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 bmr17171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 5.44 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS 5.59 8.33 0 10 SER 0.03 0.16 1 11 ARG 0.23 0.08 1 12 LEU -0.21 -0.32 1 14 HIS 2.91 4.23 1 15 ASP -1.27 -1.19 1 16 ARG -3.44 -1.14 1 17 MET -0.61 0.55 1 18 THR -2.77 -1.13 1 20 GLN 3.98 3.57 1 21 GLU 3.44 2.91 1 22 ALA 3.82 2.76 1 23 ALA 2.38 1.77 1 25 PHE 1.31 -0.08 1 27 ASP 3.06 0.57 1 28 ILE 2.12 -0.25 1 29 ILE 1.40 0.58 1 30 SER -0.09 0.17 1 33 GLN 4.85 3.86 1 34 GLN 5.38 3.78 1 35 THR 5.48 3.95 1 36 GLN 6.13 4.18 1 37 LYS 4.83 3.76 1 38 VAL 6.17 5.20 1 39 PHE 5.21 5.13 1 40 LEU 3.41 2.76 1 41 PHE 4.35 4.39 1 42 ILE 4.80 4.84 1 43 ARG 5.68 5.07 1 44 ASN 4.37 2.71 1 45 ARG 3.26 1.47 1 46 THR 5.85 4.02 1 47 LEU 3.40 3.29 1 48 GLN 4.18 3.32 1 49 LEU 2.48 2.82 1 50 TRP 0.83 1.51 1 51 LEU 2.86 2.02 1 52 ASP 1.89 1.93 1 53 ASN 0.89 0.52 1 55 LYS 0.07 -0.34 1 56 ILE -5.29 -2.19 1 57 GLN 1.05 1.07 1 58 LEU -0.23 -1.25 1 59 THR -2.24 -0.76 1 60 PHE 3.51 2.38 1 61 GLU 6.08 4.51 1 62 ALA 2.25 2.21 1 64 LEU 3.42 2.91 1 65 GLN 2.53 2.05 1 66 GLN -1.55 -0.10 1 67 LEU -2.73 -0.67 1 68 GLU -2.44 -1.11 1 69 ALA 1.88 1.13 1 71 TYR 4.20 2.88 1 72 ASN 0.47 -1.08 1 73 SER 2.82 2.90 1 74 ASP -1.21 -2.19 1 75 THR 5.72 4.19 1 76 VAL 5.76 4.14 1 77 LEU 4.81 3.28 1 78 VAL 6.68 5.33 1 79 HIS 4.67 4.83 1 80 ARG 2.00 4.08 1 81 VAL 6.94 5.75 1 83 SER 3.64 3.36 1 84 TYR 4.13 3.70 1 85 LEU 3.33 2.77 1 86 GLU 2.63 3.18 1 87 ARG 4.00 2.91 1 88 HIS 2.94 2.07 1 90 LEU -0.02 1.01 1 91 ILE -6.46 -3.14 1 92 ASN 4.34 1.22 1 93 PHE -3.70 -1.81 1 96 TYR -1.71 -1.27 1 97 LYS -0.47 -0.20 1 98 ARG 0.24 0.22 1 99 ILE -0.10 -0.07 1 100 LYS -0.68 -0.08 1 102 LEU 0.84 1.92 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 3.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -1.50 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS 5.59 2.74 0 10 SER 0.03 0.13 1 11 ARG 0.23 -0.15 1 12 LEU -0.21 -0.11 1 14 HIS 2.91 1.32 1 15 ASP -1.27 0.08 1 16 ARG -3.44 2.30 1 17 MET -0.61 1.16 1 18 THR -2.77 1.64 1 20 GLN 3.98 -0.41 1 21 GLU 3.44 -0.53 1 22 ALA 3.82 -1.06 1 23 ALA 2.38 -0.61 1 25 PHE 1.31 -1.39 1 27 ASP 3.06 -2.49 1 28 ILE 2.12 -2.37 1 29 ILE 1.40 -0.82 1 30 SER -0.09 0.26 1 33 GLN 4.85 -0.99 1 