66 152.71 50.71 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.361 0.874 . . . . 64.530000000000001 113.361 173.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -132.23 119.3 20.65 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.796 1.238 . . . . 74.25 108.516 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' MSE . . . . . . . . . . . . . 6.5 ttp -127.5 134.44 49.8 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 120.867 0.365 . . . . 59.82 110.492 -177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 75.5 m -77.73 142.15 38.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.834 -0.621 . . . . 46.689999999999998 109.33 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' MSE . . . . . . . . . . . . . 4.3 mtp -128.73 138.86 52.35 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.284 -1.006 . . . . 76.799999999999997 108.284 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -121.15 135.06 55.23 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.728 -1.212 . . . . 43.969999999999999 107.728 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -136.6 151.49 49.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.799 -0.815 . . . . 42.409999999999997 108.799 -173.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' MSE . . . . . . . . . . . . . 20.2 tpp -139.2 130.92 27.43 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.623 -1.621 . . . . 64.870000000000005 106.623 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 11.0 m -134.26 141.22 46.91 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.977 -0.556 . . . . 50.439999999999998 110.788 -173.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -104.89 129.55 53.23 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 106.687 -1.597 . . . . 55.869999999999997 106.687 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 80.5 t -117.98 135.45 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.18 0.592 . . . . 52.079999999999998 109.686 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -141.0 126.27 18.55 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.706 -1.22 . . . . 61.450000000000003 107.706 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 52.94 39.71 29.76 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.324 0.861 . . . . 87.120000000000005 113.324 -175.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 68.11 22.68 74.41 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 116.362 1.305 . . . . 58.969999999999999 116.362 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -132.21 142.81 49.56 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 117.433 0.616 . . . . 59.579999999999998 111.723 174.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 92.3 mt -69.22 124.39 24.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.195 -1.039 . . . . 57.539999999999999 108.195 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 34.7 m -111.93 -19.28 7.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 N-CA-C 113.388 0.884 . . . . 45.619999999999997 113.388 173.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -148.79 143.98 26.71 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.149 -0.686 . . . . 64.140000000000001 109.149 172.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -150.11 133.91 16.82 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 123.763 0.664 . . . . 44.649999999999999 110.448 -175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 25.2 m-90 -120.13 137.92 53.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.2 -1.778 . . . . 53.380000000000003 106.2 169.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 11.1 t -144.33 144.83 31.64 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.233 0.333 . . . . 47.079999999999998 111.238 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 19.9 mt -142.36 139.53 29.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 107.636 -1.246 . . . . 51.090000000000003 107.636 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 43.6 m -115.13 151.11 34.92 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.421 0.688 . . . . 46.810000000000002 111.525 177.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -85.58 69.93 10.7 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 115.135 -0.939 . . . . 46.07 110.562 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -61.65 -37.17 83.05 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.375 1.25 . . . . 62.719999999999999 114.375 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 84.7 t -66.13 -39.82 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 111.411 0.152 . . . . 64.75 111.411 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 50.0 m -62.33 -40.14 95.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.45 0.167 . . . . 61.039999999999999 111.45 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -65.8 -44.41 85.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 112.062 0.393 . . . . 101.97 112.062 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.98 -39.58 90.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.44 0.462 . . . . 75.730000000000004 111.616 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.53 89.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.849 0.685 . . . . 76.599999999999994 112.849 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.09 -30.31 69.46 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.875 1.065 . . . . 79.030000000000001 113.875 178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 81.0 mt -93.11 -66.61 0.91 Allowed 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.128 0.788 . . . . 85.689999999999998 113.128 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.702 0 N-CA-C 110.951 -0.86 . . . . 90.159999999999997 110.951 -169.915 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.176 0 N-CA-C 112.89 0.7 . . . . 79.53 112.89 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.3 -40.05 71.98 Favored 'Trans proline' 0 C--N 1.357 1.0 0 N-CA-C 114.069 0.757 . . . . 70.61 114.069 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.6 m -52.56 -41.82 63.91 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.763 1.023 . . . . 73.53 113.763 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -67.51 -42.52 82.67 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.503 0.502 . . . . 85.51 112.093 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 84.8 m -53.81 -45.17 70.71 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.481 0.549 . . . . 62.65 112.481 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mm -75.38 -40.07 42.08 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 CA-C-N 115.924 -0.58 . . . . 58.3 110.537 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.43 91.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.647 -0.421 . . . . 62.2 110.939 172.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.18 -34.27 87.42 Favored Glycine 0 N--CA 1.474 1.191 0 N-CA-C 115.33 0.892 . . . . 59.27 115.33 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.32 -49.48 75.46 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.581 0.586 . . . . 63.17 112.581 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -69.37 -36.23 76.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 118.943 -0.551 . . . . 71.45 112.351 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -54.83 -49.81 70.14 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 110.019 -0.363 . . . . 71.35 110.019 168.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.39 90.13 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.652 0.982 . . . . 55.81 113.652 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -62.15 -45.44 93.43 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.754 0.279 . . . . 52.46 111.754 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -59.64 -43.14 93.98 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 112.821 0.674 . . . . 55.5 112.821 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 97.0 p -80.59 -10.02 59.75 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.048 1.499 . . . . 64.58 115.048 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.31 32.22 60.34 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 118.103 0.41 . . . . 62.51 112.441 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -94.18 85.95 4.81 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.08 0.552 . . . . 62.7 110.075 -170.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 mt -59.66 -37.26 78.24 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.392 1.256 . . . . 73.06 114.392 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . . . -63.08 -46.64 86.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.231 0.332 . . . . 59.84 111.467 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.2 m -67.3 -39.4 85.93 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.397 -0.365 . . . . 58.67 111.42 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 mt -56.4 -46.43 80.15 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.584 0.23 . . . . 51.75 111.259 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -70.63 -22.04 62.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 115.065 1.505 . . . . 60.25 115.065 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -74.55 -42.31 59.03 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.142 0.423 . . . . 72.2 112.142 168.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 91.9 mt -82.25 -18.13 43.56 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.944 1.461 . . . . 55.04 114.944 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.0 mt -116.26 124.45 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 109.093 -0.706 . . . . 45.03 109.093 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.7 98.03 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 109.439 -0.578 . . . . 47.39 109.439 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -55.61 -32.65 84.1 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 121.418 1.412 . . . . 44.91 114.612 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -101.21 18.57 19.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.325 0.65 . . . . 57.06 112.124 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.63 146.84 34.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.457 -0.572 . . . . 39.99 109.457 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.8 t -96.9 107.54 20.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 108.245 -1.02 . . . . 40.68 108.245 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.0 mm -107.64 112.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.011 -0.366 . . . . 36.64 110.011 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -95.73 100.07 11.83 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.934 -0.765 . . . . 46.86 108.934 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.9 mt -94.04 156.97 38.58 Favored Pre-proline 0 N--CA 1.435 -1.204 0 N-CA-C 108.264 -1.013 . . . . 50.91 108.264 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.63 163.83 36.4 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 O-C-N 122.856 0.924 . . . . 46.29 112.505 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -55.25 -28.58 50.36 Favored Glycine 0 N--CA 1.467 0.735 0 N-CA-C 115.304 0.882 . . . . 