data_5ax2_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 5ax2 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 121.595 0.712 . . . . 68.620000000000005 110.382 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.0 t -154.39 163.43 40.18 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 107.667 -1.234 . . . . 71.950000000000003 107.667 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 p -132.4 148.31 52.41 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.61 -0.681 . . . . 75.430000000000007 110.495 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -146.71 134.28 20.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.59 0.589 . . . . 93.439999999999998 112.59 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -93.92 133.8 36.96 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 122.47 1.128 . . . . 81.620000000000005 112.337 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -118.61 144.94 45.8 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.898 -2.26 . . . . 74.629999999999995 104.898 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . 0.469 ' CD1' ' CE1' ' A' ' 24' ' ' TYR . 1.4 tt -136.85 161.63 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 N-CA-C 114.71 1.374 . . . . 57.850000000000001 114.71 173.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -91.51 145.74 24.37 Favored 'General case' 0 CA--C 1.498 -1.019 0 C-N-CA 123.835 0.854 . . . . 65.739999999999995 110.162 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.72 -45.24 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 118.879 -1.128 . . . . 45.329999999999998 112.089 -177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -64.89 9.83 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.804 1.409 . . . . 48.390000000000001 114.804 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -102.04 -5.57 24.41 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 120.288 -0.565 . . . . 51.590000000000003 112.015 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.4 mtp -101.71 163.84 12.05 Favored 'General case' 0 CA--C 1.489 -1.401 0 N-CA-C 106.952 -1.499 . . . . 47.649999999999999 106.952 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.2 m -98.52 137.68 36.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.687 -1.968 . . . . 39.060000000000002 105.687 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -106.7 143.44 34.8 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 106.85 -1.537 . . . . 43.909999999999997 106.85 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -122.81 99.92 41.12 Favored Pre-proline 0 CA--C 1.508 -0.668 0 N-CA-C 103.595 -2.743 . . . . 62.840000000000003 103.595 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.33 -34.52 93.45 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 123.35 2.7 . . . . 50.939999999999998 114.084 -172.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . 0.56 ' CB ' ' O ' ' A' ' 204' ' ' HOH . 61.2 mt-10 -62.44 -30.6 71.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.924 -0.71 . . . . 88.819999999999993 109.092 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -104.78 -6.32 20.42 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 116.518 2.044 . . . . 47.149999999999999 116.518 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 48.5 45.36 20.99 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 124.421 1.076 . . . . 52.640000000000001 112.801 -173.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 33.1 ttp -137.21 138.44 40.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.784 0.802 . . . . 60.75 112.586 -169.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -100.81 132.57 46.15 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.833 -1.173 . . . . 50.920000000000002 107.833 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.3 p -120.88 163.5 18.11 Favored 'General case' 0 N--CA 1.439 -1.02 0 O-C-N 123.803 0.689 . . . . 54.950000000000003 112.046 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CE1' ' CD1' ' A' ' 8' ' ' ILE . 60.9 t80 -150.94 143.62 16.44 Favored Pre-proline 0 C--O 1.236 0.348 0 N-CA-C 105.632 -1.988 . . . . 57.479999999999997 105.632 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -56.03 124.46 16.33 Favored 'Trans proline' 0 C--O 1.259 1.53 0 O-C-N 123.107 1.056 . . . . 62.359999999999999 111.471 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 28' ' ' CYS . 14.2 t -108.06 124.24 35.3 Favored Pre-proline 0 CA--C 1.514 -0.422 0 CA-C-N 114.526 -1.216 . . . . 80.829999999999998 111.231 -179.16 169.748 171.065 -88.058 104.013 2.016 106.062 175.198 178.927 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -72.38 45.42 0.82 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.682 1.588 . . . . 106.92 112.404 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' CB ' ' OG ' ' A' ' 50' ' ' SER . 83.6 m -140.81 -158.47 0.86 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 100.041 -4.059 . . . . 124.8 100.041 170.736 -64.307 164.434 123.335 104.294 2.049 105.765 -140.933 21.397 3 3 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . 0.79 ' CA ' ' O ' ' A' ' 201' ' ' HOH . . . -79.76 -4.5 89.43 Favored Glycine 0 N--CA 1.467 0.748 0 C-N-CA 119.524 -1.322 . . . . 101.58 111.598 -175.6 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . 0.481 ' CB ' ' CB ' ' A' ' 50' ' ' SER . 0.7 OUTLIER -117.51 -169.02 1.59 Allowed 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 112.611 0.597 . . . . 87.430000000000007 112.611 -159.306 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 77.4 mtp85 -127.16 139.22 53.1 Favored 'General case' 0 C--O 1.254 1.332 0 C-N-CA 119.668 -0.813 . . . . 