data_1vwb_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1vwb _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 106.526 -1.657 . . . . 45.969999999999999 106.526 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 26.64 -84.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 119.348 3.092 . . . . 50.380000000000003 119.348 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.93 79.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.07 0.85 . . . . 39.450000000000003 109.737 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.48 -29.19 74.43 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-N 119.584 1.084 . . . . 35.409999999999997 113.175 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -85.24 -38.45 13.11 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 CA-C-N 119.035 1.417 . . . . 22.52 112.054 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 47.9 m -58.39 128.47 37.31 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 108.749 -0.834 . . . . 19.260000000000002 108.749 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 145.83 -169.44 27.28 Favored Glycine 0 C--N 1.336 0.574 0 CA-C-N 119.492 1.042 . . . . 18.649999999999999 112.245 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 32.8 m -107.69 132.37 53.42 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.608 1.194 . . . . 17.620000000000001 107.87 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -125.61 150.37 47.59 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.657 -1.156 . . . . 17.629999999999999 109.612 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -130.29 138.91 50.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 105.805 -1.924 . . . . 21.390000000000001 105.805 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -101.22 -177.21 3.38 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 117.903 -1.519 . . . . 23.079999999999998 109.086 169.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.6 -28.63 69.27 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.379 1.472 . . . . 42.920000000000002 111.311 -174.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 mp -78.88 -17.82 54.94 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 114.178 1.177 . . . . 53.560000000000002 114.178 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.8 2.64 39.87 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 120.305 1.411 . . . . 40.710000000000001 114.279 -171.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -78.03 148.09 34.49 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 120.339 2.07 . . . . 27.609999999999999 111.678 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.5 m -116.95 132.69 56.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.837 1.255 . . . . 29.09 111.647 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -129.33 137.51 51.04 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 121.148 1.795 . . . . 18.59 108.452 164.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 70.1 mt -110.81 121.43 63.51 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 112.202 -2.272 . . . . 24.239999999999998 107.524 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 p -134.72 140.88 44.68 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.142 0 O-C-N 121.203 -0.936 . . . . 17.289999999999999 111.176 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 48.3 m -107.11 126.15 51.99 Favored 'General case' 0 C--O 1.254 1.31 0 C-N-CA 125.622 1.569 . . . . 24.27 109.55 166.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -98.48 114.65 27.12 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 109.206 -0.664 . . . . 23.629999999999999 109.206 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -85.08 160.08 34.69 Favored Glycine 0 N--CA 1.443 -0.881 0 O-C-N 118.596 -2.565 . . . . 28.010000000000002 108.758 -171.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.43 68.43 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.534 0.568 . . . . 36.93 112.534 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -99.94 29.92 3.97 Favored 'General case' 0 C--O 1.243 0.755 0 N-CA-C 117.147 2.277 . . . . 35.130000000000003 117.147 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.28 2.42 77.08 Favored Glycine 0 C--N 1.341 0.81 0 O-C-N 125.5 1.75 . . . . 20.280000000000001 113.344 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.18 139.49 37.97 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.598 2.199 . . . . 17.170000000000002 116.068 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -113.18 134.05 54.76 Favored 'General case' 0 C--O 1.252 1.231 0 O-C-N 120.078 -1.639 . . . . 16.5 107.817 169.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 p -137.78 146.11 43.19 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 106.389 -1.708 . . . . 16.329999999999998 106.389 179.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.81 -163.02 36.74 Favored Glycine 0 C--N 1.346 1.127 0 CA-C-N 121.801 2.092 . . . . 11.15 112.398 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 62.0 p -136.12 147.35 47.74 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 122.359 1.076 . . . . 22.489999999999998 108.688 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -107.28 140.13 40.67 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 103.924 -2.621 . . . . 38.560000000000002 103.924 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -128.42 116.18 19.35 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 104.543 -2.391 . . . . 59.700000000000003 104.543 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -23.92 64.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.496 1.295 . . . . 65.640000000000001 114.496 172.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.38 143.77 28.22 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 106.687 -1.597 . . . . 72.790000000000006 106.687 174.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -56.18 5.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 N-CA-C 118.182 2.66 . . . . 80.069999999999993 118.182 -170.037 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -170.42 70.35 0.13 Allowed Glycine 0 C--N 1.338 0.673 0 O-C-N 116.656 -3.777 . . . . 75.069999999999993 114.496 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -174.61 129.33 0.33 Allowed 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 119.122 1.461 . . . . 66.510000000000005 112.779 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.39 -27.25 67.71 Favored 'General case' 0 CA--C 1.509 -0.63 0 O-C-N 118.488 -2.633 . . . . 53.240000000000002 114.233 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -69.59 -16.02 63.32 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.247 -0.888 . . . . 69.590000000000003 112.293 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 58.3 p -106.28 5.89 30.15 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.879 -1.055 . . . . 48.270000000000003 112.543 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -99.15 137.2 38.0 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-O 122.154 0.978 . . . . 31.91 110.378 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -131.59 146.9 52.44 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 113.629 -1.623 . . . . 18.16 109.601 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 92.4 t -72.38 138.84 20.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 125.643 1.577 . . . . 17.07 112.286 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 pp -126.77 151.75 47.82 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 122.862 1.315 . . . . 16.289999999999999 109.618 170.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 4.2 t -140.67 150.79 43.96 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 114.029 -1.441 . . . . 20.32 110.533 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -171.73 -168.94 33.97 Favored Glycine 0 CA--C 1.532 1.13 0 O-C-N 120.074 -1.641 . . . . 12.1 111.547 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -141.14 154.5 45.91 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.229 1.011 . . . . 17.329999999999998 108.748 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -145.27 158.25 43.87 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 108.846 -0.798 . . . . 21.350000000000001 108.846 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -70.93 107.77 4.21 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 124.858 1.263 . . . . 15.1 109.406 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 13.4 p -88.43 3.92 48.29 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 112.517 0.562 . . . . 24.030000000000001 112.517 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.98 70.77 49.39 Favored Pre-proline 0 C--O 1.246 0.869 0 O-C-N 118.503 -2.623 . . . . 