55.89 115.304 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -57.8 -32.04 67.17 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 117.715 0.757 . . . . 74.26 113.021 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.48 -1.37 50.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.611 0.967 . . . . 65.12 113.611 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.85 164.77 38.74 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-O 123.301 1.5 . . . . 72.02 111.613 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.8 169.56 24.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.018 -1.091 . . . . 82.44 108.76 -162.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.97 -41.68 88.1 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.946 0.721 . . . . 66.78 112.946 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -85.2 -26.68 26.6 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.552 1.316 . . . . 81.96 114.552 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -122.55 91.79 49.28 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.381 0.672 . . . . 61.38 110.399 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -64.06 153.2 77.48 Favored 'Trans proline' 0 C--N 1.349 0.605 0 O-C-N 123.312 1.164 . . . . 69.47 113.208 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.76 139.97 48.0 Favored 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 122.307 2.005 . . . . 74.65 113.775 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.75 -0.6 76.73 Favored Glycine 0 N--CA 1.468 0.78 0 N-CA-C 116.72 1.448 . . . . 60.87 116.72 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.8 m -83.59 124.22 75.62 Favored Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 119.0 1.4 . . . . 59.52 109.264 170.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -65.21 150.34 87.66 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 120.484 0.79 . . . . 44.98 112.861 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -109.48 167.23 10.28 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.47 -0.937 . . . . 51.93 108.47 174.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -93.28 -177.89 4.59 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 109.15 -0.685 . . . . 43.08 109.15 165.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -54.71 -52.52 62.19 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.914 1.079 . . . . 47.15 113.914 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -66.97 -28.22 68.09 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.623 0.601 . . . . 50.54 112.623 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.39 -44.69 94.99 Favored Glycine 0 N--CA 1.467 0.713 0 N-CA-C 110.831 -0.908 . . . . 43.34 110.831 170.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -62.87 -49.69 73.85 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.906 0.335 . . . . 43.47 111.906 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.35 -34.47 75.35 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.007 -0.521 . . . . 47.95 112.394 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.39 95.96 Favored Glycine 0 N--CA 1.48 1.577 0 N-CA-C 115.529 0.972 . . . . 46.62 115.529 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.1 t -68.3 -41.69 83.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 121.498 0.666 . . . . 48.18 110.647 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.86 -41.06 99.22 Favored 'General case' 0 C--O 1.202 -1.432 0 CA-C-N 115.877 -0.601 . . . . 66.0 112.037 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.32 -37.99 85.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 119.714 1.143 . . . . 71.03 112.884 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -61.85 -49.6 75.62 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.35 0.523 . . . . 55.71 110.889 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.1 m -58.92 -36.03 74.06 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 113.365 0.876 . . . . 55.12 113.365 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . . . -66.47 -45.33 80.06 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.633 1.206 . . . . 55.4 111.062 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.79 -32.82 74.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.344 -0.844 . . . . 54.15 110.819 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -77.28 -35.88 54.78 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.479 1.288 . . . . 62.56 114.479 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -126.02 76.67 71.57 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.416 -0.957 . . . . 62.86 108.416 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -64.48 -22.27 65.55 Favored 'Trans proline' 0 C--O 1.247 0.929 0 N-CA-C 116.47 1.681 . . . . 60.35 116.47 -171.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -100.25 7.52 44.39 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.481 1.66 . . . . 77.74 115.481 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MSE . . . . . . . . . . . . . 60.2 ttp -71.38 135.05 47.1 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 108.56 -0.904 . . . . 79.16 108.56 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.3 p -127.28 153.19 46.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.071 -0.968 . . . . 50.9 110.293 167.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.98 127.3 55.9 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.416 -0.957 . . . . 55.46 108.416 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.3 m -119.43 129.42 54.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.01 -0.737 . . . . 51.02 109.01 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.3 t -75.85 119.88 24.65 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 N-CA-C 109.389 -0.597 . . . . 46.08 109.389 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -97.89 -37.59 9.76 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.757 0.823 . . . . 62.64 113.049 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -142.59 142.25 32.11 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 107.788 -1.19 . . . . 59.96 107.788 178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.0 tt -141.55 132.18 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 107.512 -1.292 . . . . 54.55 107.512 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.7 m -129.29 141.26 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 108.07 -1.085 . . . . 49.86 108.07 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -136.77 136.57 39.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.166 0.586 . . . . 72.45 109.791 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.9 m -147.97 108.81 4.21 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.432 -2.062 . . . . 61.52 105.432 171.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.67 -125.62 23.21 Favored Glycine 0 C--O 1.237 0.331 0 O-C-N 123.498 0.499 . . . . 59.78 112.055 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.57 2.95 56.41 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.115 1.154 . . . . 79.18 114.115 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.42 133.49 45.96 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 122.858 0.463 . . . . 63.47 111.461 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -128.89 125.12 62.47 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 N-CA-C 108.059 -1.089 . . . . 50.07 108.059 175.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.8 30.62 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.896 -0.779 . . . . 42.69 108.896 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.7 p -138.45 143.78 39.81 Favored 'General case' 0 C--O 1.25 1.081 0 O-C-N 123.72 0.637 . . . . 48.25 112.101 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -106.61 124.91 50.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 106.197 -1.779 . . . . 49.64 106.197 165.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 68.4 m -119.95 156.52 30.66 Favored 'General case' 0 N--CA 1.443 -0.794 0 O-C-N 123.871 0.732 . . . . 51.05 110.217 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.6 t -114.95 125.14 72.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.709 -1.219 . . . . 52.52 107.709 168.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.77 121.06 33.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.278 -1.379 . . . . 56.1 107.278 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.7 mtt85 -123.16 143.24 50.14 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 124.172 0.92 . . . . 69.71 110.489 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.31 173.87 46.2 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.91 -0.876 . . . . 68.21 110.91 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -125.78 115.37 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 103.009 -2.96 . . . . 81.69 103.009 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -112.56 116.88 30.92 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 109.771 -0.455 . . . . 87.8 109.771 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.0 t 46.99 51.89 12.34 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 124.155 0.91 . . . . 79.21 111.638 -173.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.03 5.55 65.72 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 118.71 2.244 . . . . 73.36 118.71 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . . . -111.09 119.28 46.13 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 118.64 1.22 . . . . 75.97 110.173 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -76.61 147.52 28.24 Favored 'Trans proline' 0 N--CA 1.48 0.721 0 N-CA-C 113.45 0.519 . . . . 76.41 113.45 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -142.67 149.49 38.95 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.882 0.697 . . . . 64.73 112.882 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -138.03 114.43 10.32 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 125.549 1.54 . . . . 82.38 108.068 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' MSE . . . . . . . . . . . . . 3.3 ptt? -127.47 135.47 50.44 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.702 0.763 . . . . 75.81 110.527 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 99.9 m -76.0 142.04 42.0 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.157 -0.929 . . . . 61.58 110.025 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' MSE . . . . . . . . . . . . . 4.1 mtp -129.97 140.58 50.89 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.321 -0.992 . . . . 97.37 108.321 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.6 mt -121.49 135.48 55.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 107.19 -1.411 . . . . 48.15 107.19 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -136.35 154.28 50.89 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 109.391 -0.596 . . . . 46.24 109.391 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' MSE . . . . . . . . . . . . . 36.4 ttm -143.75 132.02 21.98 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.712 -1.588 . . . . 76.32 106.712 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.3 m -132.3 142.2 49.27 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.241 -0.436 . . . . 