74.069999999999993 112.369 175.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -53.77 138.32 35.87 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 107.751 -1.203 . . . . 69.030000000000001 107.751 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.62 145.41 30.94 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 119.692 -0.803 . . . . 75.480000000000004 112.616 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 16.9 tt -162.18 140.92 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 108.049 -1.093 . . . . 38.850000000000001 108.049 -175.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -102.74 145.39 29.8 Favored 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 125.299 1.624 . . . . 42.119999999999997 110.35 -167.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.72 -42.51 83.97 Favored 'General case' 0 N--CA 1.422 -1.871 0 O-C-N 125.101 1.501 . . . . 40.439999999999998 112.297 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -71.47 -31.83 67.6 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.713 -1.195 . . . . 40.439999999999998 109.666 -169.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -68.69 -46.39 69.15 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.43 -0.804 . . . . 42.82 112.898 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 mtp -54.72 -44.08 73.18 Favored 'General case' 0 C--O 1.202 -1.441 0 O-C-N 124.673 1.233 . . . . 41.770000000000003 114.091 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -52.43 -41.0 62.86 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 110.271 -0.27 . . . . 51.890000000000001 110.271 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . 0.504 ' CA ' ' OE1' ' A' ' 41' ' ' GLU . 11.1 mm-40 -75.22 -12.83 60.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.873 1.064 . . . . 47.890000000000001 113.873 -179.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 128.6 -35.12 2.73 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 118.263 2.065 . . . . 44.729999999999997 118.263 172.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -36.12 121.6 0.68 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.336 1.236 . . . . 50.890000000000001 114.336 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -124.38 8.7 8.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.96 0.886 . . . . 70.420000000000002 111.893 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 43.5 t -111.26 121.13 63.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 C-N-CA 119.904 -0.718 . . . . 39.32 110.637 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -95.46 133.72 39.11 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-N 115.72 -0.673 . . . . 54.710000000000001 110.584 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 125.67 62.5 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 C-N-CA 126.976 2.11 . . . . 72.700000000000003 112.539 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 46.4 t -102.93 101.17 19.5 Favored Pre-proline 0 CA--C 1.556 1.182 0 N-CA-C 113.487 0.921 . . . . 83.560000000000002 113.487 167.39 178.927 175.198 -88.058 106.062 2.016 104.013 171.065 169.748 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -92.1 25.81 0.44 Allowed 'Trans proline' 0 CA--C 1.574 2.506 1 C-N-CA 126.262 4.641 . . . . 114.73 119.867 -176.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . 0.481 ' CB ' ' CB ' ' A' ' 30' ' ' ASP . 81.6 p -88.37 -19.99 25.9 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 106.94 -1.504 . . . . 148.71000000000001 106.94 164.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.0 -159.24 0.94 Allowed 'General case' 0 N--CA 1.428 -1.547 1 N-CA-C 99.675 -4.194 . . . . 120.22 99.675 169.152 21.397 -140.933 123.335 105.765 2.049 104.294 164.434 -64.307 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 t -118.31 139.27 51.6 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 105.449 -2.056 . . . . 109.01000000000001 105.449 152.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.8 tt -167.81 154.14 7.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.845 -3.761 . . . . 95.650000000000006 100.845 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 49.2 mtt -149.06 128.05 12.69 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 119.609 -0.836 . . . . 68.510000000000005 110.91 -167.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.5 tt -123.2 142.97 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 124.152 0.908 . . . . 62.509999999999998 111.629 -176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -90.94 122.71 33.85 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 126.037 1.735 . . . . 55.990000000000002 108.637 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.1 t -98.87 120.25 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-N 118.299 0.499 . . . . 48.960000000000001 111.626 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.1 t -85.98 119.66 34.63 Favored 'Isoleucine or valine' 0 C--O 1.263 1.811 0 N-CA-C 112.112 0.412 . . . . 42.640000000000001 112.112 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -159.28 159.82 34.51 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.669 -1.234 . . . . 37.950000000000003 107.669 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.2 168.45 10.3 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.926 1.29 . . . . 52.200000000000003 109.756 161.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -49.06 -40.3 30.95 Favored 'General case' 0 C--O 1.25 1.097 0 N-CA-C 114.652 1.353 . . . . 