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 bmr17962_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 -3.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.81 _LACS_plot.Line_2_terminator_val_x_2 5.62 _LACS_plot.Line_2_terminator_val_y_2 3.63 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 PHE -6.75 -1.44 0 10 ALA -6.04 -1.82 1 11 ARG -3.85 -1.96 1 12 ILE -3.10 -1.49 1 13 TYR -3.17 -2.08 1 14 LYS -1.78 -2.69 1 16 ALA 0.22 -0.23 1 17 LYS 3.96 -0.16 1 20 MET 1.54 -1.45 1 21 GLN 0.32 -0.05 1 22 SER 0.19 -0.20 1 24 HIS 4.44 3.16 1 26 LYS 0.93 -0.03 1 27 LEU 0.47 0.04 1 28 LYS 0.30 -0.95 1 29 ALA -0.50 0.69 1 30 TRP -0.41 -0.65 1 31 LYS -4.45 -2.70 1 32 LEU -4.54 -1.27 1 33 GLU -7.04 -2.71 1 34 PHE 0.34 0.30 1 35 GLU -0.85 -0.44 1 37 SER 0.30 -0.01 1 39 THR 0.60 0.04 1 40 GLN 0.44 -0.04 1 41 TYR 0.02 -0.38 1 42 THR -0.02 -0.40 1 43 GLU 0.32 0.34 1 45 LEU 0.71 -0.15 1 46 MET 0.53 -0.26 1 47 ASN 0.51 -0.25 1 48 TRP 0.06 -0.28 1 49 THR 0.15 -0.29 1 51 SER -0.30 -0.61 1 52 HIS -0.15 0.88 1 53 ASP -0.04 -0.36 1 54 THR 0.75 0.11 1 55 LYS 3.13 -0.20 1 56 GLN -0.14 -0.37 1 57 GLN -0.49 -0.38 1 58 VAL 0.68 0.01 1 60 LEU -4.29 -1.64 1 61 SER -2.76 -1.43 1 63 THR 3.82 2.76 1 64 THR -6.19 -3.47 1 65 ARG 4.47 2.22 1 66 GLU 5.55 3.72 1 67 LEU 2.98 2.05 1 68 ALA 2.35 1.19 1 69 ILE 4.84 3.80 1 70 ALA 3.90 2.05 1 71 TYR 4.22 3.76 1 72 ALA 5.31 3.07 1 73 VAL 4.53 3.38 1 74 ALA 3.17 1.53 1 75 HIS 2.02 1.14 1 76 LYS 5.62 0.79 1 77 ILE -1.55 -0.88 1 78 ASP 0.40 -0.31 1 79 TYR -5.79 -3.04 1 80 THR -2.67 -1.22 1 81 VAL -0.34 -1.29 1 82 LEU 0.00 -0.76 1 83 GLN -0.54 -0.37 1 84 ASP -0.45 -0.50 1 85 ASN -0.10 -0.33 1 87 ARG 0.31 -0.27 1 88 THR 0.38 -0.10 1 89 ILE -0.11 -0.72 1 90 VAL 0.26 -0.29 1 92 LYS 0.44 -0.11 1 93 SER -0.50 -0.75 1 94 TYR 0.25 -0.19 1 95 ALA -0.13 -0.34 1 96 ASP 0.26 -0.13 1 97 ASN 0.53 -0.10 1 98 PHE 0.52 -0.13 1 99 THR 0.17 -0.28 1 100 LYS 0.28 -0.28 1 102 ARG 0.44 -0.21 1 103 ASP 0.47 -0.07 1 104 MET 0.72 1.35 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17962_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 3.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 5.62 _LACS_plot.Line_2_terminator_val_y_2 -1.99 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 PHE -6.75 5.31 0 10 ALA -6.04 4.22 1 11 ARG -3.85 1.89 1 12 ILE -3.10 1.61 1 13 TYR -3.17 1.09 1 14 LYS -1.78 -0.91 1 16 ALA 0.22 -0.45 1 17 LYS 3.96 -4.12 1 20 MET 1.54 -2.99 1 21 GLN 0.32 -0.37 1 22 SER 0.19 -0.39 1 24 HIS 4.44 -1.28 1 26 LYS 0.93 -0.96 1 27 