22.859999999999999 107.415 168.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -70.48 165.2 32.58 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.586 1.524 . . . . 18.329999999999998 112.96 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.19 147.15 50.18 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 118.58 -2.575 . . . . 27.09 113.159 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -80.18 -14.72 58.24 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.093 1.886 . . . . 34.439999999999998 116.093 -171.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -72.31 -177.65 2.23 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 120.962 -1.086 . . . . 44.600000000000001 108.503 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -78.14 47.46 2.89 Favored Glycine 0 CA--C 1.549 2.172 0 CA-C-N 122.179 2.263 . . . . 43.119999999999997 116.297 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.7 m -89.18 154.22 20.32 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 118.202 1.001 . . . . 38.240000000000002 110.054 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.8 163.74 54.29 Favored Glycine 0 C--N 1.345 1.033 0 N-CA-C 110.71 -0.956 . . . . 24.43 110.71 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 54.5 m -95.38 116.22 28.49 Favored 'General case' 0 C--O 1.252 1.201 0 C-N-CA 125.266 1.427 . . . . 20.460000000000001 109.942 172.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.28 140.91 50.5 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.919 -1.738 . . . . 12.800000000000001 111.491 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.7 pp -155.8 168.82 25.96 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.849 0.833 . . . . 16.120000000000001 109.024 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.98 156.98 28.25 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 109.818 -1.313 . . . . 12.02 109.818 173.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' TRP . . . . . . . . . . . . . 45.6 p90 -151.44 162.46 40.9 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.279 1.54 . . . . 14.94 109.83 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 m -122.82 141.24 52.06 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.697 1.599 . . . . 14.300000000000001 110.277 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 74.5 t -124.0 121.94 63.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 106.308 -1.738 . . . . 11.529999999999999 106.308 166.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.71 128.53 36.11 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.513 0.673 . . . . 12.619999999999999 110.562 164.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 88.1 m95 -86.53 63.85 8.21 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 117.667 -3.146 . . . . 15.050000000000001 111.285 -167.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -136.41 131.49 34.23 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 104.959 -2.237 . . . . 25.829999999999998 104.959 174.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.9 p30 -141.1 -165.2 1.91 Allowed 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.406 -1.331 . . . . 18.18 107.406 168.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.16 -16.89 64.0 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 116.79 2.144 . . . . 42.159999999999997 116.79 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -113.5 -17.44 12.21 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 115.808 1.781 . . . . 34.740000000000002 115.808 -173.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt85 -153.62 147.92 25.9 Favored 'General case' 0 C--O 1.263 1.813 0 N-CA-C 104.901 -2.259 . . . . 21.18 104.901 -164.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 53.2 t-20 -138.57 117.83 12.73 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 104.976 -2.231 . . . . 21.489999999999998 104.976 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -99.76 9.49 42.98 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 118.245 -0.883 . . . . 15.029999999999999 112.771 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 48.19 53.98 10.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.84 2.109 . . . . 22.129999999999999 114.546 173.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -163.25 161.2 24.69 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 114.001 -1.454 . . . . 14.99 111.768 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.04 141.17 28.65 Favored 'General case' 0 C--O 1.252 1.224 0 N-CA-C 106.254 -1.758 . . . . 15.640000000000001 106.254 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m -113.15 141.38 46.99 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 121.605 -0.685 . . . . 12.73 110.879 171.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 73.3 p -114.49 133.97 55.36 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 120.632 -1.292 . . . . 11.81 109.347 168.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -105.89 132.47 51.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.522 1.055 . . . . 15.43 109.678 171.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 47.7 t -124.13 129.4 50.78 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 124.904 1.282 . . . . 14.359999999999999 108.508 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.95 -154.44 11.96 Favored Glycine 0 C--O 1.254 1.38 0 O-C-N 119.95 -1.719 . . . . 13.07 112.031 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -150.78 137.62 19.03 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.548 -1.826 . . . . 18.370000000000001 113.004 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -78.17 138.84 38.89 Favored 'General case' 0 C--O 1.249 1.064 0 CA-C-N 112.388 -2.187 . . . . 27.789999999999999 109.787 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 60.4 t -130.2 120.67 49.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 104.921 -2.252 . . . . 29.32 104.921 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.96 -175.44 50.85 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 124.376 2.098 . . . . 33.939999999999998 114.516 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 112.9 -165.37 12.03 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 108.964 -1.654 . . . . 29.809999999999999 108.964 170.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.78 74.8 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 114.236 -0.982 . . . . 29.109999999999999 112.321 -173.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -124.87 73.42 1.28 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 125.357 2.503 . . . . 29.309999999999999 109.398 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.34 137.84 57.84 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-N 109.89 -3.323 . . . . 23.52 111.691 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.8 162.68 41.02 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 119.78 -0.768 . . . . 32.289999999999999 110.746 174.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 84.1 mt -125.02 117.29 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.098 0 N-CA-C 100.707 -3.812 . . . . 17.07 100.707 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -99.1 125.85 44.72 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.498 -1.668 . . . . 26.91 106.498 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 70.0 p -130.76 156.63 44.64 Favored 'General case' 0 C--O 1.26 1.631 0 O-C-N 120.82 -1.175 . . . . 11.16 111.321 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -115.38 151.01 35.45 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 106.223 -1.769 . . . . 24.280000000000001 106.223 159.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 37.9 p-90 -134.68 154.32 51.59 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 119.428 1.013 . . . . 13.630000000000001 113.326 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 46.1 mt -126.34 125.78 42.82 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.401 -1.333 . . . . 15.050000000000001 107.401 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 tp -109.42 112.29 24.32 Favored 'General case' 0 C--O 1.254 1.342 0 N-CA-C 107.628 -1.249 . . . . 16.289999999999999 107.628 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 99.9 m -105.22 129.64 53.55 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 118.59 0.632 . . . . 15.949999999999999 112.244 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 75.5 m -94.76 141.57 28.47 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 118.177 -0.916 . . . . 17.59 112.181 170.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.41 124.61 33.76 Favored Glycine 0 CA--C 1.543 1.783 0 CA-C-N 120.304 1.411 . . . . 20.219999999999999 110.816 168.