57.359999999999999 114.652 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.07 -27.19 63.45 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 118.059 -1.456 . . . . 63.219999999999999 111.095 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -66.35 -19.22 65.75 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.941 -0.763 . . . . 45.649999999999999 108.941 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -83.87 -27.76 28.44 Favored 'General case' 0 C--O 1.258 1.53 0 N-CA-C 117.093 2.257 . . . . 47.460000000000001 117.093 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -36.08 -59.16 0.63 Allowed 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 113.453 0.908 . . . . 38.880000000000003 113.453 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -57.08 -26.64 60.73 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.763 2.135 . . . . 66.790000000000006 116.763 -173.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -93.76 -30.16 15.01 Favored 'General case' 0 N--CA 1.425 -1.692 0 N-CA-C 107.021 -1.474 . . . . 46.119999999999997 107.021 -169.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -48.77 -40.87 30.51 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 120.919 0.39 . . . . 43.670000000000002 111.087 162.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -73.83 -53.63 9.82 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 115.826 -0.624 . . . . 52.859999999999999 110.781 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -47.64 -36.47 11.01 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.055 1.132 . . . . 59.939999999999998 114.055 169.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.11 -23.5 57.92 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.719 1.007 . . . . 52.920000000000002 113.719 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.29 18.15 50.53 Favored Glycine 0 C--O 1.215 -1.071 0 C-N-CA 117.451 -2.309 . . . . 42.460000000000001 111.92 -178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 pt -130.02 176.95 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 113.587 0.958 . . . . 44.289999999999999 113.587 -178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -122.68 153.0 62.93 Favored Pre-proline 0 CA--C 1.494 -1.201 0 N-CA-C 109.281 -0.637 . . . . 55.740000000000002 109.281 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -69.12 149.6 71.17 Favored 'Trans proline' 0 N--CA 1.443 -1.444 0 O-C-N 122.559 0.768 . . . . 57.609999999999999 113.691 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.88 -29.75 27.82 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 125.119 3.88 . . . . 58.030000000000001 114.869 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -139.01 149.13 60.36 Favored Pre-proline 0 N--CA 1.446 -0.67 0 N-CA-C 107.964 -1.124 . . . . 98.480000000000004 107.964 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -63.05 151.59 83.94 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 118.264 -0.691 . . . . 72.469999999999999 113.006 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mt . . . . . 0 N--CA 1.474 0.732 0 C-N-CA 123.579 0.752 . . . . 70.689999999999998 109.792 178.44 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.79 ' O ' ' CA ' ' A' ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.56 ' O ' ' CB ' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 121.595 0.712 . . . . 68.620000000000005 110.382 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.0 t -154.39 163.43 40.18 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 107.667 -1.234 . . . . 71.950000000000003 107.667 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 p -132.4 148.31 52.41 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.61 -0.681 . . . . 75.430000000000007 110.495 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -146.71 134.28 20.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.59 0.589 . . . . 93.439999999999998 112.59 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -93.92 133.8 36.96 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 122.47 1.128 . . . . 81.620000000000005 112.337 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -118.61 144.94 45.8 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.898 -2.26 . . . . 74.629999999999995 104.898 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . 0.469 ' CD1' ' CE1' ' A' ' 24' ' ' TYR . 1.4 tt -136.85 161.63 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 N-CA-C 114.71 1.374 . . . . 57.850000000000001 114.71 173.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . 0.669 ' HB3' ' OE1' ' A' ' 11' ' ' GLU . 27.6 mm-40 -91.51 145.74 24.37 Favored 'General case' 0 CA--C 1.498 -1.019 0 C-N-CA 123.835 0.854 . . . . 65.739999999999995 110.162 -179.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.72 -45.24 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 118.879 -1.128 . . . . 45.329999999999998 112.089 -177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.669 ' OE1' ' HB3' ' A' ' 9' ' ' GLU . 7.6 mp0 -64.89 9.83 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.804 1.409 . . . . 59.619999999999997 114.804 173.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -102.04 -5.57 24.41 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 120.288 -0.565 . . . . 51.590000000000003 112.015 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.4 mtp -101.71 163.84 12.05 Favored 'General case' 0 CA--C 1.489 -1.401 0 N-CA-C 106.952 -1.499 . . . . 47.649999999999999 106.952 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.2 m -98.52 137.68 36.