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 bmr16870_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 5.15 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 SER -5.13 -2.38 0 10 GLN 1.98 1.64 1 11 GLU 1.38 1.38 1 12 ARG 2.12 1.60 1 13 GLN 2.34 1.62 1 14 LEU 1.84 1.58 1 15 GLU 1.95 1.65 1 16 VAL 3.45 2.75 1 17 GLU 1.76 1.53 1 18 ARG 2.48 2.03 1 19 ARG 2.12 1.63 1 20 LYS 1.55 1.28 1 21 GLN 0.88 0.75 1 22 LYS 0.88 0.63 1 23 ARG 0.89 0.49 1 24 GLN 0.64 0.66 1 25 ASN 0.98 0.76 1 26 GLN 1.30 1.17 1 27 GLU 0.93 0.74 1 28 VAL 1.63 1.28 1 29 GLU 1.30 1.18 1 30 LYS 1.55 1.25 1 31 GLU 1.58 0.98 1 32 ASN 1.85 1.29 1 33 SER 3.78 3.06 1 34 HIS 3.75 3.40 1 35 PHE 3.68 2.97 1 36 PHE 5.02 4.84 1 37 VAL 5.96 4.67 1 38 ALA 2.99 2.36 1 39 THR 5.94 4.80 1 40 PHE 4.87 4.07 1 41 ALA 3.84 2.96 1 42 ARG 3.89 3.28 1 43 GLU 1.67 1.43 1 44 ARG 5.78 4.01 1 45 ALA 3.63 2.44 1 46 ALA 3.65 2.49 1 47 VAL 6.70 4.89 1 48 GLU 4.55 4.03 1 49 GLU 3.32 2.90 1 50 LEU 2.46 2.71 1 51 LEU 3.13 2.69 1 52 GLU 2.83 2.39 1 53 ARG -0.34 -0.26 1 54 ALA 1.81 1.15 1 55 GLU -1.18 -0.39 1 57 VAL 5.30 4.14 1 58 GLU 5.24 4.01 1 59 ARG 2.59 2.04 1 60 LEU 3.79 2.43 1 61 GLU 3.53 2.24 1 62 GLU 3.66 2.72 1 63 ALA 4.37 3.05 1 64 ALA 3.81 3.05 1 65 SER 4.46 3.34 1 66 ARG 3.13 2.70 1 67 LEU 4.50 3.38 1 68 GLN 5.01 3.45 1 70 LEU 2.28 2.57 1 71 GLN 3.75 2.99 1 72 LYS 4.17 3.40 1 73 LEU 3.53 3.24 1 74 ILE 5.72 4.59 1 75 ASN 4.06 3.05 1 76 ASP 2.44 2.14 1 77 SER 0.75 0.57 1 78 VAL 4.17 3.23 1 79 PHE 2.47 1.27 1 80 PHE -1.91 -1.09 1 81 LEU -2.07 -0.67 1 82 ALA -0.64 -0.85 1 83 ALA 4.12 3.28 1 84 TYR 3.42 3.20 1 85 ASP 2.65 2.90 1 86 LEU 3.99 3.06 1 87 ARG 4.51 3.36 1 88 GLN 4.18 3.25 1 90 GLN 4.76 3.73 1 91 GLU 3.47 2.81 1 92 ALA 3.56 2.71 1 93 LEU 4.10 3.16 1 94 ALA 4.19 2.79 1 95 ARG 4.22 3.48 1 96 LEU 2.53 2.78 1 97 GLN 4.79 3.54 1 98 ALA 4.01 2.56 1 99 ALA 3.49 2.53 1 100 LEU 4.73 3.82 1 101 ALA 4.10 2.84 1 102 GLU 2.88 2.47 1 103 ARG 2.98 1.62 1 104 ARG 4.36 3.83 1 105 ARG 3.68 3.02 1 107 LEU -0.54 -0.07 1 108 GLN -0.03 0.23 1 110 LYS 0.23 0.16 1 111 LYS 0.73 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16870_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 