47.29 110.896 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -102.43 130.09 49.12 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.58 -1.637 . . . . 79.42 106.58 167.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.02 133.93 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.402 0.681 . . . . 54.33 109.256 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . . . -139.31 125.7 20.33 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.858 -1.164 . . . . 61.12 107.858 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 54.45 40.94 32.18 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.561 0.696 . . . . 76.68 112.762 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.5 21.77 72.77 Favored Glycine 0 CA--C 1.521 0.412 0 N-CA-C 116.627 1.411 . . . . 56.46 116.627 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -131.95 144.44 50.82 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.858 0.829 . . . . 61.65 110.973 175.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 83.2 mt -70.02 123.6 24.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.369 -0.974 . . . . 52.22 108.369 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.32 -18.1 7.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 113.376 0.88 . . . . 49.62 113.376 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -149.14 144.32 26.54 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.848 -0.797 . . . . 52.24 108.848 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -149.37 134.27 17.95 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.325 0.65 . . . . 41.42 110.581 -176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 24.9 m-90 -119.74 137.0 54.21 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.709 -1.589 . . . . 47.69 106.709 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 10.2 t -144.2 144.05 31.35 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.273 0.358 . . . . 46.13 110.869 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.4 mt -142.84 138.1 27.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.315 -1.365 . . . . 55.08 107.315 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 62.1 m -116.49 152.01 34.93 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.941 -0.572 . . . . 64.97 110.644 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -85.68 69.94 10.67 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.523 -0.762 . . . . 70.38 110.275 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.04 -35.86 81.65 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.068 1.136 . . . . 73.97 114.068 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.3 -40.12 85.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 117.614 0.188 . . . . 75.5 111.199 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 48.1 m -61.79 -40.53 95.51 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 123.048 0.217 . . . . 78.25 111.357 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' MSE . . . . . . . . . . . . . 22.4 ttp -65.99 -44.4 84.95 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 112.272 0.471 . . . . 108.9 112.272 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . . . -60.65 -39.89 89.98 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.204 0.315 . . . . 96.77 111.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.19 -40.48 90.2 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.585 0.587 . . . . 93.49 112.585 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -68.34 -30.06 68.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.792 1.034 . . . . 89.15 113.792 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.3 mt -91.21 -32.86 15.62 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.234 0.828 . . . . 92.22 113.234 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.619 0 C-N-CA 123.672 0.653 . . . . 88.35 111.895 -175.772 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.38 0.882 . . . . 90.58 113.38 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -72.9 -45.14 8.71 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 113.781 1.03 . . . . 92.48 113.781 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.07 -40.1 73.74 Favored 'Trans proline' 0 C--N 1.354 0.825 0 N-CA-C 113.96 0.715 . . . . 64.36 113.96 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -53.49 -40.93 65.76 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 113.866 1.061 . . . . 58.54 113.866 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -68.75 -41.94 78.2 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 122.482 0.313 . . . . 60.83 111.349 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.7 m -53.85 -45.26 70.88 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.744 0.646 . . . . 51.44 112.744 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 50.1 mm -75.24 -40.2 43.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 110.068 -0.345 . . . . 55.39 110.068 -175.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.44 91.22 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 121.096 -0.242 . . . . 45.55 110.86 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.89 -34.37 88.56 Favored Glycine 0 N--CA 1.465 0.628 0 N-CA-C 115.245 0.858 . . . . 44.75 115.245 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.2 -49.83 74.22 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 112.475 0.546 . . . . 50.89 112.475 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -68.65 -36.96 79.26 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.474 0.484 . . . . 56.26 112.008 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -55.31 -49.32 72.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.432 0.458 . . . . 69.4 110.694 169.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.27 90.3 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 113.673 0.99 . . . . 45.95 113.673 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -61.89 -45.19 94.83 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.163 0.431 . . . . 47.65 112.163 171.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.83 -42.81 98.47 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.2 0.313 . . . . 46.62 111.22 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.7 m -80.04 -11.42 59.78 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.122 1.527 . . . . 52.72 115.122 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.88 68.59 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 118.505 0.593 . . . . 51.01 112.077 -174.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -92.33 86.6 5.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.071 0.548 . . . . 55.4 109.728 -172.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 33.9 mt -58.74 -38.7 78.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.814 1.413 . . . . 66.08 114.814 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -62.63 -47.63 82.92 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.73 0.644 . . . . 78.17 111.013 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 93.6 m -67.2 -39.73 86.38 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 123.716 0.635 . . . . 52.46 111.667 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.4 mt -55.82 -47.3 77.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.617 0.246 . . . . 49.73 111.292 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -71.76 -21.72 61.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.745 1.387 . . . . 52.22 114.745 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -73.78 -42.86 60.42 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.289 0.477 . . . . 73.1 112.289 167.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 90.8 mt -82.42 -17.84 44.0 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 115.149 1.537 . . . . 47.61 115.149 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 19.0 mt -115.47 125.99 72.87 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 N-CA-C 109.245 -0.65 . . . . 48.97 109.245 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.52 141.8 98.3 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 109.317 -0.623 . . . . 50.07 109.317 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -55.24 -33.05 83.32 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.427 1.418 . . . . 51.87 115.214 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -102.34 19.63 18.42 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.426 0.69 . . . . 78.98 111.876 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.53 146.91 38.82 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.409 -0.589 . . . . 52.48 109.409 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 95.5 t -96.99 107.97 20.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 N-CA-C 108.636 -0.876 . . . . 52.02 108.636 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 31.0 mm -108.09 113.42 43.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 47.58 110.175 -172.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -95.77 101.89 13.62 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.094 -0.706 . . . . 51.73 109.094 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' B' ' 54' ' ' ARG . 84.3 mt -93.75 157.74 37.69 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 109.323 -0.621 . . . . 57.28 109.323 177.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.71 164.04 34.51 Favored 'Trans proline' 0 C--O 1.239 0.558 0 O-C-N 122.788 0.888 . . . . 63.8 112.045 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.23 -28.94 55.56 Favored Glycine 0 C--N 1.333 0.365 0 N-CA-C 115.878 1.111 . . . . 79.52 115.878 -174.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 64.7 p -57.83 -31.93 67.11 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 112.914 0.709 . . . . 90.92 112.914 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.94 -4.66 53.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.247 1.203 . . . . 92.59 114.247 173.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.99 148.96 50.05 Favored Glycine 0 N--CA 1.467 0.727 0 CA-C-O 119.16 -0.8 . . . . 108.23 112.998 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . 0.261 0.6 OUTLIER -156.63 -168.61 2.74 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 0.724 . . . . 125.37 110.419 -176.117 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.22 99.22 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.623 0.971 . . . . 130.47 113.623 -167.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -87.97 -27.14 22.28 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.03 0.752 . . . . 135.41 113.03 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -121.62 91.57 48.52 Favored Pre-proline 0 C--N 1.344 0.332 0 C-N-CA 122.54 0.336 . . . . 119.94 110.868 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -58.68 154.14 44.98 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 120.74 0.96 . . . . 113.93 112.879 171.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -37.99 -44.88 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 122.177 3.876 . . . . 107.44 122.177 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -78.07 -2.46 82.73 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 121.46 1.936 . . . . 