data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 6.20 _LACS_plot.Line_2_terminator_val_y_2 4.73 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 VAL 1.70 -1.90 0 11 ARG 4.80 3.80 1 12 ALA 4.10 2.70 1 13 ALA 3.30 2.40 1 14 TYR 2.60 2.60 1 15 ASN 3.60 2.20 1 16 LEU 3.10 3.00 1 17 VAL 3.30 2.60 1 18 ARG 2.43 1.54 1 19 ASP -0.30 -0.40 1 20 ASP 2.60 2.10 1 22 SER -1.70 -0.90 1 23 ALA 0.70 0.20 1 24 VAL 1.80 1.20 1 25 ILE -0.80 -0.30 1 26 TRP -6.20 -2.90 1 27 VAL -4.70 -2.60 1 28 THR -6.10 -3.10 1 29 PHE -1.90 -1.70 1 30 LYS -7.00 -3.10 1 31 TYR 1.20 1.10 1 32 ASP -1.80 -1.60 1 34 SER -0.50 -0.50 1 35 THR -0.90 -0.50 1 36 ILE 1.20 0.50 1 37 VAL -2.60 -1.70 1 40 GLU -2.70 -0.80 1 41 GLN -5.90 -3.00 1 43 ALA -3.20 -0.30 1 44 GLU -2.90 -1.70 1 45 TYR 6.00 5.60 1 46 GLN 5.30 3.20 1 47 HIS 0.40 2.30 1 48 PHE 6.00 1.10 1 49 ILE 6.10 4.10 1 50 GLN 2.70 1.60 1 51 GLN 0.70 -0.30 1 53 THR -1.80 -1.40 1 54 ASP 3.10 3.00 1 55 ASP -1.50 -0.60 1 56 VAL -5.40 -2.40 1 57 ARG -5.40 -3.30 1 58 LEU -2.90 -0.20 1 59 PHE -5.20 -2.30 1 60 ALA -7.40 -1.50 1 61 PHE -4.60 -1.10 1 62 VAL -5.30 -1.90 1 63 ARG -3.90 -1.20 1 64 PHE -2.70 -0.70 1 65 THR -0.10 0.20 1 66 THR -1.90 -1.20 1 68 ASP -2.20 -1.10 1 69 ALA 2.70 2.00 1 70 MET 1.70 0.90 1 71 SER -0.70 -0.80 1 72 LYS 0.70 0.50 1 73 ARG -2.50 -0.90 1 74 SER -1.50 -0.20 1 75 LYS -6.40 -1.70 1 76 PHE -4.30 -1.30 1 77 ALA -6.40 -2.30 1 78 LEU -2.80 -1.40 1 79 ILE -4.60 -0.50 1 80 THR 2.30 1.50 1 81 TRP -3.80 -2.40 1 82 ILE -2.10 -1.50 1 84 GLU 2.10 2.30 1 85 ASN 0.30 -0.50 1 86 VAL 2.90 1.10 1 87 SER -1.50 -0.30 1 89 LEU 3.20 2.90 1 90 GLN 4.00 3.10 1 91 ARG 4.90 4.00 1 92 ALA 3.60 2.50 1 93 LYS 3.40 2.50 1 94 THR 6.20 5.60 1 96 THR 4.60 3.50 1 97 ASP 3.40 2.50 1 98 LYS 4.30 3.10 1 99 THR 5.70 4.50 1 100 LEU 3.50 2.30 1 101 VAL 5.40 3.60 1 102 LYS 3.90 2.90 1 103 GLU 2.80 2.20 1 104 VAL 1.30 1.20 1 106 GLN 0.20 1.60 1 107 ASN -1.30 -0.20 1 108 PHE -1.70 -1.80 1 109 ALA 0.90 1.60 1 110 LYS -4.70 -0.90 1 111 GLU -6.10 -3.70 1 112 PHE -5.50 -1.00 1 113 VAL 1.60 0.80 1 114 ILE -4.10 -0.10 1 115 SER -3.50 -1.00 1 116 ASP -4.70 -1.90 1 117 ARG 4.30 3.70 1 118 LYS 5.00 3.40 1 119 GLU 