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 81.5 p -128.2 169.89 13.63 Favored 'General case' 0 C--O 1.249 1.078 0 O-C-N 119.431 -2.217 . . . . 17.370000000000001 105.52 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 41.8 p -75.83 162.65 27.97 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 113.818 -1.537 . . . . 28.850000000000001 107.07 164.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.24 -25.69 67.96 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 116.844 2.164 . . . . 42.149999999999999 116.844 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.45 70.64 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.921 -1.14 . . . . 38.789999999999999 107.921 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -91.79 13.27 18.78 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 117.198 2.296 . . . . 40.869999999999997 117.198 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.85 -26.75 68.46 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 121.08 -1.013 . . . . 31.350000000000001 113.318 -171.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 64.3 p-90 -59.45 -25.29 64.24 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 119.424 -2.047 . . . . 60.039999999999999 115.839 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -101.98 18.37 20.84 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 120.936 -1.103 . . . . 29.940000000000001 109.487 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 62.2 p -74.64 -24.38 58.83 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 116.958 2.207 . . . . 18.010000000000002 116.958 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 77.7 m -130.2 121.56 26.45 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-O 123.227 1.489 . . . . 14.59 111.414 -165.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 11.8 mt -97.5 154.02 17.77 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 113.13 -1.85 . . . . 14.92 111.353 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 9.2 p -132.12 141.52 45.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.271 0 CA-C-N 115.012 -0.995 . . . . 13.5 108.454 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -160.26 -163.79 14.26 Favored Glycine 0 N--CA 1.429 -1.793 0 N-CA-C 109.382 -1.487 . . . . 11.710000000000001 109.382 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -148.21 155.02 40.87 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.711 -1.589 . . . . 30.120000000000001 106.711 -173.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.94 140.02 21.1 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.5 1.52 . . . . 29.289999999999999 108.094 -174.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 85.4 m -114.33 127.09 55.69 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.102 1.761 . . . . 22.16 109.406 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -106.26 138.96 41.52 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.246 1.418 . . . . 19.18 107.522 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 18.7 p -128.17 161.4 29.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.854 0.752 . . . . 20.07 109.13 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.04 -15.46 56.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.722 1.249 . . . . 39.280000000000001 111.942 177.563 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 63.3 t -92.25 121.04 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 CA-C-N 114.28 -1.327 . . . . 44.600000000000001 107.468 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.79 129.42 68.1 Favored Pre-proline 0 C--O 1.236 0.364 0 N-CA-C 105.703 -1.962 . . . . 58.590000000000003 105.703 166.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.235 0.37 0 C-N-CA 123.422 2.748 . . . . 55.170000000000002 117.141 173.609 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 39.009999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 156.41 151.72 0.01 OUTLIER 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.441 2.697 . . . . 45.340000000000003 103.757 . 144.789 -94.315 -108.911 95.352 2.015 103.352 -97.776 39.443 2 2 . 1 . 001 ecloud orig full ' P' P ' 2' ' ' HIS . . . . . . . . . . . . . 38.8 t-80 -76.43 143.3 72.31 Favored Pre-proline 0 C--O 1.239 0.506 0 O-C-N 120.205 -1.559 . . . . 37.859999999999999 109.609 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 3' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -55.79 -16.49 15.61 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 125.11 3.874 . . . . 32.32 116.598 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 4' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.06 -24.59 67.51 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 118.807 -2.433 . . . . 36.759999999999998 109.548 171.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 5' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -115.95 -27.66 6.9 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.915 0.886 . . . . 50.439999999999998 113.333 -170.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 6' ' ' CYS . . . . . . . . . . . . . 1.6 p -133.75 124.38 26.53 Favored 'General case' 0 CA--C 1.506 -0.722 0 CA-C-N 122.408 2.367 . . . . 49.789999999999999 110.207 173.376 39.443 -97.776 -108.911 103.352 2.015 95.352 -94.315 144.789 1 1 . 1 . 001 ecloud orig full ' P' P ' 7' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.629 0 O-C-N 120.9 -1.125 . . . . 50.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 664' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 667' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 106.526 -1.657 . . . . 45.969999999999999 106.526 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 26.64 -84.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 119.348 3.092 . . . . 50.380000000000003 119.348 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.93 79.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.07 0.85 . . . . 39.450000000000003 109.737 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.48 -29.19 74.43 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-N 119.584 1.084 . . . . 35.409999999999997 113.175 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -85.24 -38.45 13.11 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 CA-C-N 119.035 1.417 . . . . 22.52 112.054 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 47.9 m -58.39 128.47 37.31 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 108.749 -0.834 . . . . 19.260000000000002 108.749 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 145.83 -169.44 27.28 Favored Glycine 0 C--N 1.336 0.574 0 CA-C-N 119.492 1.042 . . . . 18.649999999999999 112.245 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 32.8 m -107.69 132.37 53.42 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.608 1.194 . . . . 17.620000000000001 107.87 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -125.61 150.37 47.59 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.657 -1.156 . . . . 17.629999999999999 109.612 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -130.29 138.91 50.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 105.805 -1.924 . . . . 21.390000000000001 105.805 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -101.22 -177.21 3.38 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 117.903 -1.519 . . . . 23.079999999999998 109.086 169.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.6 -28.63 69.27 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.379 1.472 . . . . 42.920000000000002 111.311 -174.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 mp -78.88 -17.82 54.94 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 114.178 1.177 . . . . 53.560000000000002 114.178 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.8 2.64 39.87 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 120.305 1.411 . . . . 40.710000000000001 114.279 -171.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -78.03 148.09 34.49 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 120.339 2.07 . . . . 27.609999999999999 111.678 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.5 m -116.95 132.69 56.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.837 1.255 . . . . 29.09 111.647 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PHE . . . . . 0.449 ' HD2' HD21 ' B' ' 56' ' ' LEU . 3.8 p90 -129.33 137.51 51.04 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 121.148 1.795 . . . . 19.219999999999999 108.452 164.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . 0.405 ' O ' ' HA3' ' B' ' 41' ' ' GLY . 70.1 mt -110.81 121.43 63.51 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 112.202 -2.272 . . . . 24.239999999999998 107.524 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 p -134.72 140.88 44.68 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.142 0 O-C-N 121.203 -0.936 . . . . 