2.68 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 -1.54 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 56 SER -5.13 2.75 0 10 GLN 1.98 -0.34 1 11 GLU 1.38 0.00 1 12 ARG 2.12 -0.52 1 13 GLN 2.34 -0.72 1 14 LEU 1.84 -0.26 1 15 GLU 1.95 -0.30 1 16 VAL 3.45 -0.70 1 17 GLU 1.76 -0.23 1 18 ARG 2.48 -0.45 1 19 ARG 2.12 -0.49 1 20 LYS 1.55 -0.27 1 21 GLN 0.88 -0.13 1 22 LYS 0.88 -0.25 1 23 ARG 0.89 -0.40 1 24 GLN 0.64 0.02 1 25 ASN 0.98 -0.22 1 26 GLN 1.30 -0.13 1 27 GLU 0.93 -0.19 1 28 VAL 1.63 -0.35 1 29 GLU 1.30 -0.12 1 30 LYS 1.55 -0.30 1 31 GLU 1.58 -0.60 1 32 ASN 1.85 -0.56 1 33 SER 3.78 -0.72 1 34 HIS 3.75 -0.35 1 35 PHE 3.68 -0.71 1 36 PHE 5.02 -0.18 1 37 VAL 5.96 -1.29 1 38 ALA 2.99 -0.63 1 39 THR 5.94 -1.14 1 40 PHE 4.87 -0.80 1 41 ALA 3.84 -0.88 1 42 ARG 3.89 -0.61 1 43 GLU 1.67 -0.24 1 44 ARG 5.78 -1.77 1 45 ALA 3.63 -1.19 1 46 ALA 3.65 -1.16 1 47 VAL 6.70 -1.81 1 48 GLU 4.55 -0.52 1 49 GLU 3.32 -0.42 1 50 LEU 2.46 0.25 1 51 LEU 3.13 -0.44 1 52 GLU 2.83 -0.44 1 53 ARG -0.34 0.08 1 54 ALA 1.81 -0.66 1 55 GLU -1.18 0.79 1 57 VAL 5.30 -1.16 1 58 GLU 5.24 -1.23 1 59 ARG 2.59 -0.55 1 60 LEU 3.79 -1.36 1 61 GLU 3.53 -1.29 1 62 GLU 3.66 -0.94 1 63 ALA 4.37 -1.32 1 64 ALA 3.81 -0.76 1 65 SER 4.46 -1.12 1 66 ARG 3.13 -0.43 1 67 LEU 4.50 -1.12 1 68 GLN 5.01 -1.56 1 70 LEU 2.28 0.29 1 71 GLN 3.75 -0.76 1 72 LYS 4.17 -0.77 1 73 LEU 3.53 -0.29 1 74 ILE 5.72 -1.13 1 75 ASN 4.06 -1.01 1 76 ASP 2.44 -0.30 1 77 SER 0.75 -0.18 1 78 VAL 4.17 -0.94 1 79 PHE 2.47 -1.20 1 80 PHE -1.91 0.82 1 81 LEU -2.07 1.40 1 82 ALA -0.64 -0.21 1 83 ALA 4.12 -0.84 1 84 TYR 3.42 -0.22 1 85 ASP 2.65 0.25 1 86 LEU 3.99 -0.93 1 87 ARG 4.51 -1.15 1 88 GLN 4.18 -0.93 1 90 GLN 4.76 -1.03 1 91 GLU 3.47 -0.66 1 92 ALA 3.56 -0.85 1 93 LEU 4.10 -0.94 1 94 ALA 4.19 -1.40 1 95 ARG 4.22 -0.74 1 96 LEU 2.53 0.25 1 97 GLN 4.79 -1.25 1 98 ALA 4.01 -1.45 1 99 ALA 3.49 -0.96 1 100 LEU 4.73 -0.91 1 101 ALA 4.10 -1.26 1 102 GLU 2.88 -0.41 1 103 ARG 2.98 -1.36 1 104 ARG 4.36 -0.53 1 105 ARG 3.68 -0.66 1 107 LEU -0.54 0.47 1 108 GLN -0.03 0.26 1 110 LYS 0.23 -0.07 1 111 LYS 0.73 0.