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 bmr6797_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.01 _LACS_plot.Line_2_terminator_val_x_2 7.48 _LACS_plot.Line_2_terminator_val_y_2 4.68 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 10 GLN -0.52 3.57 0 12 ILE -0.12 -0.73 1 13 TYR -0.84 -1.01 1 14 GLN -1.19 -0.88 1 16 ASN -0.02 -0.43 1 17 LEU 0.28 -0.48 1 18 ILE 0.02 -1.14 1 19 LYS -0.85 -1.18 1 20 GLN 0.32 -0.74 1 21 ASN 3.46 1.88 1 22 ALA 1.17 1.19 1 23 VAL 4.08 2.19 1 24 GLU 1.45 0.37 1 25 GLN -1.39 -1.06 1 26 LEU 0.56 -0.75 1 27 GLN -5.54 -2.29 1 28 VAL 3.83 2.16 1 30 GLN 0.67 0.20 1 31 SER -4.22 -2.45 1 32 LYS 4.26 3.32 1 33 GLN 6.25 3.89 1 34 GLN 3.99 3.00 1 35 VAL 6.99 4.65 1 36 SER 3.85 2.07 1 37 ALA 2.76 1.41 1 38 LEU 0.10 1.13 1 39 LEU -0.13 -0.89 1 41 THR 0.77 -0.71 1 43 SER 0.70 -1.97 1 44 ILE -0.70 -1.50 1 46 ASP 1.22 0.18 1 48 PHE 7.49 4.06 1 49 HIS 1.90 0.91 1 50 ALA -2.99 -1.26 1 51 GLN -0.10 -1.14 1 52 ARG -3.70 -2.23 1 53 TRP -6.11 -3.83 1 54 ASP -2.87 -1.02 1 55 TYR -1.60 -0.98 1 56 THR -1.54 -1.03 1 57 SER -2.31 -1.36 1 58 THR -2.08 -1.65 1 59 GLN -3.12 -1.47 1 60 ARG -0.60 -0.94 1 61 VAL 0.47 -0.56 1 62 ASP 0.60 0.29 1 63 ARG 2.83 1.20 1 64 LEU -0.35 -1.07 1 65 ALA -0.13 -0.66 1 66 ARG -0.83 -0.73 1 67 THR -0.02 -0.63 1 68 GLU -3.31 -1.73 1 69 ILE -1.09 -0.91 1 70 LYS -2.89 -1.89 1 71 ASN -3.63 -0.55 1 72 PHE -3.88 -0.74 1 73 THR -2.49 -0.84 1 74 VAL -2.31 -1.43 1 75 PHE -1.44 -0.73 1 76 PHE -3.75 -1.55 1 77 GLU -3.19 -0.76 1 78 ASN 3.25 1.11 1 79 GLU 2.92 -0.32 1 80 GLN -6.71 -2.57 1 81 VAL 1.58 1.49 1 82 VAL -1.30 -0.56 1 83 ARG -1.26 -1.08 1 84 TRP -3.23 -1.81 1 85 GLU -4.99 -2.05 1 87 ASP -3.21 -1.50 1 88 TYR -4.99 -0.98 1 89 PHE 6.22 -0.11 1 91 SER -0.24 -0.69 1 92 GLN 0.22 -0.24 1 93 ASP 0.36 0.01 1 94 GLU 0.77 0.17 1 95 GLN 1.17 0.18 1 96 LEU 0.65 -0.12 1 97 ALA 0.46 -0.21 1 98 LYS 0.20 -0.54 1 99 ALA -0.84 -1.05 1 100 ALA 0.11 -0.53 1 102 LYS 0.18 -0.50 1 103 GLN -0.49 -0.83 1 104 PHE 0.08 -0.54 1 106 ARG 0.24 -0.51 1 107 ASN 0.44 -0.37 1 108 LEU 0.29 -0.47 1 109 ALA 0.52 -0.33 1 110 ARG 0.54 -0.25 1 111 ASP -0.05 -0.41 1 112 LYS 0.40 -0.28 1 113 LYS 0.53 -0.25 1 114 LYS 0.39 -0.39 1 115 GLN -0.40 -0.79 1 116 ARG 0.27 -0.29 1 118 ARG 0.73 0.61 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6797_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 3.