17.289999999999999 111.176 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 48.3 m -107.11 126.15 51.99 Favored 'General case' 0 C--O 1.254 1.31 0 C-N-CA 125.622 1.569 . . . . 24.27 109.55 166.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -98.48 114.65 27.12 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 109.206 -0.664 . . . . 23.629999999999999 109.206 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -85.08 160.08 34.69 Favored Glycine 0 N--CA 1.443 -0.881 0 O-C-N 118.596 -2.565 . . . . 28.010000000000002 108.758 -171.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.43 68.43 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.534 0.568 . . . . 36.93 112.534 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -99.94 29.92 3.97 Favored 'General case' 0 C--O 1.243 0.755 0 N-CA-C 117.147 2.277 . . . . 35.130000000000003 117.147 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.28 2.42 77.08 Favored Glycine 0 C--N 1.341 0.81 0 O-C-N 125.5 1.75 . . . . 20.280000000000001 113.344 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.18 139.49 37.97 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.598 2.199 . . . . 17.170000000000002 116.068 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . 0.512 HD11 HD12 ' B' ' 73' ' ' LEU . 89.0 mt -113.18 134.05 54.76 Favored 'General case' 0 C--O 1.252 1.231 0 O-C-N 120.078 -1.639 . . . . 16.5 107.817 169.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 p -137.78 146.11 43.19 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 106.389 -1.708 . . . . 16.329999999999998 106.389 179.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . 0.405 ' HA3' ' O ' ' B' ' 30' ' ' ILE . . . 166.81 -163.02 36.74 Favored Glycine 0 C--N 1.346 1.127 0 CA-C-N 121.801 2.092 . . . . 11.15 112.398 -179.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 62.0 p -136.12 147.35 47.74 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 122.359 1.076 . . . . 22.489999999999998 108.688 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -107.28 140.13 40.67 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 103.924 -2.621 . . . . 38.560000000000002 103.924 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLU . . . . . 0.527 ' HG3' ' HG2' ' B' ' 53' ' ' ARG . 14.0 tt0 -128.42 116.18 19.35 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 104.543 -2.391 . . . . 59.700000000000003 104.543 178.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . 0.527 ' HB2' ' N ' ' P' ' 7' ' ' NH2 . 0.0 OUTLIER -60.48 -23.92 64.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.496 1.295 . . . . 65.640000000000001 114.496 172.935 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.38 143.77 28.22 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 106.687 -1.597 . . . . 72.790000000000006 106.687 174.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -56.18 5.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 N-CA-C 118.182 2.66 . . . . 80.069999999999993 118.182 -170.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -170.42 70.35 0.13 Allowed Glycine 0 C--N 1.338 0.673 0 O-C-N 116.656 -3.777 . . . . 75.069999999999993 114.496 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -174.61 129.33 0.33 Allowed 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 119.122 1.461 . . . . 66.510000000000005 112.779 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.39 -27.25 67.71 Favored 'General case' 0 CA--C 1.509 -0.63 0 O-C-N 118.488 -2.633 . . . . 53.240000000000002 114.233 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . 0.465 ' HA ' ' CD2' ' B' ' 83' ' ' TYR . 8.5 pt-20 -69.59 -16.02 63.32 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.247 -0.888 . . . . 69.590000000000003 112.293 -178.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 58.3 p -106.28 5.89 30.15 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.879 -1.055 . . . . 48.270000000000003 112.543 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . 0.527 ' HG2' ' HG3' ' B' ' 44' ' ' GLU . 30.3 mtt180 -99.15 137.2 38.0 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-O 122.154 0.978 . . . . 31.91 110.378 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -131.59 146.9 52.44 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 113.629 -1.623 . . . . 18.16 109.601 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 92.4 t -72.38 138.84 20.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 125.643 1.577 . . . . 17.07 112.286 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . 0.449 HD21 ' HD2' ' B' ' 29' ' ' PHE . 3.1 pp -126.77 151.75 47.82 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 122.862 1.315 . . . . 16.289999999999999 109.618 170.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 4.2 t -140.67 150.79 43.96 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 114.029 -1.441 . . . . 20.32 110.533 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -171.73 -168.94 33.97 Favored Glycine 0 CA--C 1.532 1.13 0 O-C-N 120.074 -1.641 . . . . 12.1 111.547 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -141.14 154.5 45.91 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.229 1.011 . . . . 17.329999999999998 108.748 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -145.27 158.25 43.87 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 108.846 -0.798 . . . . 21.350000000000001 108.846 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -70.93 107.77 4.21 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 124.858 1.263 . . . . 15.1 109.406 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 13.4 p -88.43 3.92 48.29 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 112.517 0.562 . . . . 24.030000000000001 112.517 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.98 70.77 49.39 Favored Pre-proline 0 C--O 1.246 0.869 0 O-C-N 118.503 -2.623 . . . . 22.859999999999999 107.415 168.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -70.48 165.2 32.58 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.586 1.524 . . . . 18.329999999999998 112.96 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.19 147.15 50.18 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 118.58 -2.575 . . . . 27.09 113.159 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -80.18 -14.72 58.24 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.093 1.886 . . . . 34.439999999999998 116.093 -171.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -72.31 -177.65 2.23 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 120.962 -1.086 . . . . 44.600000000000001 108.503 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -78.14 47.46 2.89 Favored Glycine 0 CA--C 1.549 2.172 0 CA-C-N 122.179 2.263 . . . . 43.119999999999997 116.297 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.7 m -89.18 154.22 20.32 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 118.202 1.001 . . . . 38.240000000000002 110.054 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.8 163.74 54.29 Favored Glycine 0 C--N 1.345 1.033 0 N-CA-C 110.71 -0.956 . . . . 24.43 110.71 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 54.5 m -95.38 116.22 28.49 Favored 'General case' 0 C--O 1.252 1.201 0 C-N-CA 125.266 1.427 . . . . 20.460000000000001 109.942 172.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.28 140.91 50.5 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.919 -1.738 . . . . 12.800000000000001 111.491 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . 0.512 HD12 HD11 ' B' ' 39' ' ' LEU . 2.7 pp -155.8 168.82 25.96 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.849 0.833 . . . . 16.120000000000001 109.024 -179.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.98 156.98 28.25 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 109.818 -1.313 . . . . 12.02 109.818 173.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' TRP . . . . . . . . . . . . . 45.6 p90 -151.44 162.46 40.9 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.279 1.54 . . . . 14.94 109.83 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 m -122.82 141.24 52.06 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.697 1.599 . . . . 14.300000000000001 110.277 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 74.5 t -124.0 121.94 63.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 106.308 -1.738 . . . . 11.529999999999999 106.308 166.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.71 128.53 36.11 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.513 0.673 . . . . 12.619999999999999 110.562 164.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 88.1 m95 -86.53 63.85 8.21 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 117.667 -3.146 . . . . 