0.80 0.20 1 120 LEU -2.90 -1.60 1 121 GLU 1.70 1.60 1 122 GLU 3.70 3.90 1 123 ASN 4.40 3.20 1 124 PHE 4.50 3.50 1 125 ILE 5.80 2.70 1 126 LYS 5.70 4.80 1 127 SER 4.00 3.10 1 128 GLU 1.70 2.10 1 129 LEU 2.70 2.00 1 130 LYS 3.00 2.40 1 131 LYS 1.30 1.10 1 132 ALA 0.00 0.20 1 135 ALA -0.10 0.10 1 136 ASN 0.10 0.00 1 137 TYR 0.40 0.40 1 138 ASP -0.10 0.00 1 139 ALA 0.80 0.80 1 140 GLN 1.40 1.00 1 141 THR 1.40 1.10 1 142 GLU 0.50 0.50 1 143 LEU 0.80 0.70 1 144 GLU 0.10 0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 4.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 6.20 _LACS_plot.Line_2_terminator_val_y_2 -1.47 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 VAL 1.70 -3.60 0 11 ARG 4.80 -1.00 1 12 ALA 4.10 -1.40 1 13 ALA 3.30 -0.90 1 14 TYR 2.60 0.00 1 15 ASN 3.60 -1.40 1 16 LEU 3.10 -0.10 1 17 VAL 3.30 -0.70 1 18 ARG 2.43 -0.89 1 19 ASP -0.30 -0.10 1 20 ASP 2.60 -0.50 1 22 SER -1.70 0.80 1 23 ALA 0.70 -0.50 1 24 VAL 1.80 -0.60 1 25 ILE -0.80 0.50 1 26 TRP -6.20 3.30 1 27 VAL -4.70 2.10 1 28 THR -6.10 3.00 1 29 PHE -1.90 0.20 1 30 LYS -7.00 3.90 1 31 TYR 1.20 -0.10 1 32 ASP -1.80 0.20 1 34 SER -0.50 0.00 1 35 THR -0.90 0.40 1 36 ILE 1.20 -0.70 1 37 VAL -2.60 0.90 1 40 GLU -2.70 1.90 1 41 GLN -5.90 2.90 1 43 ALA -3.20 2.90 1 44 GLU -2.90 1.20 1 45 TYR 6.00 -0.40 1 46 GLN 5.30 -2.10 1 47 HIS 0.40 1.90 1 48 PHE 6.00 -4.90 1 49 ILE 6.10 -2.00 1 50 GLN 2.70 -1.10 1 51 GLN 0.70 -1.00 1 53 THR -1.80 0.40 1 54 ASP 3.10 -0.10 1 55 ASP -1.50 0.90 1 56 VAL -5.40 3.00 1 57 ARG -5.40 2.10 1 58 LEU -2.90 2.70 1 59 PHE -5.20 2.90 1 60 ALA -7.40 5.90 1 61 PHE -4.60 3.50 1 62 VAL -5.30 3.40 1 63 ARG -3.90 2.70 1 64 PHE -2.70 2.00 1 65 THR -0.10 0.30 1 66 THR -1.90 0.70 1 68 ASP -2.20 1.10 1 69 ALA 2.70 -0.70 1 70 MET 1.70 -0.80 1 71 SER -0.70 -0.10 1 72 LYS 0.70 -0.20 1 73 ARG -2.50 1.60 1 74 SER -1.50 1.30 1 75 LYS -6.40 4.70 1 76 PHE -4.30 3.00 1 77 ALA -6.40 4.10 1 78 LEU -2.80 1.40 1 79 ILE -4.60 4.10 1 80 THR 2.30 -0.80 1 81 TRP -3.80 1.40 1 82 ILE -2.10 0.60 1 84 GLU 2.10 0.20 1 85 ASN 0.30 -0.80 1 86 VAL 2.90 -1.80 1 87 SER -1.50 1.20 1 89 LEU 3.20 -0.30 1 90 GLN 4.00 -0.90 1 91 ARG 4.90 -0.90 1 92 ALA 3.60 -1.10 1 93 LYS 3.40 -0.90 1 94 THR 6.20 -0.60 1 96 THR 4.60 -1.10 1 97 ASP 3.40 -0.90 1 98 LYS 4.30 -1.20 1 99 THR 5.70 -1.20 1 100 LEU 3.50 -1.20 1 101 VAL 5.40 -1.80 1 102 LYS 3.90 -1.00 1 103 GLU 2.80 -0.60 1 104 VAL 1.30 -0.10 1 106 GLN 0.20 1.40 1 107 ASN -1.30 1.10 1 108 PHE -1.70 -0.10 1 109 ALA 0.90 0.70 1 110 LYS -4.70 3.80 1 111 GLU -6.10 2.40 1 112 PHE -5.50 4.50 1 113 VAL 1.60 -0.80 1 114 ILE -4.10 4.00 1 115 SER -3.50 2.50 1 116 ASP -4.70 2.80 1 117 ARG 4.30 -0.60 1 118 LYS 5.00 -1.60 1 119 GLU 0.80 -0.60 1 120 LEU -2.90 1.30 1 121 GLU 1.70 -0.10 1 122 GLU 3.70 0.20 1 123 ASN 4.40 -1.20 1 124 PHE 4.50 -1.00 1 125 ILE 5.80 -3.10 1 126 LYS 5.70 -0.90 1 127 SER 4.00 -0.90 1 128 GLU 1.70 0.40 1 129 LEU 2.70 -0.70 1 130 LYS 3.00 -0.60 1 131 LYS 1.30 -0.20 1 132 ALA 0.00 0.20 1 135 ALA -0.10 0.20 1 136 ASN 0.10 -0.10 1 137 TYR 0.40 0.00 1 138 ASP -0.10 0.10 1 139 ALA 0.80 0.00 1 140 GLN 1.40 -0.40 1 141 THR 1.40 -0.30 1 142 GLU 0.50 0.00 1 143 LEU 0.80 -0.10 1 144 GLU 0.10 0.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 1.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 6.20 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 PHE 6.00 -2.26 0 11 ARG 4.80 -0.62 1 12 ALA 4.10 -0.14 1 13 ALA 3.30 -0.09 1 14 TYR 2.60 -0.43 1 15 ASN 3.60 -0.74 1 16 LEU 3.10 -0.15 1 17 VAL 3.30 -0.32 1 18 ARG 2.43 -0.32 1 19 ASP -0.30 -0.16 1 20 ASP 2.60 -0.33 1 22 SER -1.70 -0.08 1 23 ALA 0.70 -0.14 1 24 VAL 1.80 -0.72 1 25 ILE -0.80 0.35 1 26 TRP -6.20 0.99 1 27 VAL -4.70 0.85 1 28 THR -6.10 1.24 1 29 PHE -1.90 0.73 1 30 LYS -7.00 0.90 1 31 TYR 1.20 -0.02 1 32 ASP -1.80 0.20 1 34 SER -0.50 0.32 1 35 THR -0.90 0.51 1 36 ILE 1.20 0.33 1 37 VAL -2.60 0.34 1 40 GLU -2.70 0.11 1 41 GLN -5.90 0.04 1 43 ALA -3.20 0.37 1 44 GLU -2.90 0.48 1 45 TYR 6.00 -0.73 1 46 GLN 5.30 -0.55 1 47 HIS 0.40 -0.32 1 49 ILE 6.10 -1.90 1 50 GLN 2.70 -0.72 1 51 GLN 0.70 -0.57 1 53 THR -1.80 0.07 1 54 ASP 3.10 0.09 1 55 ASP -1.50 -0.05 1 56 VAL -5.40 0.76 1 57 ARG -5.40 1.19 1 58 LEU -2.90 0.51 1 59 PHE -5.20 1.27 1 60 ALA -7.40 1.22 1 61 PHE -4.60 1.26 1 62 VAL -5.30 0.84 1 63 ARG -3.90 -0.14 1 64 PHE -2.70 -0.06 1 65 THR -0.10 0.48 