LEU 0.47 -0.43 1 28 LYS 0.30 -1.25 1 29 ALA -0.50 1.19 1 30 TRP -0.41 -0.24 1 31 LYS -4.45 1.75 1 32 LEU -4.54 3.27 1 33 GLU -7.04 4.33 1 34 PHE 0.34 -0.04 1 35 GLU -0.85 0.41 1 37 SER 0.30 -0.31 1 39 THR 0.60 -0.56 1 40 GLN 0.44 -0.48 1 41 TYR 0.02 -0.40 1 42 THR -0.02 -0.38 1 43 GLU 0.32 0.02 1 45 LEU 0.71 -0.86 1 46 MET 0.53 -0.79 1 47 ASN 0.51 -0.76 1 48 TRP 0.06 -0.34 1 49 THR 0.15 -0.44 1 51 SER -0.30 -0.31 1 52 HIS -0.15 1.03 1 53 ASP -0.04 -0.32 1 54 THR 0.75 -0.64 1 55 LYS 3.13 -3.33 1 56 GLN -0.14 -0.23 1 57 GLN -0.49 0.11 1 58 VAL 0.68 -0.67 1 60 LEU -4.29 2.65 1 61 SER -2.76 1.33 1 63 THR 3.82 -1.06 1 64 THR -6.19 2.72 1 65 ARG 4.47 -2.25 1 66 GLU 5.55 -1.83 1 67 LEU 2.98 -0.93 1 68 ALA 2.35 -1.16 1 69 ILE 4.84 -1.04 1 70 ALA 3.90 -1.85 1 71 TYR 4.22 -0.46 1 72 ALA 5.31 -2.24 1 73 VAL 4.53 -1.15 1 74 ALA 3.17 -1.64 1 75 HIS 2.02 -0.88 1 76 LYS 5.62 -4.83 1 77 ILE -1.55 0.67 1 78 ASP 0.40 -0.71 1 79 TYR -5.79 2.75 1 80 THR -2.67 1.45 1 81 VAL -0.34 -0.95 1 82 LEU 0.00 -0.76 1 83 GLN -0.54 0.17 1 84 ASP -0.45 -0.05 1 85 ASN -0.10 -0.23 1 87 ARG 0.31 -0.58 1 88 THR 0.38 -0.48 1 89 ILE -0.11 -0.61 1 90 VAL 0.26 -0.55 1 92 LYS 0.44 -0.55 1 93 SER -0.50 -0.25 1 94 TYR 0.25 -0.44 1 95 ALA -0.13 -0.21 1 96 ASP 0.26 -0.39 1 97 ASN 0.53 -0.63 1 98 PHE 0.52 -0.65 1 99 THR 0.17 -0.45 1 100 LYS 0.28 -0.56 1 102 ARG 0.44 -0.65 1 103 ASP 0.47 -0.54 1 104 MET 0.72 0.63 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17962_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 0.36 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.10 _LACS_plot.Line_2_terminator_val_x_2 5.62 _LACS_plot.Line_2_terminator_val_y_2 -0.41 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ALA 2.35 -2.28 0 10 ALA -6.04 0.83 1 11 ARG -3.85 1.00 1 12 ILE -3.10 1.59 1 13 TYR -3.17 0.62 1 14 LYS -1.78 -0.10 1 16 ALA 0.22 -0.09 1 21 GLN 0.32 0.00 1 22 SER 0.19 -0.59 1 26 LYS 0.93 -0.03 1 27 LEU 0.47 -0.08 1 28 LYS 0.30 -0.02 1 29 ALA -0.50 -0.24 1 30 TRP -0.41 -0.32 1 31 LYS -4.45 0.77 1 32 LEU -4.54 0.79 1 33 GLU -7.04 0.86 1 34 PHE 0.34 0.25 1 37 SER 0.30 -0.62 1 39 THR 0.60 -0.12 1 40 GLN 0.44 -0.04 1 41 TYR 0.02 0.09 1 42 THR -0.02 -0.06 1 45 LEU 0.71 -0.06 1 46 MET 0.53 -0.10 1 47 ASN 0.51 -0.07 1 48 TRP 0.06 0.08 1 49 THR 0.15 -0.11 1 52 HIS -0.15 -0.10 1 53 ASP -0.04 0.00 1 55 LYS 3.13 0.10 1 56 GLN -0.14 -0.03 1 57 GLN -0.49 0.07 1 58 VAL 0.68 -0.01 1 60 LEU -4.29 0.24 1 61 SER -2.76 1.04 1 62 PHE -6.75 0.27 1 63 THR 3.82 0.12 1 64 THR -6.19 0.27 1 65 ARG 4.47 -1.89 1 66 GLU 5.55 -0.77 1 67 LEU 2.98 -0.32 1 69 ILE 4.84 -1.53 1 70 ALA 3.90 -0.40 1 71 TYR 4.22 -0.40 1 72 ALA 5.31 -0.39 1 73 VAL 4.53 -0.27 1 74 ALA 3.17 -0.29 1 75 HIS 2.02 -0.30 1 76 LYS 5.62 -0.35 1 77 ILE -1.55 0.00 1 78 ASP 0.40 0.06 1 79 TYR -5.79 1.32 1 80 THR -2.67 0.13 1 81 VAL -0.34 0.89 1 82 LEU 0.00 0.28 1 84 ASP -0.45 0.01 1 87 ARG 0.31 0.01 1 88 THR 0.38 -0.05 1 89 ILE -0.11 0.02 1 92 LYS 0.44 -0.08 1 93 SER -0.50 -0.05 1 94 TYR 0.25 -0.02 1 95 ALA -0.13 -0.06 1 96 ASP 0.26 -0.13 1 97 ASN 0.53 -0.11 1 98 PHE 0.52 0.03 1 99 THR 0.17 -0.09 1 102 ARG 0.44 -0.05 1 103 ASP 0.47 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17962_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.04 _LACS_plot.Line_1_terminator_val_y_1 -2.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.22 _LACS_plot.Line_2_terminator_val_x_2 5.62 _LACS_plot.Line_2_terminator_val_y_2 1.63 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 104 MET 0.72 4.41 0 10 ALA -6.04 -1.79 1 11 ARG -3.85 -1.59 1 12 ILE -3.10 -1.52 1 13 TYR -3.17 -4.74 1 16 ALA 0.22 0.16 1 21 GLN 0.32 -0.13 1 22 SER 0.19 0.48 1 26 LYS 0.93 -0.16 1 27 LEU 0.47 -0.32 1 28 LYS 0.30 -1.22 1 29 ALA -0.50 -0.85 1 30 TRP -0.41 -0.97 1 31 LYS -4.45 -2.57 1 32 LEU -4.54 -3.41 1 33 GLU -7.04 -0.95 1 34 PHE 0.34 -0.63 1 35 GLU -0.85 -0.06 1 37 SER 0.30 0.21 1 39 THR 0.60 -0.39 1 40 GLN 0.44 -0.59 1 41 TYR 0.02 -0.18 1 42 THR -0.02 -0.78 1 43 GLU 0.32 -0.40 1 45 LEU 0.71 -0.22 1 46 MET 0.53 -0.53 1 47 ASN 0.51 -0.42 1 48 TRP 0.06 0.50 1 49 THR 0.15 0.06 1 51 SER -0.30 -0.07 1 53 ASP -0.04 0.19 1 54 THR 0.75 0.07 1 55 LYS 3.13 -0.32 1 56 GLN -0.14 -0.53 1 57 GLN -0.49 -0.49 1 58 VAL 0.68 -1.49 1 60 LEU -4.29 -2.41 1 61 SER -2.76 -1.78 1 62 PHE -6.75 -0.05 1 63 THR 3.82 0.90 1 64 THR -6.19 -1.85 1 65 ARG 4.47 0.94 1 66 GLU 5.55 3.07 1 67 LEU 2.98 1.03 1 68 ALA 2.35 0.36 1 69 ILE 4.84 0.50 1 70 ALA 3.90 3.07 1 71 TYR 4.22 2.53 1 72 ALA 5.31 1.70 1 73 VAL 4.53 4.50 1 74 ALA 3.17 0.85 1 76 LYS 5.62 -1.45 1 77 ILE -1.55 -0.30 1 78 ASP 0.40 -1.32 1 79 TYR -5.79 -1.94 1 80 THR -2.67 -1.86 1 81 VAL -0.34 -0.34 1 82 LEU 0.00 -0.82 1 83 GLN -0.54 -0.75 1 84 ASP -0.45 -0.96 1 85 ASN -0.10 -0.36 1 87 ARG 0.31 0.14 1 88 THR 0.38 -0.64 1 89 ILE -0.11 -0.60 1 90 VAL 0.26 -0.68 1 92 LYS 0.44 -0.11 1 93 SER -0.50 -0.46 1 94 TYR 0.25 -0.35 1 95 ALA -0.13 -0.54 1 96 ASP 0.26 -0.31 1 97 ASN 0.53 -0.26 1 98 PHE 0.52 -0.01 1 99 THR 0.17 -0.95 1 100 LYS 0.28 -0.58 1 102 ARG 0.44 -0.29 1 103 ASP 0.47 -1.29 1 stop_ save_