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 bmr27643_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.61 _LACS_plot.Line_1_terminator_val_y_1 -3.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.85 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 5.66 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 ILE 7.71 -1.15 0 10 VAL 5.33 3.49 1 11 LEU 4.64 2.49 1 12 ARG 3.85 2.56 1 13 SER 0.62 0.73 1 14 LEU -0.67 -1.81 1 15 THR 1.60 0.59 1 17 ASN 3.92 3.56 1 18 ALA 3.29 3.37 1 19 ARG 4.84 4.49 1 21 ILE 4.39 4.58 1 22 PHE 5.55 4.76 1 23 ARG 5.11 4.05 1 24 LEU 3.78 3.07 1 25 LEU 4.45 2.39 1 26 ILE 6.23 5.11 1 27 LYS 4.78 3.48 1 28 TYR 4.84 4.45 1 29 GLN 6.11 5.09 1 30 LEU 4.07 2.21 1 31 ASP 3.13 1.94 1 32 ASN -0.98 0.40 1 33 GLN 3.12 2.42 1 34 ASP 0.18 -0.70 1 37 SER -0.14 -0.83 1 38 TYR 1.50 1.35 1 41 LEU -3.86 -2.29 1 42 SER -1.07 -0.75 1 43 PHE 5.67 5.27 1 44 GLN 5.55 3.78 1 45 ASP 3.70 2.71 1 46 PHE 2.13 0.82 1 47 TYR 4.57 2.24 1 48 GLN 5.59 3.23 1 49 GLN 4.77 3.34 1 51 ARG 4.40 2.45 1 52 GLU 2.98 1.83 1 53 ALA -1.22 -1.37 1 54 PHE 5.65 0.99 1 55 LEU -1.02 0.61 1 56 VAL -6.18 -3.36 1 57 ASN -1.05 -0.67 1 58 SER -3.01 -1.62 1 59 ASP 5.19 2.40 1 60 LEU 4.16 2.81 1 61 THR 5.12 3.58 1 62 LEU 3.78 2.31 1 63 ARG 6.47 4.41 1 64 ALA 4.34 2.50 1 65 GLN 1.92 1.15 1 66 LEU 5.04 2.90 1 67 THR 6.72 5.13 1 68 GLU 3.87 3.01 1 69 PHE 2.47 0.35 1 70 ARG 5.54 4.17 1 71 ASP 4.57 2.96 1 72 HIS -0.28 1.36 1 73 LYS 6.02 1.02 1 74 LEU -1.14 -0.10 1 75 ILE -7.61 -2.93 1 76 ARG -3.85 -1.38 1 77 THR -2.59 -2.00 1 78 LYS -3.46 -1.24 1 79 LYS -0.90 -0.96 1 81 THR 4.30 2.68 1 82 ASP 0.34 -1.03 1 84 VAL 1.38 0.21 1 85 GLU -2.25 -0.87 1 86 TYR -1.96 0.14 1 87 LEU -2.28 -0.91 1 88 LEU -4.71 -1.01 1 89 ILE -1.12 -0.43 1 91 VAL -3.83 -1.46 1 92 ASP -0.23 0.57 1 93 ASN 4.30 2.89 1 95 THR 6.60 4.44 1 96 LEU 4.20 2.80 1 97 THR 6.84 5.41 1 98 ASP 3.73 2.96 1 99 PHE 4.76 3.82 1 100 LEU 2.73 1.93 1 101 GLU 1.58 1.42 1 102 LYS 1.19 0.40 1 103 GLU 0.60 0.09 1 104 GLU -0.27 -0.13 1 105 GLU -2.79 -1.30 1 106 GLU 4.05 -0.35 1 107 ALA 2.16 1.21 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27643_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.61 _LACS_plot.Line_1_terminator_val_y_1 4.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 -2.04 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 ILE 7.71 -8.86 0 10 VAL 5.33 -1.84 1 11 LEU 4.64 -2.15 1 12 ARG 3.85 -1.29 1 13 SER 0.62 0.11 1 14 LEU -0.67 -1.14 1 15 THR 1.60 -1.01 1 17 ASN 3.92 -0.36 1 18 ALA 3.29 0.08 1 19 ARG 4.84 -0.35 1 21 ILE 4.39 0.19 1 22 PHE 5.55 -0.79 1 23 ARG 5.11 -1.06 1 24 LEU 3.78 -0.71 1 25 LEU 4.45 -2.06 1 26 ILE 6.23 -1.12 1 27 LYS 4.78 -1.30 1 28 TYR 4.84 -0.39 1 29 