1 66 THR -1.90 0.25 1 68 ASP -2.20 -0.02 1 69 ALA 2.70 -0.30 1 70 MET 1.70 -0.02 1 71 SER -0.70 0.05 1 72 LYS 0.70 0.20 1 73 ARG -2.50 0.21 1 74 SER -1.50 0.70 1 75 LYS -6.40 0.28 1 76 PHE -4.30 0.96 1 77 ALA -6.40 1.28 1 78 LEU -2.80 1.20 1 79 ILE -4.60 0.78 1 80 THR 2.30 0.47 1 81 TRP -3.80 0.86 1 82 ILE -2.10 -0.38 1 84 GLU 2.10 -0.40 1 85 ASN 0.30 0.09 1 86 VAL 2.90 -0.34 1 87 SER -1.50 -0.19 1 89 LEU 3.20 -0.18 1 90 GLN 4.00 -0.46 1 91 ARG 4.90 -0.69 1 92 ALA 3.60 -0.21 1 93 LYS 3.40 -0.21 1 94 THR 6.20 -0.19 1 96 THR 4.60 -0.13 1 97 ASP 3.40 -0.25 1 98 LYS 4.30 -0.85 1 99 THR 5.70 -0.69 1 100 LEU 3.50 -0.40 1 101 VAL 5.40 -1.31 1 102 LYS 3.90 -0.46 1 103 GLU 2.80 -0.46 1 104 VAL 1.30 -0.52 1 105 VAL 1.70 -1.43 1 106 GLN 0.20 -0.20 1 107 ASN -1.30 -0.04 1 108 PHE -1.70 0.26 1 109 ALA 0.90 0.11 1 110 LYS -4.70 0.17 1 111 GLU -6.10 1.48 1 112 PHE -5.50 0.35 1 113 VAL 1.60 0.85 1 114 ILE -4.10 0.27 1 115 SER -3.50 -0.85 1 116 ASP -4.70 0.39 1 117 ARG 4.30 -0.54 1 118 LYS 5.00 -0.27 1 119 GLU 0.80 -0.82 1 120 LEU -2.90 -0.02 1 121 GLU 1.70 -0.38 1 122 GLU 3.70 -0.87 1 123 ASN 4.40 -0.45 1 124 PHE 4.50 -0.40 1 125 ILE 5.80 -1.06 1 126 LYS 5.70 -1.03 1 127 SER 4.00 -0.41 1 128 GLU 1.70 -0.41 1 129 LEU 2.70 -0.40 1 130 LYS 3.00 -0.33 1 131 LYS 1.30 -0.20 1 132 ALA 0.00 -0.03 1 135 ALA -0.10 -0.07 1 136 ASN 0.10 -0.10 1 137 TYR 0.40 -0.08 1 138 ASP -0.10 -0.13 1 139 ALA 0.80 -0.16 1 140 GLN 1.40 -0.09 1 141 THR 1.40 -0.17 1 142 GLU 0.50 -0.15 1 143 LEU 0.80 -0.16 1 144 GLU 0.10 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6071_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -3.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.05 _LACS_plot.Line_2_terminator_val_x_2 6.20 _LACS_plot.Line_2_terminator_val_y_2 2.12 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 112 PHE -5.50 0.00 0 53 THR -1.80 2.00 0 44 GLU -2.90 1.60 0 47 HIS 0.40 3.00 0 109 ALA 0.90 -3.10 0 105 VAL 1.70 -2.90 0 116 ASP -4.70 0.90 0 11 ARG 4.80 1.10 1 12 ALA 4.10 2.20 1 13 ALA 3.30 0.40 1 14 TYR 2.60 0.50 1 15 ASN 3.60 2.50 1 16 LEU 3.10 1.20 1 17 VAL 3.30 1.40 1 18 ARG 2.43 -0.80 1 19 ASP -0.30 0.20 1 20 ASP 2.60 1.00 1 22 