15.050000000000001 111.285 -167.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -136.41 131.49 34.23 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 104.959 -2.237 . . . . 30.850000000000001 104.959 174.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.9 p30 -141.1 -165.2 1.91 Allowed 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.406 -1.331 . . . . 18.18 107.406 168.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.16 -16.89 64.0 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 116.79 2.144 . . . . 42.159999999999997 116.79 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 51' ' ' GLU . 52.1 m-85 -113.5 -17.44 12.21 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 115.808 1.781 . . . . 34.740000000000002 115.808 -173.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt85 -153.62 147.92 25.9 Favored 'General case' 0 C--O 1.263 1.813 0 N-CA-C 104.901 -2.259 . . . . 35.899999999999999 104.901 -164.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 53.2 t-20 -138.57 117.83 12.73 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 104.976 -2.231 . . . . 21.489999999999998 104.976 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -99.76 9.49 42.98 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 118.245 -0.883 . . . . 15.029999999999999 112.771 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 48.19 53.98 10.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.84 2.109 . . . . 22.129999999999999 114.546 173.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -163.25 161.2 24.69 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 114.001 -1.454 . . . . 14.99 111.768 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.04 141.17 28.65 Favored 'General case' 0 C--O 1.252 1.224 0 N-CA-C 106.254 -1.758 . . . . 15.640000000000001 106.254 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m -113.15 141.38 46.99 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 121.605 -0.685 . . . . 12.73 110.879 171.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 73.3 p -114.49 133.97 55.36 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 120.632 -1.292 . . . . 11.81 109.347 168.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -105.89 132.47 51.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.522 1.055 . . . . 15.43 109.678 171.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 47.7 t -124.13 129.4 50.78 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 124.904 1.282 . . . . 14.359999999999999 108.508 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.95 -154.44 11.96 Favored Glycine 0 C--O 1.254 1.38 0 O-C-N 119.95 -1.719 . . . . 13.07 112.031 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -150.78 137.62 19.03 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.548 -1.826 . . . . 18.370000000000001 113.004 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -78.17 138.84 38.89 Favored 'General case' 0 C--O 1.249 1.064 0 CA-C-N 112.388 -2.187 . . . . 27.789999999999999 109.787 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 60.4 t -130.2 120.67 49.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 104.921 -2.252 . . . . 29.32 104.921 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.96 -175.44 50.85 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 124.376 2.098 . . . . 33.939999999999998 114.516 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 112.9 -165.37 12.03 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 108.964 -1.654 . . . . 29.809999999999999 108.964 170.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.78 74.8 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 114.236 -0.982 . . . . 29.109999999999999 112.321 -173.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -124.87 73.42 1.28 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 125.357 2.503 . . . . 29.309999999999999 109.398 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.34 137.84 57.84 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-N 109.89 -3.323 . . . . 23.52 111.691 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.8 162.68 41.02 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 119.78 -0.768 . . . . 32.289999999999999 110.746 174.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 84.1 mt -125.02 117.29 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.098 0 N-CA-C 100.707 -3.812 . . . . 17.07 100.707 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -99.1 125.85 44.72 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.498 -1.668 . . . . 26.91 106.498 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 70.0 p -130.76 156.63 44.64 Favored 'General case' 0 C--O 1.26 1.631 0 O-C-N 120.82 -1.175 . . . . 11.16 111.321 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -115.38 151.01 35.45 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 106.223 -1.769 . . . . 24.280000000000001 106.223 159.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 37.9 p-90 -134.68 154.32 51.59 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 119.428 1.013 . . . . 13.630000000000001 113.326 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 46.1 mt -126.34 125.78 42.82 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.401 -1.333 . . . . 15.050000000000001 107.401 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 tp -109.42 112.29 24.32 Favored 'General case' 0 C--O 1.254 1.342 0 N-CA-C 107.628 -1.249 . . . . 17.899999999999999 107.628 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 99.9 m -105.22 129.64 53.55 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 118.59 0.632 . . . . 15.949999999999999 112.244 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 75.5 m -94.76 141.57 28.47 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 118.177 -0.916 . . . . 17.59 112.181 170.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.41 124.61 33.76 Favored Glycine 0 CA--C 1.543 1.783 0 CA-C-N 120.304 1.411 . . . . 20.219999999999999 110.816 168.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 81.5 p -128.2 169.89 13.63 Favored 'General case' 0 C--O 1.249 1.078 0 O-C-N 119.431 -2.217 . . . . 17.370000000000001 105.52 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 41.8 p -75.83 162.65 27.97 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 113.818 -1.537 . . . . 28.850000000000001 107.07 164.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.24 -25.69 67.96 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 116.844 2.164 . . . . 42.149999999999999 116.844 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.45 70.64 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.921 -1.14 . . . . 38.789999999999999 107.921 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -91.79 13.27 18.78 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 117.198 2.296 . . . . 40.869999999999997 117.198 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.85 -26.75 68.46 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 121.08 -1.013 . . . . 31.350000000000001 113.318 -171.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' TRP . . . . . 0.569 ' CZ3' ' HB3' ' B' ' 121' ' ' LYS . 64.3 p-90 -59.45 -25.29 64.24 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 119.424 -2.047 . . . . 60.039999999999999 115.839 178.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LYS . . . . . 0.569 ' HB3' ' CZ3' ' B' ' 120' ' ' TRP . 13.5 ptmm? -101.98 18.37 20.84 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 120.936 -1.103 . . . . 29.940000000000001 109.487 179.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 62.2 p -74.64 -24.38 58.83 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 116.958 2.207 . . . . 18.010000000000002 116.958 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 77.7 m -130.2 121.56 26.45 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-O 123.227 1.489 . . . . 14.59 111.414 -165.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 11.8 mt -97.5 154.02 17.77 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 113.13 -1.85 . . . . 14.92 111.353 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 9.2 p -132.12 141.52 45.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.271 0 CA-C-N 115.012 -0.995 . . . . 13.5 108.454 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -160.26 -163.79 14.26 Favored Glycine 0 N--CA 1.429 -1.793 0 N-CA-C 109.382 -1.487 . . . . 11.710000000000001 109.382 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -148.21 155.02 40.87 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.711 -1.589 . . . . 30.120000000000001 106.711 -173.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.94 140.02 21.1 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.5 1.52 . . . . 