93.11 117.128 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 11.4 m -86.4 123.81 70.75 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 123.98 0.912 . . . . 87.75 109.874 -165.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.86 151.3 84.58 Favored 'Trans proline' 0 C--N 1.353 0.786 0 O-C-N 122.448 0.709 . . . . 72.29 113.231 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 39' ' ' LEU . 35.7 mtt-85 -108.85 168.18 9.54 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.37 -0.604 . . . . 84.81 109.37 170.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 45.0 p30 -94.19 -176.63 4.04 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 123.711 0.632 . . . . 61.25 109.719 166.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -51.94 -53.93 35.46 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.39 1.256 . . . . 53.55 114.39 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.7 -27.36 65.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.414 -0.812 . . . . 57.11 112.308 -174.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.59 -43.34 96.63 Favored Glycine 0 C--O 1.213 -1.213 0 N-CA-C 110.788 -0.925 . . . . 48.49 110.788 169.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -63.78 -49.59 72.35 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 111.761 0.282 . . . . 50.56 111.761 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.44 -34.24 75.08 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.143 0.423 . . . . 52.16 112.143 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.45 -43.5 97.43 Favored Glycine 0 N--CA 1.476 1.302 0 N-CA-C 115.577 0.991 . . . . 49.29 115.577 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 50.0 t -67.63 -41.27 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 122.343 -0.504 . . . . 52.78 110.725 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -57.92 -48.13 80.8 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 116.392 -0.367 . . . . 52.0 111.965 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -62.53 -37.41 85.99 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.038 1.125 . . . . 62.57 114.038 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.79 -49.17 77.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.584 -0.28 . . . . 82.3 111.477 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -61.46 -36.9 81.7 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.837 0.68 . . . . 70.97 112.837 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . . . -65.8 -36.08 82.5 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 117.528 -1.225 . . . . 75.19 111.947 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.12 -36.36 70.56 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.273 1.212 . . . . 73.67 114.273 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -80.66 -35.49 33.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.981 1.104 . . . . 82.63 113.981 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -125.02 75.79 67.15 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 123.935 0.894 . . . . 75.78 109.002 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -65.66 -22.03 58.22 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 N-CA-C 115.965 1.486 . . . . 67.16 115.965 -170.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -102.01 12.81 36.29 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.247 1.203 . . . . 57.66 114.247 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' MSE . . . . . . . . . . . . . 31.4 ttp -71.57 131.34 43.1 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 109.153 -0.684 . . . . 72.86 109.153 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 50.5 p -133.77 154.63 50.84 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.496 0.718 . . . . 48.98 109.953 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.74 132.82 55.68 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 123.649 0.78 . . . . 45.9 109.46 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -119.8 132.12 55.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.453 -0.573 . . . . 45.14 109.453 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 99.6 t -78.24 121.52 31.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 109.337 -0.616 . . . . 39.97 109.337 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -98.15 -37.9 9.53 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.636 0.774 . . . . 52.84 112.524 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -143.83 146.06 32.79 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.015 0.926 . . . . 46.63 109.645 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 12.6 tt -143.19 132.93 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 108.332 -0.988 . . . . 48.21 108.332 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.67 142.58 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 108.395 -0.965 . . . . 57.84 108.395 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -135.33 136.65 41.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.812 -0.631 . . . . 59.13 110.04 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -146.4 108.13 4.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 105.435 -2.061 . . . . 54.08 105.435 171.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.97 -125.08 24.52 Favored Glycine 0 CA--C 1.508 -0.387 0 O-C-N 123.503 0.502 . . . . 52.71 113.737 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 p-10 -93.29 3.42 55.67 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.702 1.001 . . . . 53.81 113.702 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 28.7 mt -102.19 133.87 46.37 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.091 0.556 . . . . 49.61 111.047 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.42 125.4 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 N-CA-C 107.726 -1.213 . . . . 45.3 107.726 175.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.3 145.6 34.17 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.554 -0.906 . . . . 42.75 108.554 169.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 18.6 p -138.78 143.61 39.03 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.866 -0.606 . . . . 45.83 111.534 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -107.48 124.23 49.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 106.292 -1.744 . . . . 42.46 106.292 166.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 81.2 m -120.24 159.29 25.25 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.309 0.575 . . . . 46.97 110.035 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -115.02 123.56 70.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.469 -1.308 . . . . 50.27 107.469 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.18 122.08 34.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.119 -1.438 . . . . 44.01 107.119 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 56.6 mtt85 -119.92 138.14 53.62 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.321 0.648 . . . . 67.32 109.664 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.35 -178.58 39.14 Favored Glycine 0 C--O 1.231 -0.034 0 N-CA-C 111.174 -0.77 . . . . 61.96 111.174 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 34.5 p -121.95 143.31 49.54 Favored 'General case' 0 CA--C 1.509 -0.612 0 O-C-N 124.319 0.658 . . . . 71.78 110.833 166.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -112.46 116.15 29.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.726 -0.842 . . . . 98.87 108.726 164.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 88.5 p 47.86 51.7 13.92 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 124.082 0.864 . . . . 99.01 111.797 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.29 8.59 70.79 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 118.402 2.121 . . . . 88.67 118.402 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -110.96 118.74 47.56 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-N 117.86 0.83 . . . . 82.86 109.108 176.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -76.94 150.2 29.84 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.051 1.167 . . . . 72.06 113.494 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -136.66 152.71 50.71 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.361 0.874 . . . . 64.53 113.361 173.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -132.23 119.3 20.65 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.796 1.238 . . . . 74.25 108.516 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' MSE . . . . . . . . . . . . . 6.5 ttp -127.5 134.44 49.8 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 120.867 0.365 . . . . 59.82 110.492 -177.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 75.5 m -77.73 142.15 38.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.834 -0.621 . . . . 46.69 109.33 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' MSE . . . . . . . . . . . . . 4.3 mtp -128.73 138.86 52.35 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.284 -1.006 . . . . 76.8 108.284 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -121.15 135.06 55.23 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.728 -1.212 . . . . 43.97 107.728 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -136.6 151.49 49.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.799 -0.815 . . . . 42.41 108.799 -173.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' MSE . . . . . . . . . . . . . 20.2 tpp -139.2 130.92 27.43 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.623 -1.621 . . . . 64.87 106.623 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 11.0 m -134.26 141.22 46.91 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.977 -0.556 . . . . 50.44 110.788 -173.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -104.89 129.55 53.23 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 106.687 -1.597 . . . . 55.87 106.687 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 80.5 t -117.98 135.45 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.18 0.592 . . . . 52.08 109.686 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -141.0 126.27 18.55 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.706 -1.22 . . . . 61.45 107.706 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 52.94 39.71 29.76 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.324 0.861 . . . . 87.12 113.324 -175.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 68.11 22.68 74.41 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 116.362 1.305 . . . . 58.97 116.362 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -132.21 142.81 49.56 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 117.433 0.616 . . . . 59.58 111.723 174.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 92.3 mt -69.22 124.39 24.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.195 -1.039 . . . . 57.54 108.195 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 34.7 m -111.93 -19.28 7.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 N-CA-C 113.388 0.884 . . . . 45.62 113.388 173.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -148.79 143.98 26.71 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.149 -0.686 . . . . 64.14 109.149 172.