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.687 -1.968 . . . . 39.060000000000002 105.687 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -106.7 143.44 34.8 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 106.85 -1.537 . . . . 43.909999999999997 106.85 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -122.81 99.92 41.12 Favored Pre-proline 0 CA--C 1.508 -0.668 0 N-CA-C 103.595 -2.743 . . . . 62.840000000000003 103.595 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.33 -34.52 93.45 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 123.35 2.7 . . . . 50.939999999999998 114.084 -172.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.978 ' HB2' ' O ' ' A' ' 204' ' ' HOH . 61.2 mt-10 -62.44 -30.6 71.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.924 -0.71 . . . . 88.819999999999993 109.092 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -104.78 -6.32 20.42 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 116.518 2.044 . . . . 47.149999999999999 116.518 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 48.5 45.36 20.99 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 124.421 1.076 . . . . 52.640000000000001 112.801 -173.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 33.1 ttp -137.21 138.44 40.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.784 0.802 . . . . 60.75 112.586 -169.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -100.81 132.57 46.15 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.833 -1.173 . . . . 50.920000000000002 107.833 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . 0.414 ' HB ' ' HE ' ' A' ' 31' ' ' ARG . 73.3 p -120.88 163.5 18.11 Favored 'General case' 0 N--CA 1.439 -1.02 0 O-C-N 123.803 0.689 . . . . 54.950000000000003 112.046 177.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CE1' ' CD1' ' A' ' 8' ' ' ILE . 60.9 t80 -150.94 143.62 16.44 Favored Pre-proline 0 C--O 1.236 0.348 0 N-CA-C 105.632 -1.988 . . . . 57.479999999999997 105.632 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -56.03 124.46 16.33 Favored 'Trans proline' 0 C--O 1.259 1.53 0 O-C-N 123.107 1.056 . . . . 62.359999999999999 111.471 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 30' ' ' ASP . 14.2 t -108.06 124.24 35.3 Favored Pre-proline 0 CA--C 1.514 -0.422 0 CA-C-N 114.526 -1.216 . . . . 80.829999999999998 111.231 -179.16 169.748 171.065 -88.058 104.013 2.016 106.062 175.198 178.927 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -72.38 45.42 0.82 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.682 1.588 . . . . 106.92 112.404 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' CB ' ' OG ' ' A' ' 50' ' ' SER . 83.6 m -140.81 -158.47 0.86 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 100.041 -4.059 . . . . 124.8 100.041 170.736 -64.307 164.434 123.335 104.294 2.049 105.765 -140.933 21.397 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . 0.79 ' CA ' ' O ' ' A' ' 201' ' ' HOH . . . -79.76 -4.5 89.43 Favored Glycine 0 N--CA 1.467 0.748 0 C-N-CA 119.524 -1.322 . . . . 101.58 111.598 -175.6 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . 1.139 ' HB2' ' HB3' ' A' ' 50' ' ' SER . 0.7 OUTLIER -117.51 -169.02 1.59 Allowed 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 112.611 0.597 . . . . 87.430000000000007 112.611 -159.306 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.414 ' HE ' ' HB ' ' A' ' 23' ' ' THR . 77.4 mtp85 -127.16 139.22 53.1 Favored 'General case' 0 C--O 1.254 1.332 0 C-N-CA 119.668 -0.813 . . . . 74.069999999999993 112.369 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -53.77 138.32 35.87 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 107.751 -1.203 . . . . 69.030000000000001 107.751 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.62 145.41 30.94 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 119.692 -0.803 . . . . 75.480000000000004 112.616 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 16.9 tt -162.18 140.92 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 108.049 -1.093 . . . . 38.850000000000001 108.049 -175.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -102.74 145.39 29.8 Favored 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 125.299 1.624 . . . . 42.119999999999997 110.35 -167.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.72 -42.51 83.97 Favored 'General case' 0 N--CA 1.422 -1.871 0 O-C-N 125.101 1.501 . . . . 40.439999999999998 112.297 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -71.47 -31.83 67.6 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.713 -1.195 . . . . 40.439999999999998 109.666 -169.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -68.69 -46.39 69.15 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.43 -0.804 . . . . 42.82 112.898 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 mtp -54.72 -44.08 73.18 Favored 'General case' 0 C--O 1.202 -1.441 0 O-C-N 124.673 1.233 . . . . 41.770000000000003 114.091 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -52.43 -41.0 62.86 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 110.271 -0.27 . . . . 51.890000000000001 110.271 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . 0.735 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . 11.1 mm-40 -75.22 -12.83 60.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.873 1.064 . . . . 48.390000000000001 113.873 -179.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 128.6 -35.12 2.73 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 118.263 2.065 . . . . 