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16870_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 0.38 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 40 PHE 4.87 -1.06 0 10 GLN 1.98 -0.12 1 11 GLU 1.38 -0.15 1 12 ARG 2.12 -0.10 1 13 GLN 2.34 -0.14 1 14 LEU 1.84 -0.12 1 15 GLU 1.95 -0.17 1 16 VAL 3.45 -0.33 1 17 GLU 1.76 -0.19 1 18 ARG 2.48 -0.16 1 19 ARG 2.12 -0.14 1 20 LYS 1.55 -0.11 1 21 GLN 0.88 -0.09 1 22 LYS 0.88 -0.05 1 23 ARG 0.89 -0.02 1 24 GLN 0.64 -0.02 1 25 ASN 0.98 -0.08 1 26 GLN 1.30 -0.05 1 27 GLU 0.93 -0.08 1 28 VAL 1.63 -0.13 1 29 GLU 1.30 -0.17 1 30 LYS 1.55 -0.16 1 31 GLU 1.58 -0.26 1 32 ASN 1.85 -0.16 1 33 SER 3.78 -0.12 1 34 HIS 3.75 -0.24 1 35 PHE 3.68 -0.19 1 36 PHE 5.02 -0.54 1 37 VAL 5.96 -0.66 1 38 ALA 2.99 -0.14 1 39 THR 5.94 -0.62 1 41 ALA 3.84 -0.33 1 42 ARG 3.89 -0.28 1 43 GLU 1.67 -0.05 1 44 ARG 5.78 -0.86 1 45 ALA 3.63 -0.16 1 46 ALA 3.65 -0.14 1 47 VAL 6.70 -0.59 1 48 GLU 4.55 -0.59 1 49 GLU 3.32 -0.27 1 50 LEU 2.46 -0.33 1 51 LEU 3.13 -0.49 1 52 GLU 2.83 -0.28 1 53 ARG -0.34 0.07 1 54 ALA 1.81 -0.23 1 55 GLU -1.18 0.10 1 56 SER -5.13 0.39 1 57 VAL 5.30 -0.44 1 58 GLU 5.24 -0.25 1 59 ARG 2.59 -0.01 1 60 LEU 3.79 -0.33 1 61 GLU 3.53 -0.14 1 62 GLU 3.66 -0.18 1 63 ALA 4.37 -0.42 1 64 ALA 3.81 -0.37 1 65 SER 4.46 -0.17 1 66 ARG 3.13 -0.10 1 67 LEU 4.50 -0.27 1 68 GLN 5.01 -0.15 1 70 LEU 2.28 -0.11 1 71 GLN 3.75 -0.33 1 72 LYS 4.17 -0.23 1 73 LEU 3.53 0.05 1 74 ILE 5.72 -0.50 1 75 ASN 4.06 -0.36 1 76 ASP 2.44 0.01 1 77 SER 0.75 -0.10 1 78 VAL 4.17 -0.71 1 79 PHE 2.47 -0.22 1 80 PHE -1.91 0.30 1 81 LEU -2.07 0.04 1 82 ALA -0.64 0.00 1 83 ALA 4.12 -0.38 1 84 TYR 3.42 -0.38 1 85 ASP 2.65 -0.27 1 86 LEU 3.99 -0.56 1 87 ARG 4.51 -0.25 1 88 GLN 4.18 -0.39 1 90 GLN 4.76 -0.31 1 91 GLU 3.47 -0.25 1 92 ALA 3.56 -0.11 1 93 LEU 4.10 -0.25 1 94 ALA 4.19 -0.06 1 95 ARG 4.22 -0.15 1 96 LEU 2.53 -0.20 1 97 GLN 4.79 -0.38 1 98 ALA 4.01 -0.06 1 99 ALA 3.49 -0.07 1 100 LEU 4.73 -0.38 1 101 ALA 4.10 -0.26 1 102 GLU 2.88 -0.26 1 103 ARG 2.98 -0.14 1 104 ARG 4.36 -0.54 1 105 ARG 3.68 -0.23 1 107 LEU -0.54 0.07 1 108 GLN -0.03 -0.07 1 110 LYS 0.23 0.01 1 111 LYS 0.73 -0.15 1 stop_ save_