SER -1.70 0.30 1 23 ALA 0.70 -1.10 1 24 VAL 1.80 -1.30 1 25 ILE -0.80 -2.60 1 26 TRP -6.20 -2.80 1 27 VAL -4.70 -1.70 1 28 THR -6.10 -0.80 1 29 PHE -1.90 -1.90 1 30 LYS -7.00 -2.60 1 31 TYR 1.20 1.00 1 32 ASP -1.80 0.50 1 34 SER -0.50 -2.30 1 35 THR -0.90 -2.00 1 36 ILE 1.20 -2.30 1 37 VAL -2.60 -1.70 1 40 GLU -2.70 -2.70 1 41 GLN -5.90 -1.90 1 43 ALA -3.20 -1.00 1 45 TYR 6.00 1.40 1 46 GLN 5.30 1.90 1 48 PHE 6.00 1.00 1 49 ILE 6.10 1.90 1 50 GLN 2.70 1.10 1 51 GLN 0.70 0.30 1 54 ASP 3.10 -1.30 1 55 ASP -1.50 -0.90 1 56 VAL -5.40 -2.70 1 57 ARG -5.40 -2.20 1 58 LEU -2.90 -3.90 1 59 PHE -5.20 -0.60 1 60 ALA -7.40 -3.50 1 61 PHE -4.60 -1.90 1 62 VAL -5.30 -2.90 1 63 ARG -3.90 -2.20 1 64 PHE -2.70 -0.50 1 65 THR -0.10 -0.40 1 66 THR -1.90 -0.80 1 68 ASP -2.20 -0.50 1 69 ALA 2.70 0.90 1 70 MET 1.70 0.50 1 71 SER -0.70 -0.90 1 72 LYS 0.70 0.10 1 73 ARG -2.50 -0.60 1 74 SER -1.50 -1.20 1 75 LYS -6.40 -2.50 1 76 PHE -4.30 -0.60 1 77 ALA -6.40 -3.00 1 78 LEU -2.80 -2.60 1 79 ILE -4.60 -1.50 1 80 THR 2.30 -1.80 1 81 TRP -3.80 -1.50 1 82 ILE -2.10 -2.20 1 84 GLU 2.10 0.40 1 85 ASN 0.30 0.70 1 86 VAL 2.90 0.00 1 87 SER -1.50 0.20 1 89 LEU 3.20 1.70 1 90 GLN 4.00 3.60 1 91 ARG 4.90 2.00 1 92 ALA 3.60 2.90 1 93 LYS 3.40 1.40 1 94 THR 6.20 1.40 1 96 THR 4.60 2.30 1 97 ASP 3.40 1.10 1 98 LYS 4.30 0.70 1 99 THR 5.70 1.30 1 100 LEU 3.50 1.40 1 101 VAL 5.40 2.30 1 102 LYS 3.90 -0.40 1 103 GLU 2.80 1.10 1 104 VAL 1.30 -1.40 1 106 GLN 0.20 0.00 1 107 ASN -1.30 -2.40 1 108 PHE -1.70 -2.00 1 110 LYS -4.70 -3.40 1 111 GLU -6.10 -2.00 1 113 VAL 1.60 -1.10 1 114 ILE -4.10 -3.20 1 115 SER -3.50 -2.80 1 117 ARG 4.30 2.80 1 118 LYS 5.00 2.70 1 119 GLU 0.80 -2.70 1 120 LEU -2.90 -0.20 1 121 GLU 1.70 0.90 1 122 GLU 3.70 1.10 1 123 ASN 4.40 2.70 1 124 PHE 4.50 1.70 1 125 ILE 5.80 2.00 1 126 LYS 5.70 2.50 1 127 SER 4.00 2.50 1 128 GLU 1.70 3.10 1 129 LEU 2.70 0.80 1 130 LYS 3.00 1.20 1 131 LYS 1.30 0.20 1 132 ALA 0.00 0.10 1 135 ALA -0.10 -0.40 1 136 ASN 0.10 -0.30 1 137 TYR 0.40 -0.50 1 138 ASP -0.10 -0.50 1 139 ALA 0.80 0.40 1 140 GLN 1.40 0.80 1 141 THR 1.40 0.30 1 142 GLU 0.50 0.20 1 143 LEU 0.80 0.10 1 144 GLU 0.10 -0.20 1 stop_ save_