29.289999999999999 108.094 -174.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 85.4 m -114.33 127.09 55.69 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.102 1.761 . . . . 22.16 109.406 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -106.26 138.96 41.52 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.246 1.418 . . . . 19.18 107.522 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 18.7 p -128.17 161.4 29.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.854 0.752 . . . . 20.07 109.13 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.04 -15.46 56.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.722 1.249 . . . . 39.280000000000001 111.942 177.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 63.3 t -92.25 121.04 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 CA-C-N 114.28 -1.327 . . . . 44.600000000000001 107.468 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.79 129.42 68.1 Favored Pre-proline 0 C--O 1.236 0.364 0 N-CA-C 105.703 -1.962 . . . . 58.590000000000003 105.703 166.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.235 0.37 0 C-N-CA 123.422 2.748 . . . . 55.170000000000002 117.141 173.609 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 39.009999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 156.41 151.72 0.01 OUTLIER 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.441 2.697 . . . . 45.340000000000003 103.757 . 144.789 -94.315 -108.911 95.352 2.015 103.352 -97.776 39.443 2 2 . 1 . 001 ecloud build full ' P' P ' 2' ' ' HIS . . . . . 0.406 ' HB3' ' HD2' ' P' ' 5' ' ' PHE . 38.8 t-80 -76.43 143.3 72.31 Favored Pre-proline 0 C--O 1.239 0.506 0 O-C-N 120.205 -1.559 . . . . 37.859999999999999 109.609 179.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 3' ' ' PRO . . . . . 0.461 ' O ' ' HB3' ' B' ' 45' ' ' SER . 18.7 Cg_endo -55.79 -16.49 15.61 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 125.11 3.874 . . . . 32.32 116.598 176.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 4' ' ' GLN . . . . . 0.417 ' HB3' ' CE2' ' P' ' 5' ' ' PHE . 48.2 tt0 -65.06 -24.59 67.51 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 118.807 -2.433 . . . . 36.759999999999998 109.548 171.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 5' ' ' PHE . . . . . 0.417 ' CE2' ' HB3' ' P' ' 4' ' ' GLN . 44.4 m-85 -115.95 -27.66 6.9 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.915 0.886 . . . . 50.439999999999998 113.333 -170.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 6' ' ' CYS . . . . . . . . . . . . . 1.6 p -133.75 124.38 26.53 Favored 'General case' 0 CA--C 1.506 -0.722 0 CA-C-N 122.408 2.367 . . . . 49.789999999999999 110.207 173.376 39.443 -97.776 -108.911 103.352 2.015 95.352 -94.315 144.789 1 1 . 1 . 001 ecloud build full ' P' P ' 7' ' ' NH2 . . . . . 0.527 ' N ' ' HB2' ' B' ' 45' ' ' SER . . . . . . . . 0 C--N 1.322 -0.629 0 O-C-N 120.9 -1.125 . . . . 50.359999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 664' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 667' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.649 0 N-CA-C 106.526 -1.657 . . . . 45.97 106.526 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 26.64 -84.64 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 119.348 3.092 . . . . 50.38 119.348 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.53 -40.93 79.9 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 119.07 0.85 . . . . 39.45 109.737 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.48 -29.19 74.43 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-N 119.584 1.084 . . . . 35.41 113.175 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 56.7 mt -85.24 -38.45 13.11 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 CA-C-N 119.035 1.417 . . . . 22.52 112.054 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 47.9 m -58.39 128.47 37.31 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 108.749 -0.834 . . . . 19.26 108.749 -178.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 145.83 -169.44 27.28 Favored Glycine 0 C--N 1.336 0.574 0 CA-C-N 119.492 1.042 . . . . 18.65 112.245 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 32.8 m -107.69 132.37 53.42 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-O 122.608 1.194 . . . . 17.62 107.87 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -125.61 150.37 47.59 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.657 -1.156 . . . . 17.63 109.612 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -130.29 138.91 50.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 N-CA-C 105.805 -1.924 . . . . 21.39 105.805 -173.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASN . . . . . . . . . . . . . 41.5 p30 -101.22 -177.21 3.38 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 117.903 -1.519 . . . . 23.08 109.086 169.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -65.6 -28.63 69.27 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.379 1.472 . . . . 42.92 111.311 -174.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 mp -78.88 -17.82 54.94 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 114.178 1.177 . . . . 53.56 114.178 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.8 2.64 39.87 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 120.305 1.411 . . . . 40.71 114.279 -171.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -78.03 148.09 34.49 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 120.339 2.07 . . . . 27.61 111.678 174.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.5 m -116.95 132.69 56.64 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 124.837 1.255 . . . . 29.09 111.647 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PHE . . . . . 0.449 ' HD2' HD21 ' B' ' 56' ' ' LEU . 3.8 p90 -129.33 137.51 51.04 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 121.148 1.795 . . . . 19.22 108.452 164.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.405 ' O ' ' HA3' ' B' ' 41' ' ' GLY . 70.1 mt -110.81 121.43 63.51 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-N 112.202 -2.272 . . . . 24.24 107.524 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 p -134.72 140.88 44.68 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.142 0 O-C-N 121.203 -0.936 . . . . 17.29 111.176 -173.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 48.3 m -107.11 126.15 51.99 Favored 'General case' 0 C--O 1.254 1.31 0 C-N-CA 125.622 1.569 . . . . 24.27 109.55 166.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -98.48 114.65 27.12 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 109.206 -0.664 . . . . 23.63 109.206 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -85.08 160.08 34.69 Favored Glycine 0 N--CA 1.443 -0.881 0 O-C-N 118.596 -2.565 . . . . 28.01 108.758 -171.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.39 -30.43 68.43 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.534 0.568 . . . . 36.93 112.534 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -99.94 29.92 3.97 Favored 'General case' 0 C--O 1.243 0.755 0 N-CA-C 117.147 2.277 . . . . 35.13 117.147 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.28 2.42 77.08 Favored Glycine 0 C--N 1.341 0.81 0 O-C-N 125.5 1.75 . . . . 20.28 113.344 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.18 139.49 37.97 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.598 2.199 . . . . 17.17 116.068 176.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.512 HD11 HD12 ' B' ' 73' ' ' LEU . 89.0 mt -113.18 134.05 54.76 Favored 'General case' 0 C--O 1.252 1.231 0 O-C-N 120.078 -1.639 . . . . 16.5 107.817 169.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 5.0 p -137.78 146.11 43.19 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 106.389 -1.708 . . . . 16.33 106.389 179.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.405 ' HA3' ' O ' ' B' ' 30' ' ' ILE . . . 166.81 -163.02 36.74 Favored Glycine 0 C--N 1.346 1.127 0 CA-C-N 121.801 2.092 . . . . 11.15 112.398 -179.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 62.0 p -136.12 147.35 47.74 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 122.359 1.076 . . . . 22.49 108.688 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -107.28 140.13 40.67 Favored 'General case' 0 C--O 1.253 1.263 0 N-CA-C 103.924 -2.621 . . . . 38.56 103.924 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLU . . . . . 0.527 ' HG3' ' HG2' ' B' ' 53' ' ' ARG . 14.0 tt0 -128.42 116.18 19.35 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 104.543 -2.391 . . . . 59.7 104.543 178.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . 0.527 ' HB2' ' N ' ' P' ' 7' ' ' NH2 . 0.0 OUTLIER -60.48 -23.92 64.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.496 1.295 . . . . 