44.729999999999997 118.263 172.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -36.12 121.6 0.68 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.336 1.236 . . . . 50.890000000000001 114.336 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -124.38 8.7 8.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.96 0.886 . . . . 70.420000000000002 111.893 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 43.5 t -111.26 121.13 63.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 C-N-CA 119.904 -0.718 . . . . 39.32 110.637 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -95.46 133.72 39.11 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-N 115.72 -0.673 . . . . 54.710000000000001 110.584 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 125.67 62.5 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 C-N-CA 126.976 2.11 . . . . 72.700000000000003 112.539 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 46.4 t -102.93 101.17 19.5 Favored Pre-proline 0 CA--C 1.556 1.182 0 N-CA-C 113.487 0.921 . . . . 83.560000000000002 113.487 167.39 178.927 175.198 -88.058 106.062 2.016 104.013 171.065 169.748 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . 0.474 ' HA ' ' O ' ' A' ' 51' ' ' CYS . 96.8 Cg_endo -92.1 25.81 0.44 Allowed 'Trans proline' 0 CA--C 1.574 2.506 1 C-N-CA 126.262 4.641 . . . . 114.73 119.867 -176.822 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . 1.139 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 81.6 p -88.37 -19.99 25.9 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 106.94 -1.504 . . . . 148.71000000000001 106.94 164.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . 0.474 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -135.0 -159.24 0.94 Allowed 'General case' 0 N--CA 1.428 -1.547 1 N-CA-C 99.675 -4.194 . . . . 120.22 99.675 169.152 21.397 -140.933 123.335 105.765 2.049 104.294 164.434 -64.307 4 4 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 t -118.31 139.27 51.6 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 105.449 -2.056 . . . . 109.01000000000001 105.449 152.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.509 HD23 ' H ' ' A' ' 54' ' ' MET . 2.8 tt -167.81 154.14 7.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.845 -3.761 . . . . 95.650000000000006 100.845 177.029 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' MET . . . . . 0.509 ' H ' HD23 ' A' ' 53' ' ' LEU . 49.2 mtt -149.06 128.05 12.69 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 119.609 -0.836 . . . . 68.510000000000005 110.91 -167.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.5 tt -123.2 142.97 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 124.152 0.908 . . . . 62.509999999999998 111.629 -176.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -90.94 122.71 33.85 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 126.037 1.735 . . . . 55.990000000000002 108.637 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.1 t -98.87 120.25 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-N 118.299 0.499 . . . . 48.960000000000001 111.626 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.1 t -85.98 119.66 34.63 Favored 'Isoleucine or valine' 0 C--O 1.263 1.811 0 N-CA-C 112.112 0.412 . . . . 42.640000000000001 112.112 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -159.28 159.82 34.51 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.669 -1.234 . . . . 37.950000000000003 107.669 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.2 168.45 10.3 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.926 1.29 . . . . 52.200000000000003 109.756 161.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -49.06 -40.3 30.95 Favored 'General case' 0 C--O 1.25 1.097 0 N-CA-C 114.652 1.353 . . . . 57.359999999999999 114.652 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.07 -27.19 63.45 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 118.059 -1.456 . . . . 63.219999999999999 111.095 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -66.35 -19.22 65.75 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.941 -0.763 . . . . 45.649999999999999 108.941 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -83.87 -27.76 28.44 Favored 'General case' 0 C--O 1.258 1.53 0 N-CA-C 117.093 2.257 . . . . 47.460000000000001 117.093 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -36.08 -59.16 0.63 Allowed 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 113.453 0.908 . . . . 38.880000000000003 113.453 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.674 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 13.9 pt-20 -57.08 -26.64 60.73 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.763 2.135 . . . . 66.790000000000006 116.763 -173.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -93.76 -30.16 15.01 Favored 'General case' 0 N--CA 1.425 -1.692 0 N-CA-C 107.021 -1.474 . . . . 46.119999999999997 107.021 -169.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -48.77 -40.87 30.51 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 120.919 0.39 . . . . 43.670000000000002 111.087 162.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -73.83 -53.63 9.82 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 115.826 -0.624 . . . . 52.859999999999999 110.781 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 66' ' ' GLU . 6.2 mt-10 -47.64 -36.47 11.01 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.055 1.132 . . . . 59.939999999999998 114.055 169.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.11 -23.5 57.92 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.719 1.007 . . . . 