34 GLN 5.38 -1.60 1 35 THR 5.48 -1.53 1 36 GLN 6.13 -1.95 1 37 LYS 4.83 -1.07 1 38 VAL 6.17 -0.97 1 39 PHE 5.21 -0.08 1 40 LEU 3.41 -0.65 1 41 PHE 4.35 0.04 1 42 ILE 4.80 0.04 1 43 ARG 5.68 -0.61 1 44 ASN 4.37 -1.66 1 45 ARG 3.26 -1.79 1 46 THR 5.85 -1.83 1 47 LEU 3.40 -0.11 1 48 GLN 4.18 -0.86 1 49 LEU 2.48 0.34 1 50 TRP 0.83 0.68 1 51 LEU 2.86 -0.84 1 52 ASP 1.89 0.04 1 53 ASN 0.89 -0.37 1 55 LYS 0.07 -0.41 1 56 ILE -5.29 3.10 1 57 GLN 1.05 0.02 1 58 LEU -0.23 -1.02 1 59 THR -2.24 1.48 1 60 PHE 3.51 -1.13 1 61 GLU 6.08 -1.57 1 62 ALA 2.25 -0.04 1 64 LEU 3.42 -0.51 1 65 GLN 2.53 -0.48 1 66 GLN -1.55 1.45 1 67 LEU -2.73 2.06 1 68 GLU -2.44 1.33 1 69 ALA 1.88 -0.75 1 71 TYR 4.20 -1.32 1 72 ASN 0.47 -1.55 1 73 SER 2.82 0.08 1 74 ASP -1.21 -0.98 1 75 THR 5.72 -1.53 1 76 VAL 5.76 -1.62 1 77 LEU 4.81 -1.53 1 78 VAL 6.68 -1.35 1 79 HIS 4.67 0.16 1 80 ARG 2.00 2.08 1 81 VAL 6.94 -1.19 1 83 SER 3.64 -0.28 1 84 TYR 4.13 -0.43 1 85 LEU 3.33 -0.56 1 86 GLU 2.63 0.55 1 87 ARG 4.00 -1.09 1 88 HIS 2.94 -0.87 1 90 LEU -0.02 1.03 1 91 ILE -6.46 3.32 1 92 ASN 4.34 -3.12 1 93 PHE -3.70 1.89 1 96 TYR -1.71 0.44 1 97 LYS -0.47 0.27 1 98 ARG 0.24 -0.02 1 99 ILE -0.10 0.03 1 100 LYS -0.68 0.60 1 102 LEU 0.84 1.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 0.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 91 ILE -6.46 -0.33 0 10 SER 0.03 -0.07 1 11 ARG 0.23 0.02 1 12 LEU -0.21 -0.06 1 14 HIS 2.91 -0.59 1 15 ASP -1.27 -0.08 1 16 ARG -3.44 0.18 1 17 MET -0.61 0.03 1 18 THR -2.77 0.09 1 20 GLN 3.98 -0.17 1 21 GLU 3.44 -0.87 1 22 ALA 3.82 -0.73 1 23 ALA 2.38 -0.26 1 25 PHE 1.31 -0.30 1 27 ASP 3.06 -0.46 1 28 ILE 2.12 -0.24 1 29 ILE 1.40 -0.21 1 30 SER -0.09 0.03 1 33 GLN 4.85 -0.44 1 34 GLN 5.38 -0.26 1 35 THR 5.48 -0.25 1 36 GLN 6.13 -0.52 1 37 LYS 4.83 -0.28 1 38 VAL 6.17 -0.24 1 39 PHE 5.21 -0.96 1 40 LEU 3.41 -0.72 1 41 PHE 4.35 -0.76 1 42 ILE 4.80 -0.82 1 43 ARG 5.68 -0.91 1 44 ASN 4.37 -0.44 1 45 ARG 3.26 -0.39 1 46 THR 5.85 -0.43 1 47 LEU 3.40 -0.34 1 48 GLN 4.18 -0.51 1 49 LEU 2.48 -0.32 1 50 TRP 0.83 0.02 1 51 LEU 2.86 -0.85 1 52 ASP 1.89 -0.28 1 53 ASN 0.89 -0.34 1 55 LYS 0.07 0.03 1 56 ILE -5.29 0.48 1 57 GLN 1.05 -0.47 1 58 LEU -0.23 0.48 1 59 THR -2.24 0.30 1 60 PHE 3.51 -1.23 1 61 GLU 6.08 -1.18 1 62 ALA 2.25 -0.32 1 64 LEU 3.42 -0.60 1 65 GLN 2.53 -0.36 1 66 GLN -1.55 0.02 1 67 LEU -2.73 0.18 1 68 GLU -2.44 -0.04 1 69 ALA 1.88 -0.41 1 71 TYR 4.20 -0.47 1 72 ASN 0.47 -0.53 1 73 SER 2.82 -0.38 1 74 ASP -1.21 0.38 1 75 THR 5.72 -0.54 1 76 VAL 5.76 -0.35 1 77 LEU 4.81 -0.12 1 78 VAL 6.68 -0.29 1 79 HIS 4.67 -0.75 1 80 ARG 2.00 -0.16 1 81 VAL 6.94 -0.28 1 82 HIS 5.59 -0.94 1 83 SER 3.64 -0.15 1 84 TYR 4.13 -0.12 1 85 LEU 3.33 -0.71 1 86 GLU 2.63 -0.52 1 87 ARG 4.00 -0.33 1 88 HIS 2.94 -0.32 1 90 LEU -0.02 -0.17 1 92 ASN 4.34 -1.41 1 93 PHE -3.70 0.29 1 96 TYR -1.71 -0.18 1 97 LYS -0.47 -0.10 1 98 ARG 0.24 0.03 1 99 ILE -0.10 0.01 1 100 LYS -0.68 0.05 1 102 LEU 0.84 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17171_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.29 _LACS_plot.Line_1_terminator_val_y_1 -2.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 2.50 _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 92 ASN 4.34 -2.93 0 10 SER 0.03 -0.43 1 11 ARG 0.23 -0.36 1 14 HIS 2.91 1.77 1 15 ASP -1.27 -1.29 1 16 ARG -3.44 -2.55 1 17 MET -0.61 1.37 1 20 GLN 3.98 2.77 1 21 GLU 3.44 2.03 1 22 ALA 3.82 1.39 1 23 ALA 2.38 2.02 1 27 ASP 3.06 0.49 1 28 ILE 2.12 2.58 1 29 ILE 1.40 -1.02 1 30 SER -0.09 -0.02 1 33 GLN 4.85 2.54 1 34 GLN 5.38 1.97 1 35 THR 5.48 1.71 1 36 GLN 6.13 1.82 1 37 LYS 4.83 3.36 1 38 VAL 6.17 0.75 1 39 PHE 5.21 0.27 1 40 LEU 3.41 -0.01 1 41 PHE 4.35 2.80 1 42 ILE 4.80 2.62 1 43 ARG 5.68 0.39 1 45 ARG 3.26 1.18 1 46 THR 5.85 1.07 1 47 LEU 3.40 0.74 1 48 GLN 4.18 1.58 1 49 LEU 2.48 2.53 1 50 TRP 0.83 0.28 1 51 LEU 2.86 2.43 1 52 ASP 1.89 1.21 1 55 LYS 0.07 -0.13 1 56 ILE -5.29 -3.10 1 57 GLN 1.05 -0.77 1 58 LEU -0.23 0.31 1 59 THR -2.24 1.43 1 60 PHE 3.51 0.06 1 61 GLU 6.08 2.28 1 62 ALA 2.25 2.56 1 64 LEU 3.42 1.68 1 65 GLN 2.53 0.97 1 66 GLN -1.55 -0.98 1 67 LEU -2.73 -2.52 1 68 GLU -2.44 -0.61 1 71 TYR 4.20 -1.57 1 72 ASN 0.47 0.62 1 73 SER 2.82 -0.06 1 74 ASP -1.21 0.57 1 75 THR 5.72 1.98 1 76 VAL 5.76 2.31 1 77 LEU 4.81 1.40 1 78 VAL 6.68 1.21 1 79 HIS 4.67 4.12 1 80 ARG 2.00 4.61 1 81 VAL 6.94 0.35 1 82 HIS 5.59 2.64 1 83 SER 3.64 2.44 1 85 LEU 3.33 1.44 1 86 GLU 2.63 3.79 1 88 HIS 2.94 0.30 1 90 LEU -0.02 -1.55 1 93 PHE -3.70 -0.76 1 96 TYR -1.71 -1.40 1 97 LYS -0.47 -0.84 1 98 ARG 0.24 -0.04 1 99 ILE -0.10 -0.52 1 stop_ save_