65.64 114.496 172.935 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.38 143.77 28.22 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 106.687 -1.597 . . . . 72.79 106.687 174.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -56.18 5.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 N-CA-C 118.182 2.66 . . . . 80.07 118.182 -170.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -170.42 70.35 0.13 Allowed Glycine 0 C--N 1.338 0.673 0 O-C-N 116.656 -3.777 . . . . 75.07 114.496 -176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -174.61 129.33 0.33 Allowed 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 119.122 1.461 . . . . 66.51 112.779 177.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.39 -27.25 67.71 Favored 'General case' 0 CA--C 1.509 -0.63 0 O-C-N 118.488 -2.633 . . . . 53.24 114.233 -173.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.465 ' HA ' ' CD2' ' B' ' 83' ' ' TYR . 8.5 pt-20 -69.59 -16.02 63.32 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.247 -0.888 . . . . 69.59 112.293 -178.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 58.3 p -106.28 5.89 30.15 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.879 -1.055 . . . . 48.27 112.543 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . 0.527 ' HG2' ' HG3' ' B' ' 44' ' ' GLU . 30.3 mtt180 -99.15 137.2 38.0 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-O 122.154 0.978 . . . . 31.91 110.378 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -131.59 146.9 52.44 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 113.629 -1.623 . . . . 18.16 109.601 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 92.4 t -72.38 138.84 20.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 C-N-CA 125.643 1.577 . . . . 17.07 112.286 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.449 HD21 ' HD2' ' B' ' 29' ' ' PHE . 3.1 pp -126.77 151.75 47.82 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 122.862 1.315 . . . . 16.29 109.618 170.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 4.2 t -140.67 150.79 43.96 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 114.029 -1.441 . . . . 20.32 110.533 172.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -171.73 -168.94 33.97 Favored Glycine 0 CA--C 1.532 1.13 0 O-C-N 120.074 -1.641 . . . . 12.1 111.547 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 mmm180 -141.14 154.5 45.91 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.229 1.011 . . . . 17.33 108.748 -175.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -145.27 158.25 43.87 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 108.846 -0.798 . . . . 21.35 108.846 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -70.93 107.77 4.21 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 124.858 1.263 . . . . 15.1 109.406 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 13.4 p -88.43 3.92 48.29 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 112.517 0.562 . . . . 24.03 112.517 -175.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ALA . . . . . . . . . . . . . . . -137.98 70.77 49.39 Favored Pre-proline 0 C--O 1.246 0.869 0 O-C-N 118.503 -2.623 . . . . 22.86 107.415 168.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -70.48 165.2 32.58 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.586 1.524 . . . . 18.33 112.96 -173.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.19 147.15 50.18 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 118.58 -2.575 . . . . 27.09 113.159 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -80.18 -14.72 58.24 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.093 1.886 . . . . 34.44 116.093 -171.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -72.31 -177.65 2.23 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 120.962 -1.086 . . . . 44.6 108.503 169.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -78.14 47.46 2.89 Favored Glycine 0 CA--C 1.549 2.172 0 CA-C-N 122.179 2.263 . . . . 43.12 116.297 -173.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.7 m -89.18 154.22 20.32 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 118.202 1.001 . . . . 38.24 110.054 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.8 163.74 54.29 Favored Glycine 0 C--N 1.345 1.033 0 N-CA-C 110.71 -0.956 . . . . 24.43 110.71 167.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 54.5 m -95.38 116.22 28.49 Favored 'General case' 0 C--O 1.252 1.201 0 C-N-CA 125.266 1.427 . . . . 20.46 109.942 172.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ALA . . . . . . . . . . . . . . . -71.28 140.91 50.5 Favored 'General case' 0 C--O 1.253 1.256 0 O-C-N 119.919 -1.738 . . . . 12.8 111.491 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.512 HD12 HD11 ' B' ' 39' ' ' LEU . 2.7 pp -155.8 168.82 25.96 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.849 0.833 . . . . 16.12 109.024 -179.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -159.98 156.98 28.25 Favored Glycine 0 CA--C 1.537 1.437 0 N-CA-C 109.818 -1.313 . . . . 12.02 109.818 173.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' TRP . . . . . . . . . . . . . 45.6 p90 -151.44 162.46 40.9 Favored 'General case' 0 C--N 1.359 1.013 0 CA-C-N 119.279 1.54 . . . . 14.94 109.83 172.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 m -122.82 141.24 52.06 Favored 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.697 1.599 . . . . 14.3 110.277 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 74.5 t -124.0 121.94 63.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.979 0 N-CA-C 106.308 -1.738 . . . . 11.53 106.308 166.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.71 128.53 36.11 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.513 0.673 . . . . 12.62 110.562 164.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TRP . . . . . . . . . . . . . 88.1 m95 -86.53 63.85 8.21 Favored 'General case' 0 C--N 1.32 -0.717 0 O-C-N 117.667 -3.146 . . . . 15.05 111.285 -167.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -136.41 131.49 34.23 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 104.959 -2.237 . . . . 30.85 104.959 174.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.9 p30 -141.1 -165.2 1.91 Allowed 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.406 -1.331 . . . . 18.18 107.406 168.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.16 -16.89 64.0 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 116.79 2.144 . . . . 42.16 116.79 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 51' ' ' GLU . 52.1 m-85 -113.5 -17.44 12.21 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 115.808 1.781 . . . . 34.74 115.808 -173.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt85 -153.62 147.92 25.9 Favored 'General case' 0 C--O 1.263 1.813 0 N-CA-C 104.901 -2.259 . . . . 35.9 104.901 -164.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 53.2 t-20 -138.57 117.83 12.73 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 104.976 -2.231 . . . . 21.49 104.976 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -99.76 9.49 42.98 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 118.245 -0.883 . . . . 15.03 112.771 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 48.19 53.98 10.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.84 2.109 . . . . 22.13 114.546 173.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -163.25 161.2 24.69 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 114.001 -1.454 . . . . 14.99 111.768 -172.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -145.04 141.17 28.65 Favored 'General case' 0 C--O 1.252 1.224 0 N-CA-C 106.254 -1.758 . . . . 15.64 106.254 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 95.1 m -113.15 141.38 46.99 Favored 'General case' 0 C--O 1.247 0.958 0 O-C-N 121.605 -0.685 . . . . 12.73 110.879 171.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 73.3 p -114.49 133.97 55.36 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 120.632 -1.292 . . . . 11.81 109.347 168.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -105.89 132.47 51.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.522 1.055 . . . . 15.43 109.678 171.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 47.7 t -124.13 129.4 50.78 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 124.904 1.282 . . . . 14.36 108.508 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -176.95 -154.44 11.96 Favored Glycine 0 C--O 1.254 1.38 0 O-C-N 119.95 -1.719 . . . . 13.07 112.031 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -150.78 137.62 19.03 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.548 -1.826 . . . . 18.37 113.004 -177.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -78.17 138.84 38.89 Favored 'General case' 0 C--O 1.249 1.064 0 CA-C-N 112.388 -2.187 . . . . 