52.920000000000002 113.719 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.29 18.15 50.53 Favored Glycine 0 C--O 1.215 -1.071 0 C-N-CA 117.451 -2.309 . . . . 42.460000000000001 111.92 -178.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 pt -130.02 176.95 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 113.587 0.958 . . . . 44.289999999999999 113.587 -178.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -122.68 153.0 62.93 Favored Pre-proline 0 CA--C 1.494 -1.201 0 N-CA-C 109.281 -0.637 . . . . 55.740000000000002 109.281 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -69.12 149.6 71.17 Favored 'Trans proline' 0 N--CA 1.443 -1.444 0 O-C-N 122.559 0.768 . . . . 57.609999999999999 113.691 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.88 -29.75 27.82 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 125.119 3.88 . . . . 58.030000000000001 114.869 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -139.01 149.13 60.36 Favored Pre-proline 0 N--CA 1.446 -0.67 0 N-CA-C 107.964 -1.124 . . . . 98.480000000000004 107.964 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -63.05 151.59 83.94 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 118.264 -0.691 . . . . 72.469999999999999 113.006 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mt . . . . . 0 N--CA 1.474 0.732 0 C-N-CA 123.579 0.752 . . . . 70.689999999999998 109.792 178.44 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.79 ' O ' ' CA ' ' A' ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.978 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 121.595 0.712 . . . . 68.620000000000005 110.382 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.0 t -154.39 163.43 40.18 Favored 'General case' 0 C--O 1.244 0.793 0 N-CA-C 107.667 -1.234 . . . . 71.950000000000003 107.667 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 p -132.4 148.31 52.41 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.61 -0.681 . . . . 75.430000000000007 110.495 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -146.71 134.28 20.96 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.59 0.589 . . . . 93.439999999999998 112.59 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -93.92 133.8 36.96 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 122.47 1.128 . . . . 81.620000000000005 112.337 176.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -118.61 144.94 45.8 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 104.898 -2.26 . . . . 74.629999999999995 104.898 172.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.469 ' CD1' ' CE1' ' A' ' 24' ' ' TYR . 1.4 tt -136.85 161.63 35.79 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 N-CA-C 114.71 1.374 . . . . 57.850000000000001 114.71 173.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.669 ' HB3' ' OE1' ' A' ' 11' ' ' GLU . 27.6 mm-40 -91.51 145.74 24.37 Favored 'General case' 0 CA--C 1.498 -1.019 0 C-N-CA 123.835 0.854 . . . . 65.739999999999995 110.162 -179.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.72 -45.24 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 118.879 -1.128 . . . . 45.329999999999998 112.089 -177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.669 ' OE1' ' HB3' ' A' ' 9' ' ' GLU . 7.6 mp0 -64.89 9.83 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.804 1.409 . . . . 59.619999999999997 114.804 173.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -102.04 -5.57 24.41 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 120.288 -0.565 . . . . 51.590000000000003 112.015 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 84.4 mtp -101.71 163.84 12.05 Favored 'General case' 0 CA--C 1.489 -1.401 0 N-CA-C 106.952 -1.499 . . . . 47.649999999999999 106.952 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.2 m -98.52 137.68 36.82 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.687 -1.968 . . . . 39.060000000000002 105.687 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -106.7 143.44 34.8 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 106.85 -1.537 . . . . 43.909999999999997 106.85 174.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -122.81 99.92 41.12 Favored Pre-proline 0 CA--C 1.508 -0.668 0 N-CA-C 103.595 -2.743 . . . . 62.840000000000003 103.595 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.33 -34.52 93.45 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 123.35 2.7 . . . . 50.939999999999998 114.084 -172.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.978 ' HB2' ' O ' ' A' ' 204' ' ' HOH . 61.2 mt-10 -62.44 -30.6 71.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.924 -0.71 . . . . 88.819999999999993 109.092 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -104.78 -6.32 20.42 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 116.518 2.044 . . . . 47.149999999999999 116.518 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 48.5 45.36 20.99 Favored 'General case' 0 C--N 1.346 0.436 0 O-C-N 124.421 1.076 . . . . 52.640000000000001 112.801 -173.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 33.1 ttp -137.21 138.44 40.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 121.784 0.802 . . . . 60.75 112.586 -169.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -100.81 132.57 46.15 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.833 -1.173 . . . . 50.920000000000002 107.833 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . 0.414 ' HB ' ' HE ' ' A' ' 31' ' ' ARG . 73.3 p -120.88 163.5 18.11 Favored 'General case' 0 N--CA 1.439 -1.02 0 O-C-N 123.803 0.689 . . . . 