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -150.11 133.91 16.82 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 123.763 0.664 . . . . 44.65 110.448 -175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 25.2 m-90 -120.13 137.92 53.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.2 -1.778 . . . . 53.38 106.2 169.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 11.1 t -144.33 144.83 31.64 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.233 0.333 . . . . 47.08 111.238 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 19.9 mt -142.36 139.53 29.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 107.636 -1.246 . . . . 51.09 107.636 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 43.6 m -115.13 151.11 34.92 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.421 0.688 . . . . 46.81 111.525 177.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -85.58 69.93 10.7 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 115.135 -0.939 . . . . 46.07 110.562 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -61.65 -37.17 83.05 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.375 1.25 . . . . 62.72 114.375 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 84.7 t -66.13 -39.82 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 111.411 0.152 . . . . 64.75 111.411 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 50.0 m -62.33 -40.14 95.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.45 0.167 . . . . 61.04 111.45 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -65.8 -44.41 85.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 112.062 0.393 . . . . 101.97 112.062 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.98 -39.58 90.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.44 0.462 . . . . 75.73 111.616 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.53 89.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.849 0.685 . . . . 76.6 112.849 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.09 -30.31 69.46 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.875 1.065 . . . . 79.03 113.875 178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 81.0 mt -93.11 -66.61 0.91 Allowed 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.128 0.788 . . . . 85.69 113.128 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.702 0 N-CA-C 110.951 -0.86 . . . . 90.16 110.951 -169.915 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.176 0 N-CA-C 112.89 0.7 . . . . 79.53 112.89 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.3 -40.05 71.98 Favored 'Trans proline' 0 C--N 1.357 1.0 0 N-CA-C 114.069 0.757 . . . . 70.61 114.069 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.6 m -52.56 -41.82 63.91 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.763 1.023 . . . . 73.53 113.763 171.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -67.51 -42.52 82.67 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.503 0.502 . . . . 85.51 112.093 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 84.8 m -53.81 -45.17 70.71 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.481 0.549 . . . . 62.65 112.481 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 46.7 mm -75.38 -40.07 42.08 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 CA-C-N 115.924 -0.58 . . . . 58.3 110.537 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.43 91.19 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.647 -0.421 . . . . 62.2 110.939 172.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.18 -34.27 87.42 Favored Glycine 0 N--CA 1.474 1.191 0 N-CA-C 115.33 0.892 . . . . 59.27 115.33 174.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.2 tp -62.32 -49.48 75.46 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.581 0.586 . . . . 63.17 112.581 177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -69.37 -36.23 76.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 118.943 -0.551 . . . . 71.45 112.351 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -54.83 -49.81 70.14 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 110.019 -0.363 . . . . 71.35 110.019 168.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.28 -38.39 90.13 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.652 0.982 . . . . 55.81 113.652 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -62.15 -45.44 93.43 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 111.754 0.279 . . . . 52.46 111.754 171.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -59.64 -43.14 93.98 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 112.821 0.674 . . . . 55.5 112.821 178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 97.0 p -80.59 -10.02 59.75 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.048 1.499 . . . . 64.58 115.048 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 73.31 32.22 60.34 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 118.103 0.41 . . . . 62.51 112.441 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -94.18 85.95 4.81 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 123.08 0.552 . . . . 62.7 110.075 -170.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.0 mt -59.66 -37.26 78.24 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 114.392 1.256 . . . . 73.06 114.392 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . . . -63.08 -46.64 86.46 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.231 0.332 . . . . 59.84 111.467 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.2 m -67.3 -39.4 85.93 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.397 -0.365 . . . . 58.67 111.42 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 mt -56.4 -46.43 80.15 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.584 0.23 . . . . 51.75 111.259 175.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -70.63 -22.04 62.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 115.065 1.505 . . . . 60.25 115.065 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -74.55 -42.31 59.03 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.142 0.423 . . . . 72.2 112.142 168.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 91.9 mt -82.25 -18.13 43.56 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.944 1.461 . . . . 55.04 114.944 -173.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.0 mt -116.26 124.45 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 N-CA-C 109.093 -0.706 . . . . 45.03 109.093 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.7 98.03 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 109.439 -0.578 . . . . 47.39 109.439 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -55.61 -32.65 84.1 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 121.418 1.412 . . . . 44.91 114.612 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -101.21 18.57 19.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.325 0.65 . . . . 57.06 112.124 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.63 146.84 34.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.457 -0.572 . . . . 39.99 109.457 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.8 t -96.9 107.54 20.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 108.245 -1.02 . . . . 40.68 108.245 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.0 mm -107.64 112.39 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.011 -0.366 . . . . 36.64 110.011 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -95.73 100.07 11.83 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.934 -0.765 . . . . 46.86 108.934 179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.9 mt -94.04 156.97 38.58 Favored Pre-proline 0 N--CA 1.435 -1.204 0 N-CA-C 108.264 -1.013 . . . . 50.91 108.264 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -73.63 163.83 36.4 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 O-C-N 122.856 0.924 . . . . 46.29 112.505 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -55.25 -28.58 50.36 Favored Glycine 0 N--CA 1.467 0.735 0 N-CA-C 115.304 0.882 . . . . 55.89 115.304 -179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -57.8 -32.04 67.17 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 117.715 0.757 . . . . 74.26 113.021 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.48 -1.37 50.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.611 0.967 . . . . 65.12 113.611 174.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.85 164.77 38.74 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-O 123.301 1.5 . . . . 72.02 111.613 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -155.8 169.56 24.11 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.018 -1.091 . . . . 82.44 108.76 -162.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.97 -41.68 88.1 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.946 0.721 . . . . 66.78 112.946 173.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -85.2 -26.68 26.6 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.552 1.316 . . . . 81.96 114.552 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -122.55 91.79 49.28 Favored Pre-proline 0 N--CA 1.475 0.783 0 C-N-CA 123.381 0.672 . . . . 61.38 110.399 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -64.06 153.2 77.48 Favored 'Trans proline' 0 C--N 1.349 0.605 0 O-C-N 123.312 1.164 . . . . 69.47 113.208 -176.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.76 139.97 48.0 Favored 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 122.307 2.005 . . . . 74.65 113.775 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 78.75 -0.6 76.73 Favored Glycine 0 N--CA 1.468 0.78 0 N-CA-C 116.72 1.448 . . . . 60.87 116.72 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.8 m -83.59 124.22 75.62 Favored Pre-proline 0 N--CA 1.476 0.833 0 CA-C-N 119.0 1.4 . . . . 59.52 109.264 170.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -65.21 150.34 87.66 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 120.484 0.79 . . . . 44.98 112.861 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -109.48 167.23 10.28 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.47 -0.937 . . . . 51.93 108.47 174.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -93.28 -177.89 4.59 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 109.15 -0.685 . . . . 43.08 109.15 165.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.6 ttp180 -54.71 -52.52 62.19 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 113.914 1.079 . . . . 47.15 113.914 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -66.97 -28.22 68.09 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.623 0.601 . . . . 50.54 112.623 -175.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.39 -44.69 94.99 Favored Glycine 0 N--CA 1.467 0.713 0 N-CA-C 110.831 -0.908 . . . . 43.34 110.831 170.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -62.87 -49.69 73.85 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 111.906 0.335 . . . . 43.47 111.906 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.8 mt -61.35 -34.47 75.35 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.007 -0.521 . . . . 47.95 112.394 178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.81 -44.39 95.96 Favored Glycine 0 N--CA 1.48 1.577 0 N-CA-C 115.529 0.972 . . . . 