27.79 109.787 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 60.4 t -130.2 120.67 49.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 104.921 -2.252 . . . . 29.32 104.921 176.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -83.96 -175.44 50.85 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 124.376 2.098 . . . . 33.94 114.516 -174.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . 112.9 -165.37 12.03 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 108.964 -1.654 . . . . 29.81 108.964 170.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.78 74.8 Favored 'General case' 0 CA--C 1.5 -0.96 0 CA-C-N 114.236 -0.982 . . . . 29.11 112.321 -173.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -124.87 73.42 1.28 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 125.357 2.503 . . . . 29.31 109.398 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.34 137.84 57.84 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-N 109.89 -3.323 . . . . 23.52 111.691 177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.8 162.68 41.02 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 119.78 -0.768 . . . . 32.29 110.746 174.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 84.1 mt -125.02 117.29 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.098 0 N-CA-C 100.707 -3.812 . . . . 17.07 100.707 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -99.1 125.85 44.72 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 106.498 -1.668 . . . . 26.91 106.498 176.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 70.0 p -130.76 156.63 44.64 Favored 'General case' 0 C--O 1.26 1.631 0 O-C-N 120.82 -1.175 . . . . 11.16 111.321 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -115.38 151.01 35.45 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 106.223 -1.769 . . . . 24.28 106.223 159.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 37.9 p-90 -134.68 154.32 51.59 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-N 119.428 1.013 . . . . 13.63 113.326 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 46.1 mt -126.34 125.78 42.82 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.401 -1.333 . . . . 15.05 107.401 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 tp -109.42 112.29 24.32 Favored 'General case' 0 C--O 1.254 1.342 0 N-CA-C 107.628 -1.249 . . . . 17.9 107.628 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 99.9 m -105.22 129.64 53.55 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 118.59 0.632 . . . . 15.95 112.244 175.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 75.5 m -94.76 141.57 28.47 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 118.177 -0.916 . . . . 17.59 112.181 170.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLY . . . . . . . . . . . . . . . -62.41 124.61 33.76 Favored Glycine 0 CA--C 1.543 1.783 0 CA-C-N 120.304 1.411 . . . . 20.22 110.816 168.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' THR . . . . . . . . . . . . . 81.5 p -128.2 169.89 13.63 Favored 'General case' 0 C--O 1.249 1.078 0 O-C-N 119.431 -2.217 . . . . 17.37 105.52 -174.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 41.8 p -75.83 162.65 27.97 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 113.818 -1.537 . . . . 28.85 107.07 164.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -62.24 -25.69 67.96 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 116.844 2.164 . . . . 42.15 116.844 175.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.45 70.64 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.921 -1.14 . . . . 38.79 107.921 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -91.79 13.27 18.78 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 117.198 2.296 . . . . 40.87 117.198 -178.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.85 -26.75 68.46 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 121.08 -1.013 . . . . 31.35 113.318 -171.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.569 ' CZ3' ' HB3' ' B' ' 121' ' ' LYS . 64.3 p-90 -59.45 -25.29 64.24 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 119.424 -2.047 . . . . 60.04 115.839 178.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LYS . . . . . 0.569 ' HB3' ' CZ3' ' B' ' 120' ' ' TRP . 13.5 ptmm? -101.98 18.37 20.84 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 120.936 -1.103 . . . . 29.94 109.487 179.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 62.2 p -74.64 -24.38 58.83 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 116.958 2.207 . . . . 18.01 116.958 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 77.7 m -130.2 121.56 26.45 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-O 123.227 1.489 . . . . 14.59 111.414 -165.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 11.8 mt -97.5 154.02 17.77 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 113.13 -1.85 . . . . 14.92 111.353 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 9.2 p -132.12 141.52 45.2 Favored 'Isoleucine or valine' 0 C--O 1.253 1.271 0 CA-C-N 115.012 -0.995 . . . . 13.5 108.454 -178.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -160.26 -163.79 14.26 Favored Glycine 0 N--CA 1.429 -1.793 0 N-CA-C 109.382 -1.487 . . . . 11.71 109.382 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -148.21 155.02 40.87 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.711 -1.589 . . . . 30.12 106.711 -173.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -150.94 140.02 21.1 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.5 1.52 . . . . 29.29 108.094 -174.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' THR . . . . . . . . . . . . . 85.4 m -114.33 127.09 55.69 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.102 1.761 . . . . 22.16 109.406 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -106.26 138.96 41.52 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.246 1.418 . . . . 19.18 107.522 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' THR . . . . . . . . . . . . . 18.7 p -128.17 161.4 29.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.854 0.752 . . . . 20.07 109.13 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.04 -15.46 56.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.722 1.249 . . . . 39.28 111.942 177.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 63.3 t -92.25 121.04 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.69 0 CA-C-N 114.28 -1.327 . . . . 44.6 107.468 -178.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.79 129.42 68.1 Favored Pre-proline 0 C--O 1.236 0.364 0 N-CA-C 105.703 -1.962 . . . . 58.59 105.703 166.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 C--O 1.235 0.37 0 C-N-CA 123.422 2.748 . . . . 55.17 117.141 173.609 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 39.01 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 1' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 156.41 151.72 0.01 OUTLIER 'General case' 0 C--O 1.237 0.441 0 C-N-CA 128.441 2.697 . . . . 45.34 103.757 . 144.789 -94.315 -108.911 95.352 2.015 103.352 -97.776 39.443 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 2' ' ' HIS . . . . . 0.406 ' HB3' ' HD2' ' P' ' 5' ' ' PHE . 38.8 t-80 -76.43 143.3 72.31 Favored Pre-proline 0 C--O 1.239 0.506 0 O-C-N 120.205 -1.559 . . . . 37.86 109.609 179.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 3' ' ' PRO . . . . . 0.461 ' O ' ' HB3' ' B' ' 45' ' ' SER . 18.7 Cg_endo -55.79 -16.49 15.61 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 125.11 3.874 . . . . 32.32 116.598 176.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 4' ' ' GLN . . . . . 0.417 ' HB3' ' CE2' ' P' ' 5' ' ' PHE . 48.2 tt0 -65.06 -24.59 67.51 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 118.807 -2.433 . . . . 36.76 109.548 171.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 5' ' ' PHE . . . . . 0.417 ' CE2' ' HB3' ' P' ' 4' ' ' GLN . 44.4 m-85 -115.95 -27.66 6.9 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.915 0.886 . . . . 50.44 113.333 -170.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 6' ' ' CYS . . . . . . . . . . . . . 1.6 p -133.75 124.38 26.53 Favored 'General case' 0 CA--C 1.506 -0.722 0 CA-C-N 122.408 2.367 . . . . 49.79 110.207 173.376 39.443 -97.776 -108.911 103.352 2.015 95.352 -94.315 144.789 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 7' ' ' NH2 . . . . . 0.527 ' N ' ' HB2' ' B' ' 45' ' ' SER . . . . . . . . 0 C--N 1.322 -0.629 0 O-C-N 120.9 -1.125 . . . . 50.36 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 629' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 664' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 667' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_