54.950000000000003 112.046 177.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.469 ' CE1' ' CD1' ' A' ' 8' ' ' ILE . 60.9 t80 -150.94 143.62 16.44 Favored Pre-proline 0 C--O 1.236 0.348 0 N-CA-C 105.632 -1.988 . . . . 57.479999999999997 105.632 177.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -56.03 124.46 16.33 Favored 'Trans proline' 0 C--O 1.259 1.53 0 O-C-N 123.107 1.056 . . . . 62.359999999999999 111.471 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 30' ' ' ASP . 14.2 t -108.06 124.24 35.3 Favored Pre-proline 0 CA--C 1.514 -0.422 0 CA-C-N 114.526 -1.216 . . . . 80.829999999999998 111.231 -179.16 169.748 171.065 -88.058 104.013 2.016 106.062 175.198 178.927 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -72.38 45.42 0.82 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 121.682 1.588 . . . . 106.92 112.404 -172.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' CB ' ' OG ' ' A' ' 50' ' ' SER . 83.6 m -140.81 -158.47 0.86 Allowed 'General case' 0 N--CA 1.448 -0.549 1 N-CA-C 100.041 -4.059 . . . . 124.8 100.041 170.736 -64.307 164.434 123.335 104.294 2.049 105.765 -140.933 21.397 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.79 ' CA ' ' O ' ' A' ' 201' ' ' HOH . . . -79.76 -4.5 89.43 Favored Glycine 0 N--CA 1.467 0.748 0 C-N-CA 119.524 -1.322 . . . . 101.58 111.598 -175.6 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . 1.139 ' HB2' ' HB3' ' A' ' 50' ' ' SER . 0.7 OUTLIER -117.51 -169.02 1.59 Allowed 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 112.611 0.597 . . . . 87.430000000000007 112.611 -159.306 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.414 ' HE ' ' HB ' ' A' ' 23' ' ' THR . 77.4 mtp85 -127.16 139.22 53.1 Favored 'General case' 0 C--O 1.254 1.332 0 C-N-CA 119.668 -0.813 . . . . 74.069999999999993 112.369 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -53.77 138.32 35.87 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 107.751 -1.203 . . . . 69.030000000000001 107.751 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.62 145.41 30.94 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 119.692 -0.803 . . . . 75.480000000000004 112.616 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 16.9 tt -162.18 140.92 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 108.049 -1.093 . . . . 38.850000000000001 108.049 -175.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -102.74 145.39 29.8 Favored 'General case' 0 CA--C 1.498 -1.02 0 O-C-N 125.299 1.624 . . . . 42.119999999999997 110.35 -167.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.5 tp -57.72 -42.51 83.97 Favored 'General case' 0 N--CA 1.422 -1.871 0 O-C-N 125.101 1.501 . . . . 40.439999999999998 112.297 179.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 52.6 p-10 -71.47 -31.83 67.6 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.713 -1.195 . . . . 40.439999999999998 109.666 -169.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -68.69 -46.39 69.15 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 115.43 -0.804 . . . . 42.82 112.898 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 mtp -54.72 -44.08 73.18 Favored 'General case' 0 C--O 1.202 -1.441 0 O-C-N 124.673 1.233 . . . . 41.770000000000003 114.091 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -52.43 -41.0 62.86 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 110.271 -0.27 . . . . 51.890000000000001 110.271 172.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.735 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . 11.1 mm-40 -75.22 -12.83 60.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.873 1.064 . . . . 48.390000000000001 113.873 -179.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 128.6 -35.12 2.73 Favored Glycine 0 N--CA 1.482 1.76 0 N-CA-C 118.263 2.065 . . . . 44.729999999999997 118.263 172.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -36.12 121.6 0.68 Allowed 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.336 1.236 . . . . 50.890000000000001 114.336 174.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -124.38 8.7 8.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.96 0.886 . . . . 70.420000000000002 111.893 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 43.5 t -111.26 121.13 63.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 C-N-CA 119.904 -0.718 . . . . 39.32 110.637 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -95.46 133.72 39.11 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-N 115.72 -0.673 . . . . 54.710000000000001 110.584 170.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.63 125.67 62.5 Favored 'Isoleucine or valine' 0 C--O 1.241 0.622 0 C-N-CA 126.976 2.11 . . . . 72.700000000000003 112.539 -175.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 46.4 t -102.93 101.17 19.5 Favored Pre-proline 0 CA--C 1.556 1.182 0 N-CA-C 113.487 0.921 . . . . 83.560000000000002 113.487 167.39 178.927 175.198 -88.058 106.062 2.016 104.013 171.065 169.748 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.474 ' HA ' ' O ' ' A' ' 51' ' ' CYS . 96.8 Cg_endo -92.1 25.81 0.44 Allowed 'Trans proline' 0 CA--C 1.574 2.506 1 C-N-CA 126.262 4.641 . . . . 114.73 119.867 -176.822 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . 1.139 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 81.6 p -88.37 -19.99 25.9 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 106.94 -1.504 . . . . 148.71000000000001 106.94 164.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.474 ' O ' ' HA ' ' A' ' 49' ' ' PRO . 