46.62 115.529 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 47.1 t -68.3 -41.69 83.89 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 121.498 0.666 . . . . 48.18 110.647 176.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.86 -41.06 99.22 Favored 'General case' 0 C--O 1.202 -1.432 0 CA-C-N 115.877 -0.601 . . . . 66.0 112.037 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.32 -37.99 85.26 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 119.714 1.143 . . . . 71.03 112.884 177.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -61.85 -49.6 75.62 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.35 0.523 . . . . 55.71 110.889 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 91.1 m -58.92 -36.03 74.06 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 113.365 0.876 . . . . 55.12 113.365 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . . . -66.47 -45.33 80.06 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 122.633 1.206 . . . . 55.4 111.062 176.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.79 -32.82 74.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.344 -0.844 . . . . 54.15 110.819 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -77.28 -35.88 54.78 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 114.479 1.288 . . . . 62.56 114.479 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -126.02 76.67 71.57 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.416 -0.957 . . . . 62.86 108.416 176.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -64.48 -22.27 65.55 Favored 'Trans proline' 0 C--O 1.247 0.929 0 N-CA-C 116.47 1.681 . . . . 60.35 116.47 -171.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -100.25 7.52 44.39 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.481 1.66 . . . . 77.74 115.481 177.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MSE . . . . . . . . . . . . . 60.2 ttp -71.38 135.05 47.1 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 108.56 -0.904 . . . . 79.16 108.56 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 66.3 p -127.28 153.19 46.46 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.071 -0.968 . . . . 50.9 110.293 167.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.98 127.3 55.9 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.416 -0.957 . . . . 55.46 108.416 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.3 m -119.43 129.42 54.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.01 -0.737 . . . . 51.02 109.01 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.3 t -75.85 119.88 24.65 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 N-CA-C 109.389 -0.597 . . . . 46.08 109.389 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -97.89 -37.59 9.76 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.757 0.823 . . . . 62.64 113.049 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -142.59 142.25 32.11 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 107.788 -1.19 . . . . 59.96 107.788 178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 13.0 tt -141.55 132.18 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 N-CA-C 107.512 -1.292 . . . . 54.55 107.512 -178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 18.7 m -129.29 141.26 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 108.07 -1.085 . . . . 49.86 108.07 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -136.77 136.57 39.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.166 0.586 . . . . 72.45 109.791 -174.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.9 m -147.97 108.81 4.21 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.432 -2.062 . . . . 61.52 105.432 171.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.67 -125.62 23.21 Favored Glycine 0 C--O 1.237 0.331 0 O-C-N 123.498 0.499 . . . . 59.78 112.055 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -92.57 2.95 56.41 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.115 1.154 . . . . 79.18 114.115 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.42 133.49 45.96 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 122.858 0.463 . . . . 63.47 111.461 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -128.89 125.12 62.47 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 N-CA-C 108.059 -1.089 . . . . 50.07 108.059 175.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.8 30.62 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.896 -0.779 . . . . 42.69 108.896 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.7 p -138.45 143.78 39.81 Favored 'General case' 0 C--O 1.25 1.081 0 O-C-N 123.72 0.637 . . . . 48.25 112.101 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 70.7 ttp85 -106.61 124.91 50.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 106.197 -1.779 . . . . 49.64 106.197 165.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 68.4 m -119.95 156.52 30.66 Favored 'General case' 0 N--CA 1.443 -0.794 0 O-C-N 123.871 0.732 . . . . 51.05 110.217 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 88.6 t -114.95 125.14 72.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.709 -1.219 . . . . 52.52 107.709 168.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.77 121.06 33.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.278 -1.379 . . . . 56.1 107.278 173.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 42.7 mtt85 -123.16 143.24 50.14 Favored 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 124.172 0.92 . . . . 69.71 110.489 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -174.31 173.87 46.2 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.91 -0.876 . . . . 68.21 110.91 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -125.78 115.37 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 103.009 -2.96 . . . . 81.69 103.009 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -112.56 116.88 30.92 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 109.771 -0.455 . . . . 87.8 109.771 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.0 t 46.99 51.89 12.34 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 124.155 0.91 . . . . 79.21 111.638 -173.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.03 5.55 65.72 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 118.71 2.244 . . . . 73.36 118.71 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . . . -111.09 119.28 46.13 Favored Pre-proline 0 CA--C 1.537 0.474 0 CA-C-N 118.64 1.22 . . . . 75.97 110.173 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -76.61 147.52 28.24 Favored 'Trans proline' 0 N--CA 1.48 0.721 0 N-CA-C 113.45 0.519 . . . . 76.41 113.45 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -142.67 149.49 38.95 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.882 0.697 . . . . 64.73 112.882 178.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -138.03 114.43 10.32 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 125.549 1.54 . . . . 82.38 108.068 177.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' MSE . . . . . . . . . . . . . 3.3 ptt? -127.47 135.47 50.44 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.702 0.763 . . . . 75.81 110.527 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 99.9 m -76.0 142.04 42.0 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.157 -0.929 . . . . 61.58 110.025 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' MSE . . . . . . . . . . . . . 4.1 mtp -129.97 140.58 50.89 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.321 -0.992 . . . . 97.37 108.321 170.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 93.6 mt -121.49 135.48 55.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 107.19 -1.411 . . . . 48.15 107.19 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -136.35 154.28 50.89 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 109.391 -0.596 . . . . 46.24 109.391 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' MSE . . . . . . . . . . . . . 36.4 ttm -143.75 132.02 21.98 Favored 'General case' 0 CA--C 1.487 -1.449 0 N-CA-C 106.712 -1.588 . . . . 76.32 106.712 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.3 m -132.3 142.2 49.27 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.241 -0.436 . . . . 47.29 110.896 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -102.43 130.09 49.12 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 106.58 -1.637 . . . . 79.42 106.58 167.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.02 133.93 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.402 0.681 . . . . 54.33 109.256 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . . . -139.31 125.7 20.33 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 107.858 -1.164 . . . . 61.12 107.858 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 54.45 40.94 32.18 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.561 0.696 . . . . 76.68 112.762 -177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.5 21.77 72.77 Favored Glycine 0 CA--C 1.521 0.412 0 N-CA-C 116.627 1.411 . . . . 56.46 116.627 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 41.2 mtp180 -131.95 144.44 50.82 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.858 0.829 . . . . 61.65 110.973 175.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 83.2 mt -70.02 123.6 24.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.369 -0.974 . . . . 52.22 108.369 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 34.9 m -112.32 -18.1 7.89 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 113.376 0.88 . . . . 49.62 113.376 175.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -149.14 144.32 26.54 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.848 -0.797 . . . . 52.24 108.848 172.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -149.37 134.27 17.95 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.325 0.65 . . . . 41.42 110.581 -176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 24.9 m-90 -119.74 137.0 54.21 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 106.709 -1.589 . . . . 47.69 106.709 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 10.2 t -144.2 144.05 31.35 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.273 0.358 . . . . 46.13 110.869 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.4 mt -142.84 138.1 27.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 107.315 -1.365 . . . . 55.08 107.315 170.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 62.1 m -116.49 152.01 34.93 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.941 -0.572 . . . . 64.97 110.644 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -85.68 69.94 10.67 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.523 -0.762 . . . . 70.38 110.275 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -63.04 -35.86 81.65 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 114.068 1.136 . . . . 73.97 114.068 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.1 t -66.3 -40.12 85.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 117.614 0.188 . . . . 75.5 111.199 -178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 48.1 m -61.79 -40.53 95.51 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 123.048 0.217 . . . . 78.25 111.357 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' MSE . . . . . . . . . . . . . 