GLN 6.11 -1.02 1 30 LEU 4.07 -1.86 1 31 ASP 3.13 -1.19 1 32 ASN -0.98 1.38 1 33 GLN 3.12 -0.70 1 34 ASP 0.18 -0.88 1 37 SER -0.14 -0.69 1 38 TYR 1.50 -0.15 1 41 LEU -3.86 1.57 1 42 SER -1.07 0.32 1 43 PHE 5.67 -0.40 1 44 GLN 5.55 -1.77 1 45 ASP 3.70 -0.99 1 46 PHE 2.13 -1.31 1 47 TYR 4.57 -2.33 1 48 GLN 5.59 -2.36 1 49 GLN 4.77 -1.43 1 51 ARG 4.40 -1.95 1 52 GLU 2.98 -1.15 1 53 ALA -1.22 -0.15 1 54 PHE 5.65 -4.66 1 55 LEU -1.02 1.63 1 56 VAL -6.18 2.82 1 57 ASN -1.05 0.38 1 58 SER -3.01 1.39 1 59 ASP 5.19 -2.79 1 60 LEU 4.16 -1.35 1 61 THR 5.12 -1.54 1 62 LEU 3.78 -1.47 1 63 ARG 6.47 -2.06 1 64 ALA 4.34 -1.84 1 65 GLN 1.92 -0.77 1 66 LEU 5.04 -2.14 1 67 THR 6.72 -1.59 1 68 GLU 3.87 -0.86 1 69 PHE 2.47 -2.12 1 70 ARG 5.54 -1.37 1 71 ASP 4.57 -1.61 1 72 HIS -0.28 1.64 1 73 LYS 6.02 -5.00 1 74 LEU -1.14 1.04 1 75 ILE -7.61 4.68 1 76 ARG -3.85 2.47 1 77 THR -2.59 0.59 1 78 LYS -3.46 2.22 1 79 LYS -0.90 -0.06 1 81 THR 4.30 -1.62 1 82 ASP 0.34 -1.37 1 84 VAL 1.38 -1.17 1 85 GLU -2.25 1.38 1 86 TYR -1.96 2.10 1 87 LEU -2.28 1.37 1 88 LEU -4.71 3.70 1 89 ILE -1.12 0.69 1 91 VAL -3.83 2.37 1 92 ASP -0.23 0.80 1 93 ASN 4.30 -1.41 1 95 THR 6.60 -2.16 1 96 LEU 4.20 -1.40 1 97 THR 6.84 -1.43 1 98 ASP 3.73 -0.77 1 99 PHE 4.76 -0.94 1 100 LEU 2.73 -0.80 1 101 GLU 1.58 -0.16 1 102 LYS 1.19 -0.79 1 103 GLU 0.60 -0.51 1 104 GLU -0.27 0.14 1 105 GLU -2.79 1.49 1 106 GLU 4.05 -4.40 1 107 ALA 2.16 -0.95 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27643_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.61 _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 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.03 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 ILE -7.61 -2.48 0 10 VAL 5.33 -0.60 1 11 LEU 4.64 -0.62 1 12 ARG 3.85 -0.32 1 13 SER 0.62 -0.04 1 14 LEU -0.67 0.30 1 17 ASN 3.92 -1.06 1 18 ALA 3.29 -0.40 1 19 ARG 4.84 -0.35 1 21 ILE 4.39 -0.42 1 22 PHE 5.55 -0.70 1 23 ARG 5.11 -0.56 1 24 LEU 3.78 -0.22 1 25 LEU 4.45 -0.46 1 26 ILE 6.23 -1.14 1 27 LYS 4.78 -0.61 1 28 TYR 4.84 -0.53 1 29 GLN 6.11 -0.64 1 30 LEU 4.07 -0.42 1 31 ASP 3.13 -0.23 1 32 ASN -0.98 -0.02 1 33 GLN 3.12 -0.32 1 34 ASP 0.18 -0.03 1 37 SER -0.14 0.02 1 38 TYR 1.50 -0.25 1 39 ILE 7.71 -0.91 1 41 LEU -3.86 0.44 1 42 SER -1.07 -0.01 1 43 PHE 5.67 -0.73 1 44 GLN 5.55 -0.41 1 45 ASP 3.70 -0.23 1 46 PHE 2.13 -0.30 1 47 TYR 4.57 -0.93 1 48 GLN 5.59 -0.91 1 49 GLN 4.77 -0.44 1 51 ARG 4.40 -0.25 1 52 GLU 2.98 -0.69 1 53 ALA -1.22 -0.07 1 54 PHE 5.65 -0.40 1 55 LEU -1.02 0.03 1 56 VAL -6.18 0.00 1 57 ASN -1.05 0.11 1 58 SER -3.01 -0.34 1 59 ASP 5.19 -0.19 1 60 LEU 4.16 -0.36 1 61 THR 5.12 -0.15 1 62 LEU 3.78 -0.14 1 63 ARG 6.47 -0.41 1 64 ALA 4.34 -0.15 1 65 GLN 1.92 -0.25 1 66 LEU 5.04 -0.26 1 67 THR 6.72 -0.03 1 68 GLU 3.87 -0.12 1 69 PHE 2.47 -0.09 1 70 ARG 5.54 -0.22 1 71 ASP 4.57 -0.22 1 72 HIS -0.28 -0.10 1 73 LYS 6.02 -0.23 1 74 LEU -1.14 -0.18 1 76 ARG -3.85 0.37 1 77 THR -2.59 -0.30 1 78 LYS -3.46 0.26 1 79 LYS -0.90 -1.42 1 81 THR 4.30 -0.27 1 82 ASP 0.34 -0.20 1 84 VAL 1.38 -0.38 1 85 GLU -2.25 0.04 1 86 TYR -1.96 -0.04 1 87 LEU -2.28 0.56 1 88 LEU -4.71 0.20 1 91 VAL -3.83 0.11 1 92 ASP -0.23 -0.26 1 93 ASN 4.30 -0.38 1 95 THR 6.60 -0.32 1 96 LEU 4.20 -0.40 1 97 THR 6.84 0.44 1 98 ASP 3.73 -0.31 1 99 PHE 4.76 -0.60 1 100 LEU 2.73 -0.54 1 101 GLU 1.58 -0.34 1 102 LYS 1.19 -0.15 1 103 GLU 0.60 -0.30 1 104 GLU -0.27 -0.18 1 105 GLU -2.79 -0.16 1 106 GLU 4.05 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27643_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.61 _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 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 2.64 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 VAL -6.18 -3.85 0 73 LYS 6.02 -1.22 0 75 ILE -7.61 -2.34 0 10 VAL 5.33 2.96 1 11 LEU 4.64 2.15 1 12 ARG 3.85 0.25 1 13 SER 0.62 -0.71 1 14 LEU -0.67 -1.36 1 17 ASN 3.92 2.43 1 18 ALA 3.29 2.66 1 19 ARG 4.84 2.55 1 21 ILE 4.39 0.79 1 22 PHE 5.55 1.58 1 23 ARG 5.11 1.70 1 24 LEU 3.78 1.80 1 25 LEU 4.45 0.08 1 26 ILE 6.23 0.74 1 27 LYS 4.78 1.27 1 28 TYR 4.84 2.31 1 29 GLN 6.11 3.73 1 30 LEU 4.07 3.00 1 31 ASP 3.13 0.69 1 32 ASN -0.98 -0.23 1 33 GLN 3.12 -0.79 1 34 ASP 0.18 -1.27 1 37 SER -0.14 -1.13 1 38 TYR 1.50 0.11 1 39 ILE 7.71 1.43 1 41 LEU -3.86 -1.34 1 42 SER -1.07 0.25 1 43 PHE 5.67 0.66 1 44 GLN 5.55 2.46 1 45 ASP 3.70 2.27 1 46 PHE 2.13 1.85 1 47 TYR 4.57 0.40 1 48 GLN 5.59 2.17 1 49 GLN 4.77 3.79 1 51 ARG 4.40 4.56 1 52 GLU 2.98 -0.41 1 53 ALA -1.22 -2.08 1 54 PHE 5.65 0.00 1 55 LEU -1.02 -0.54 1 57 ASN -1.05 -0.64 1 58 SER -3.01 -0.51 1 59 ASP 5.19 0.32 1 60 LEU 4.16 2.51 1 61 THR 5.12 2.49 1 62 LEU 3.78 0.32 1 63 ARG 6.47 2.46 1 64 ALA 4.34 2.48 1 65 GLN 1.92 2.57 1 66 LEU 5.04 1.46 1 67 THR 6.72 0.42 1 68 GLU 3.87 2.60 1 69 PHE 2.47 2.95 1 70 ARG 5.54 4.20 1 71 ASP 4.57 1.33 1 72 HIS -0.28 -1.06 1 74 LEU -1.14 -2.39 1 76 ARG -3.85 -2.13 1 77 THR -2.59 -0.65 1 78 LYS -3.46 -2.00 1 79 LYS -0.90 0.99 1 81 THR 4.30 0.04 1 82 ASP 0.34 0.52 1 84 VAL 1.38 -2.30 1 85 GLU -2.25 -2.58 1 86 TYR -1.96 -0.54 1 87 LEU -2.28 -1.72 1 88 LEU -4.71 -3.18 1 91 VAL -3.83 -2.60 1 92 ASP -0.23 -0.29 1 93 ASN 4.30 3.13 1 95 THR 6.60 1.64 1 96 LEU 4.20 0.37 1 97 THR 6.84 -0.62 1 98 ASP 3.73 1.99 1 99 PHE 4.76 0.98 1 100 LEU 2.73 1.34 1 101 GLU 1.58 1.27 1 102 LYS 1.19 0.61 1 103 GLU 0.60 0.22 1 104 GLU -0.27 -0.06 1 105 GLU -2.79 -0.28 1 106 GLU 4.05 -1.57 1 stop_ save_