0.5 OUTLIER -135.0 -159.24 0.94 Allowed 'General case' 0 N--CA 1.428 -1.547 1 N-CA-C 99.675 -4.194 . . . . 120.22 99.675 169.152 21.397 -140.933 123.335 105.765 2.049 104.294 164.434 -64.307 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 t -118.31 139.27 51.6 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 105.449 -2.056 . . . . 109.01000000000001 105.449 152.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.509 HD23 ' H ' ' A' ' 54' ' ' MET . 2.8 tt -167.81 154.14 7.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 100.845 -3.761 . . . . 95.650000000000006 100.845 177.029 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' MET . . . . . 0.509 ' H ' HD23 ' A' ' 53' ' ' LEU . 49.2 mtt -149.06 128.05 12.69 Favored 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 119.609 -0.836 . . . . 68.510000000000005 110.91 -167.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 16.5 tt -123.2 142.97 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 124.152 0.908 . . . . 62.509999999999998 111.629 -176.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -90.94 122.71 33.85 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 126.037 1.735 . . . . 55.990000000000002 108.637 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.1 t -98.87 120.25 47.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-N 118.299 0.499 . . . . 48.960000000000001 111.626 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.1 t -85.98 119.66 34.63 Favored 'Isoleucine or valine' 0 C--O 1.263 1.811 0 N-CA-C 112.112 0.412 . . . . 42.640000000000001 112.112 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.2 p90 -159.28 159.82 34.51 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 107.669 -1.234 . . . . 37.950000000000003 107.669 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -117.2 168.45 10.3 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.926 1.29 . . . . 52.200000000000003 109.756 161.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttp -49.06 -40.3 30.95 Favored 'General case' 0 C--O 1.25 1.097 0 N-CA-C 114.652 1.353 . . . . 57.359999999999999 114.652 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.07 -27.19 63.45 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 118.059 -1.456 . . . . 63.219999999999999 111.095 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -66.35 -19.22 65.75 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.941 -0.763 . . . . 45.649999999999999 108.941 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 70.8 mt -83.87 -27.76 28.44 Favored 'General case' 0 C--O 1.258 1.53 0 N-CA-C 117.093 2.257 . . . . 47.460000000000001 117.093 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -36.08 -59.16 0.63 Allowed 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 113.453 0.908 . . . . 38.880000000000003 113.453 173.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.674 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 13.9 pt-20 -57.08 -26.64 60.73 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.763 2.135 . . . . 66.790000000000006 116.763 -173.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -93.76 -30.16 15.01 Favored 'General case' 0 N--CA 1.425 -1.692 0 N-CA-C 107.021 -1.474 . . . . 46.119999999999997 107.021 -169.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -48.77 -40.87 30.51 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 120.919 0.39 . . . . 43.670000000000002 111.087 162.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -73.83 -53.63 9.82 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 115.826 -0.624 . . . . 52.859999999999999 110.781 -172.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 66' ' ' GLU . 6.2 mt-10 -47.64 -36.47 11.01 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 114.055 1.132 . . . . 59.939999999999998 114.055 169.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.11 -23.5 57.92 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.719 1.007 . . . . 52.920000000000002 113.719 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.29 18.15 50.53 Favored Glycine 0 C--O 1.215 -1.071 0 C-N-CA 117.451 -2.309 . . . . 42.460000000000001 111.92 -178.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 pt -130.02 176.95 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 113.587 0.958 . . . . 44.289999999999999 113.587 -178.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -122.68 153.0 62.93 Favored Pre-proline 0 CA--C 1.494 -1.201 0 N-CA-C 109.281 -0.637 . . . . 55.740000000000002 109.281 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -69.12 149.6 71.17 Favored 'Trans proline' 0 N--CA 1.443 -1.444 0 O-C-N 122.559 0.768 . . . . 57.609999999999999 113.691 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.88 -29.75 27.82 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 125.119 3.88 . . . . 58.030000000000001 114.869 174.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -139.01 149.13 60.36 Favored Pre-proline 0 N--CA 1.446 -0.67 0 N-CA-C 107.964 -1.124 . . . . 98.480000000000004 107.964 170.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -63.05 151.59 83.94 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 118.264 -0.691 . . . . 72.469999999999999 113.006 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 49.6 mt . . . . . 0 N--CA 1.474 0.732 0 C-N-CA 123.579 0.752 . . . . 70.689999999999998 109.792 178.44 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.79 ' O ' ' CA ' ' A' ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.978 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_