22.4 ttp -65.99 -44.4 84.95 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 112.272 0.471 . . . . 108.9 112.272 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . . . -60.65 -39.89 89.98 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 123.204 0.315 . . . . 96.77 111.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.19 -40.48 90.2 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.585 0.587 . . . . 93.49 112.585 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -68.34 -30.06 68.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.792 1.034 . . . . 89.15 113.792 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.3 mt -91.21 -32.86 15.62 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.234 0.828 . . . . 92.22 113.234 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.619 0 C-N-CA 123.672 0.653 . . . . 88.35 111.895 -175.772 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.38 0.882 . . . . 90.58 113.38 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -72.9 -45.14 8.71 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 113.781 1.03 . . . . 92.48 113.781 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -59.07 -40.1 73.74 Favored 'Trans proline' 0 C--N 1.354 0.825 0 N-CA-C 113.96 0.715 . . . . 64.36 113.96 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 54.9 m -53.49 -40.93 65.76 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 113.866 1.061 . . . . 58.54 113.866 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -68.75 -41.94 78.2 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 122.482 0.313 . . . . 60.83 111.349 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 85.7 m -53.85 -45.26 70.88 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.744 0.646 . . . . 51.44 112.744 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 50.1 mm -75.24 -40.2 43.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 110.068 -0.345 . . . . 55.39 110.068 -175.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.94 -43.44 91.22 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 121.096 -0.242 . . . . 45.55 110.86 172.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.89 -34.37 88.56 Favored Glycine 0 N--CA 1.465 0.628 0 N-CA-C 115.245 0.858 . . . . 44.75 115.245 174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.2 -49.83 74.22 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 112.475 0.546 . . . . 50.89 112.475 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -68.65 -36.96 79.26 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.474 0.484 . . . . 56.26 112.008 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 8.3 tm-20 -55.31 -49.32 72.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.432 0.458 . . . . 69.4 110.694 169.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.27 90.3 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 113.673 0.99 . . . . 45.95 113.673 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -61.89 -45.19 94.83 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.163 0.431 . . . . 47.65 112.163 171.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.83 -42.81 98.47 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.2 0.313 . . . . 46.62 111.22 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.7 m -80.04 -11.42 59.78 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.122 1.527 . . . . 52.72 115.122 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.88 68.59 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 118.505 0.593 . . . . 51.01 112.077 -174.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -92.33 86.6 5.75 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.071 0.548 . . . . 55.4 109.728 -172.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 33.9 mt -58.74 -38.7 78.97 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 114.814 1.413 . . . . 66.08 114.814 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -62.63 -47.63 82.92 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.73 0.644 . . . . 78.17 111.013 -178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 93.6 m -67.2 -39.73 86.38 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 123.716 0.635 . . . . 52.46 111.667 178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.4 mt -55.82 -47.3 77.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.617 0.246 . . . . 49.73 111.292 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -71.76 -21.72 61.7 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 114.745 1.387 . . . . 52.22 114.745 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -73.78 -42.86 60.42 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.289 0.477 . . . . 73.1 112.289 167.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 90.8 mt -82.42 -17.84 44.0 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 115.149 1.537 . . . . 47.61 115.149 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ILE . . . . . . . . . . . . . 19.0 mt -115.47 125.99 72.87 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 N-CA-C 109.245 -0.65 . . . . 48.97 109.245 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.52 141.8 98.3 Favored Pre-proline 0 N--CA 1.471 0.594 0 N-CA-C 109.317 -0.623 . . . . 50.07 109.317 174.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -55.24 -33.05 83.32 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 121.427 1.418 . . . . 51.87 115.214 177.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ASP . . . . . . . . . . . . . 24.4 p-10 -102.34 19.63 18.42 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.426 0.69 . . . . 78.98 111.876 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.53 146.91 38.82 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.409 -0.589 . . . . 52.48 109.409 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 95.5 t -96.99 107.97 20.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 N-CA-C 108.636 -0.876 . . . . 52.02 108.636 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 31.0 mm -108.09 113.42 43.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.917 0.389 . . . . 47.58 110.175 -172.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -95.77 101.89 13.62 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.094 -0.706 . . . . 51.73 109.094 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.502 HD12 ' HD2' ' B' ' 54' ' ' ARG . 84.3 mt -93.75 157.74 37.69 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 109.323 -0.621 . . . . 57.28 109.323 177.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.71 164.04 34.51 Favored 'Trans proline' 0 C--O 1.239 0.558 0 O-C-N 122.788 0.888 . . . . 63.8 112.045 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.23 -28.94 55.56 Favored Glycine 0 C--N 1.333 0.365 0 N-CA-C 115.878 1.111 . . . . 79.52 115.878 -174.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 64.7 p -57.83 -31.93 67.11 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 112.914 0.709 . . . . 90.92 112.914 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.94 -4.66 53.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.247 1.203 . . . . 92.59 114.247 173.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.99 148.96 50.05 Favored Glycine 0 N--CA 1.467 0.727 0 CA-C-O 119.16 -0.8 . . . . 108.23 112.998 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . 0.261 0.6 OUTLIER -156.63 -168.61 2.74 Favored 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 0.724 . . . . 125.37 110.419 -176.117 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.22 99.22 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.623 0.971 . . . . 130.47 113.623 -167.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -87.97 -27.14 22.28 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.03 0.752 . . . . 135.41 113.03 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -121.62 91.57 48.52 Favored Pre-proline 0 C--N 1.344 0.332 0 C-N-CA 122.54 0.336 . . . . 119.94 110.868 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -58.68 154.14 44.98 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 120.74 0.96 . . . . 113.93 112.879 171.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -37.99 -44.88 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 122.177 3.876 . . . . 107.44 122.177 -172.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . -78.07 -2.46 82.73 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 121.46 1.936 . . . . 93.11 117.128 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 11.4 m -86.4 123.81 70.75 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 123.98 0.912 . . . . 87.75 109.874 -165.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.86 151.3 84.58 Favored 'Trans proline' 0 C--N 1.353 0.786 0 O-C-N 122.448 0.709 . . . . 72.29 113.231 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.502 ' HD2' HD12 ' B' ' 39' ' ' LEU . 35.7 mtt-85 -108.85 168.18 9.54 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.37 -0.604 . . . . 84.81 109.37 170.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASP . . . . . . . . . . . . . 45.0 p30 -94.19 -176.63 4.04 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 123.711 0.632 . . . . 61.25 109.719 166.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -51.94 -53.93 35.46 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.39 1.256 . . . . 53.55 114.39 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -68.7 -27.36 65.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.414 -0.812 . . . . 57.11 112.308 -174.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -64.59 -43.34 96.63 Favored Glycine 0 C--O 1.213 -1.213 0 N-CA-C 110.788 -0.925 . . . . 48.49 110.788 169.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -63.78 -49.59 72.35 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 111.761 0.282 . . . . 50.56 111.761 176.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 80.8 mt -61.44 -34.24 75.08 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.143 0.423 . . . . 52.16 112.143 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.45 -43.5 97.43 Favored Glycine 0 N--CA 1.476 1.302 0 N-CA-C 115.577 0.991 . . . . 49.29 115.577 170.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 50.0 t -67.63 -41.27 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 122.343 -0.504 . . . . 52.78 110.725 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' TRP . . . . . . . . . . . . . 26.9 t90 -57.92 -48.13 80.8 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 116.392 -0.367 . . . . 52.0 111.965 175.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -62.53 -37.41 85.99 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.038 1.125 . . . . 62.57 114.038 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -61.79 -49.17 77.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.584 -0.28 . . . . 82.3 111.477 175.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.4 m -61.46 -36.9 81.7 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 112.837 0.68 . . . . 70.97 112.837 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . . . -65.8 -36.08 82.5 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 117.528 -1.225 . . . . 75.19 111.947 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.12 -36.36 70.56 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 114.273 1.212 . . . . 73.67 114.273 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -80.66 -35.49 33.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.981 1.104 . . . . 82.63 113.981 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -125.02 75.79 67.15 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 123.935 0.894 . . . . 75.78 109.002 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -65.66 -22.03 58.22 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 N-CA-C 115.965 1.486 . . . . 67.16 115.965 -170.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -102.01 12.81 36.29 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.247 1.203 . . . . 57.66 114.247 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' MSE . . . . . . . . . . . . . 31.4 ttp -71.57 131.34 43.1 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 109.153 -0.684 . . . . 72.86 109.153 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 50.5 p -133.77 154.63 50.84 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 123.496 0.718 . . . . 48.98 109.953 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -113.74 132.82 55.68 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 123.649 0.78 . . . . 45.9 109.46 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 89.6 m -119.8 132.12 55.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.453 -0.573 . . . . 45.14 109.453 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 99.6 t -78.24 121.52 31.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 109.337 -0.616 . . . . 39.97 109.337 -179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -98.15 -37.9 9.53 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.636 0.774 . . . . 52.84 112.524 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -143.83 146.06 32.79 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.015 0.926 . . . . 46.63 109.645 177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 12.6 tt -143.19 132.93 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 N-CA-C 108.332 -0.988 . . . . 48.21 108.332 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.67 142.58 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 108.395 -0.965 . . . . 57.84 108.395 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -135.33 136.65 41.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.812 -0.631 . . . . 59.13 110.04 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -146.4 108.13 4.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 105.435 -2.061 . . . . 54.08 105.435 171.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.97 -125.08 24.52 Favored Glycine 0 CA--C 1.508 -0.387 0 O-C-N 123.503 0.502 . . . . 52.71 113.737 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 p-10 -93.29 3.42 55.67 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.702 1.001 . . . . 53.81 113.702 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 28.7 mt -102.19 133.87 46.37 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 123.091 0.556 . . . . 49.61 111.047 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.42 125.4 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 N-CA-C 107.726 -1.213 . . . . 45.3 107.726 175.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -108.3 145.6 34.17 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.554 -0.906 . . . . 42.75 108.554 169.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 18.6 p -138.78 143.61 39.03 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 115.866 -0.606 . . . . 45.83 111.534 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -107.48 124.23 49.58 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 106.292 -1.744 . . . . 42.46 106.292 166.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' CYS . . . . . . . . . . . . . 81.2 m -120.24 159.29 25.25 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.309 0.575 . . . . 46.97 110.035 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -115.02 123.56 70.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.469 -1.308 . . . . 50.27 107.469 169.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -92.18 122.08 34.32 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 107.119 -1.438 . . . . 44.01 107.119 174.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 56.6 mtt85 -119.92 138.14 53.62 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.321 0.648 . . . . 67.32 109.664 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . -166.35 -178.58 39.14 Favored Glycine 0 C--O 1.231 -0.034 0 N-CA-C 111.174 -0.77 . . . . 61.96 111.174 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 34.5 p -121.95 143.31 49.54 Favored 'General case' 0 CA--C 1.509 -0.612 0 O-C-N 124.319 0.658 . . . . 71.78 110.833 166.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 43.8 t60 -112.46 116.15 29.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.726 -0.842 . . . . 98.87 108.726 164.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 88.5 p 47.86 51.7 13.92 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 124.082 0.864 . . . . 99.01 111.797 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.29 8.59 70.79 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 118.402 2.121 . . . . 88.67 118.402 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . . . -110.96 118.74 47.56 Favored Pre-proline 0 CA--C 1.548 0.899 0 CA-C-N 117.86 0.83 . . . . 82.86 109.108 176.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -76.94 150.2 29.84 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 121.051 1.167 . . . . 72.06 113.494 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -136.66 152.71 50.71 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 113.361 0.874 . . . . 64.53 113.361 173.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -132.23 119.3 20.65 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.796 1.238 . . . . 74.25 108.516 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' MSE . . . . . . . . . . . . . 6.5 ttp -127.5 134.44 49.8 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-O 120.867 0.365 . . . . 59.82 110.492 -177.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 75.5 m -77.73 142.15 38.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.834 -0.621 . . . . 46.69 109.33 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' MSE . . . . . . . . . . . . . 4.3 mtp -128.73 138.86 52.35 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.284 -1.006 . . . . 76.8 108.284 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 94.9 mt -121.15 135.06 55.23 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 107.728 -1.212 . . . . 43.97 107.728 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -136.6 151.49 49.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.799 -0.815 . . . . 42.41 108.799 -173.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' MSE . . . . . . . . . . . . . 20.2 tpp -139.2 130.92 27.43 Favored 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.623 -1.621 . . . . 64.87 106.623 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 11.0 m -134.26 141.22 46.91 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.977 -0.556 . . . . 50.44 110.788 -173.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -104.89 129.55 53.23 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 106.687 -1.597 . . . . 55.87 106.687 169.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 80.5 t -117.98 135.45 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.18 0.592 . . . . 52.08 109.686 -179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -141.0 126.27 18.55 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.706 -1.22 . . . . 61.45 107.706 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 52.94 39.71 29.76 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.324 0.861 . . . . 87.12 113.324 -175.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 68.11 22.68 74.41 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 116.362 1.305 . . . . 58.97 116.362 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 43.2 mtp180 -132.21 142.81 49.56 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 117.433 0.616 . . . . 59.58 111.723 174.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ILE . . . . . . . . . . . . . 92.3 mt -69.22 124.39 24.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.195 -1.039 . . . . 57.54 108.195 173.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 34.7 m -111.93 -19.28 7.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.456 0 N-CA-C 113.388 0.884 . . . . 45.62 113.388 173.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -148.79 143.98 26.71 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.149 -0.686 . . . . 64.14 109.149 172.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -150.11 133.91 16.82 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 123.763 0.664 . . . . 44.65 110.448 -175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' TRP . . . . . . . . . . . . . 25.2 m-90 -120.13 137.92 53.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.2 -1.778 . . . . 53.38 106.2 169.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' THR . . . . . . . . . . . . . 11.1 t -144.33 144.83 31.64 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.233 0.333 . . . . 47.08 111.238 174.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 19.9 mt -142.36 139.53 29.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 107.636 -1.246 . . . . 51.09 107.636 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 43.6 m -115.13 151.11 34.92 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.421 0.688 . . . . 46.81 111.525 177.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -85.58 69.93 10.7 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 115.135 -0.939 . . . . 46.07 110.562 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -61.65 -37.17 83.05 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.375 1.25 . . . . 62.72 114.375 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 84.7 t -66.13 -39.82 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 111.411 0.152 . . . . 64.75 111.411 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 50.0 m -62.33 -40.14 95.36 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 111.45 0.167 . . . . 61.04 111.45 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -65.8 -44.41 85.8 Favored 'General case' 0 CA--C 1.506 -0.717 0 N-CA-C 112.062 0.393 . . . . 101.97 112.062 177.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' LEU . . . . . . . . . . . . . 7.4 mt -60.98 -39.58 90.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 123.44 0.462 . . . . 75.73 111.616 177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.53 89.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.849 0.685 . . . . 76.6 112.849 178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.09 -30.31 69.46 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.875 1.065 . . . . 79.03 113.875 178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 81.0 mt -93.11 -66.61 0.91 Allowed 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.128 0.788 . . . . 85.69 113.128 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.702 0 N-CA-C 110.951 -0.86 . . . . 90.16 110.951 -169.915 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_