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.01 _LACS_plot.Line_2_terminator_val_x_2 7.48 _LACS_plot.Line_2_terminator_val_y_2 -2.80 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 10 GLN -0.52 4.09 0 12 ILE -0.12 -0.61 1 13 TYR -0.84 -0.17 1 14 GLN -1.19 0.31 1 16 ASN -0.02 -0.41 1 17 LEU 0.28 -0.76 1 18 ILE 0.02 -1.16 1 19 LYS -0.85 -0.33 1 20 GLN 0.32 -1.06 1 21 ASN 3.46 -1.58 1 22 ALA 1.17 0.02 1 23 VAL 4.08 -1.89 1 24 GLU 1.45 -1.08 1 25 GLN -1.39 0.33 1 26 LEU 0.56 -1.31 1 27 GLN -5.54 3.25 1 28 VAL 3.83 -1.67 1 30 GLN 0.67 -0.47 1 31 SER -4.22 1.77 1 32 LYS 4.26 -0.94 1 33 GLN 6.25 -2.36 1 34 GLN 3.99 -0.99 1 35 VAL 6.99 -2.34 1 36 SER 3.85 -1.78 1 37 ALA 2.76 -1.35 1 38 LEU 0.10 1.03 1 39 LEU -0.13 -0.76 1 41 THR 0.77 -1.48 1 43 SER 0.70 -2.67 1 44 ILE -0.70 -0.80 1 46 ASP 1.22 -1.04 1 48 PHE 7.49 -3.43 1 49 HIS 1.90 -0.99 1 50 ALA -2.99 1.73 1 51 GLN -0.10 -1.04 1 52 ARG -3.70 1.47 1 53 TRP -6.11 2.28 1 54 ASP -2.87 1.85 1 55 TYR -1.60 0.62 1 56 THR -1.54 0.51 1 57 SER -2.31 0.95 1 58 THR -2.08 0.43 1 59 GLN -3.12 1.65 1 60 ARG -0.60 -0.34 1 61 VAL 0.47 -1.03 1 62 ASP 0.60 -0.31 1 63 ARG 2.83 -1.63 1 64 LEU -0.35 -0.72 1 65 ALA -0.13 -0.53 1 66 ARG -0.83 0.10 1 67 THR -0.02 -0.61 1 68 GLU -3.31 1.58 1 69 ILE -1.09 0.18 1 70 LYS -2.89 1.00 1 71 ASN -3.63 3.08 1 72 PHE -3.88 3.14 1 73 THR -2.49 1.65 1 74 VAL -2.31 0.88 1 75 PHE -1.44 0.71 1 76 PHE -3.75 2.20 1 77 GLU -3.19 2.43 1 78 ASN 3.25 -2.14 1 79 GLU 2.92 -3.24 1 80 GLN -6.71 4.14 1 81 VAL 1.58 -0.09 1 82 VAL -1.30 0.74 1 83 ARG -1.26 0.18 1 84 TRP -3.23 1.42 1 85 GLU -4.99 2.94 1 87 ASP -3.21 1.71 1 88 TYR -4.99 4.01 1 89 PHE 6.22 -6.33 1 91 SER -0.24 -0.45 1 92 GLN 0.22 -0.46 1 93 ASP 0.36 -0.35 1 94 GLU 0.77 -0.60 1 95 GLN 1.17 -0.99 1 96 LEU 0.65 -0.77 1 97 ALA 0.46 -0.67 1 98 LYS 0.20 -0.74 1 99 ALA -0.84 -0.21 1 100 ALA 0.11 -0.64 1 102 LYS 0.18 -0.68 1 103 GLN -0.49 -0.34 1 104 PHE 0.08 -0.62 1 106 ARG 0.24 -0.75 1 107 ASN 0.44 -0.81 1 108 LEU 0.29 -0.76 1 109 ALA 0.52 -0.85 1 110 ARG 0.54 -0.79 1 111 ASP -0.05 -0.36 1 112 LYS 0.40 -0.68 1 113 LYS 0.53 -0.78 1 114 LYS 0.39 -0.78 1 115 GLN -0.40 -0.39 1 116 ARG 0.27 -0.56 1 118 ARG 0.73 -0.12 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6797_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 7.48 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _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 33 GLN 6.25 -0.15 0 10 GLN -0.52 -0.69 0 56 THR -1.54 1.01 0 72 PHE -3.88 -0.26 0 73 THR -2.49 1.14 0 48 PHE 7.49 -0.35 0 12 ILE -0.12 -0.05 1 13 TYR -0.84 0.20 1 14 GLN -1.19 0.06 1 16 ASN -0.02 0.06 1 17 LEU 0.28 0.03 1 18 ILE 0.02 -0.13 1 19 LYS -0.85 0.11 1 20 GLN 0.32 0.22 1 21 ASN 3.46 -0.24 1 22 ALA 1.17 0.26 1 23 VAL 4.08 -0.94 1 24 GLU 1.45 -0.23 1 25 GLN -1.39 -0.09 1 26 LEU 0.56 0.01 1 27 GLN -5.54 0.40 1 28 VAL 3.83 -0.56 1 30 GLN 0.67 0.10 1 31 SER -4.22 0.53 1 32 LYS 4.26 -0.84 1 34 GLN 3.99 -0.22 1 35 VAL 6.99 -0.58 1 36 SER 3.85 -0.12 1 37 ALA 2.76 -0.11 1 38 LEU 0.10 -0.07 1 39 LEU -0.13 -0.15 1 41 THR 0.77 -0.54 1 43 SER 0.70 -0.08 1 44 ILE -0.70 0.23 1 46 ASP 1.22 -0.20 1 49 HIS 1.90 0.19 1 50 ALA -2.99 0.36 1 51 GLN -0.10 0.36 1 52 ARG -3.70 0.76 1 53 TRP -6.11 0.32 1 54 ASP -2.87 0.75 1 55 TYR -1.60 0.08 1 57 SER -2.31 0.50 1 58 THR -2.08 0.78 1 59 GLN -3.12 0.09 1 60 ARG -0.60 0.24 1 61 VAL 0.47 0.03 1 62 ASP 0.60 -0.16 1 63 ARG 2.83 -0.20 1 64 LEU -0.35 0.09 1 65 ALA -0.13 -0.07 1 66 ARG -0.83 0.16 1 67 THR -0.02 0.23 1 68 GLU -3.31 0.28 1 69 ILE -1.09 0.53 1 70 LYS -2.89 0.36 1 71 ASN -3.63 0.89 1 74 VAL -2.31 0.12 1 75 PHE -1.44 0.19 1 76 PHE -3.75 0.66 1 77 GLU -3.19 0.23 1 78 ASN 3.25 -0.27 1 79 GLU 2.92 -0.08 1 80 GLN -6.71 1.10 1 81 VAL 1.58 -0.58 1 82 VAL -1.30 0.55 1 83 ARG -1.26 -0.18 1 84 TRP -3.23 1.01 1 85 GLU -4.99 0.44 1 87 ASP -3.21 0.35 1 88 TYR -4.99 0.76 1 89 PHE 6.22 -0.59 1 91 SER -0.24 -0.04 1 92 GLN 0.22 0.07 1 93 ASP 0.36 -0.06 1 94 GLU 0.77 -0.13 1 95 GLN 1.17 -0.09 1 96 LEU 0.65 -0.03 1 97 ALA 0.46 -0.04 1 98 LYS 0.20 -0.05 1 99 ALA -0.84 -0.01 1 100 ALA 0.11 -0.04 1 102 LYS 0.18 -0.06 1 103 GLN -0.49 0.01 1 104 PHE 0.08 0.04 1 106 ARG 0.24 -0.03 1 107 ASN 0.44 -0.06 1 108 LEU 0.29 -0.03 1 109 ALA 0.52 -0.01 1 110 ARG 0.54 -0.06 1 111 ASP -0.05 -0.06 1 112 LYS 0.40 -0.01 1 113 LYS 0.53 -0.01 1 114 LYS 0.39 -0.07 1 115 GLN -0.40 -0.02 1 116 ARG 0.27 0.03 1 118 ARG 0.73 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6797_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.71 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 7.48 _LACS_plot.Line_2_terminator_val_y_2 2.86 _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 63 ARG 2.83 -3.84 0 12 ILE -0.12 0.48 1 13 TYR -0.84 0.05 1 14 GLN -1.19 -0.05 1 16 ASN -0.02 -0.27 1 17 LEU 0.28 -0.37 1 18 ILE 0.02 -0.53 1 19 LYS -0.85 0.51 1 20 GLN 0.32 0.41 1 21 ASN 3.46 0.05 1 22 ALA 1.17 1.11 1 23 VAL 4.08 2.07 1 24 GLU 1.45 0.40 1 25 GLN -1.39 0.21 1 26 LEU 0.56 -1.28 1 27 GLN -5.54 -0.56 1 28 VAL 3.83 1.83 1 30 GLN 0.67 3.83 1 31 SER -4.22 1.61 1 32 LYS 4.26 2.61 1 33 GLN 6.25 3.50 1 34 GLN 3.99 3.42 1 35 VAL 6.99 2.33 1 36 SER 3.85 3.01 1 37 ALA 2.76 0.94 1 38 LEU 0.10 0.31 1 39 LEU -0.13 0.79 1 43 SER 0.70 -0.11 1 48 PHE 7.49 1.73 1 49 HIS 1.90 -0.72 1 50 ALA -2.99 -0.01 1 51 GLN -0.10 -1.33 1 52 ARG -3.70 -1.76 1 53 TRP -6.11 -2.72 1 54 ASP -2.87 -1.76 1 55 TYR -1.60 0.31 1 56 THR -1.54 -0.42 1 57 SER -2.31 3.38 1 58 THR -2.08 -0.67 1 59 GLN -3.12 -1.14 1 60 ARG -0.60 0.16 1 61 VAL 0.47 -0.41 1 62 ASP 0.60 1.13 1 64 LEU -0.35 -0.88 1 65 ALA -0.13 -0.65 1 66 ARG -0.83 -0.23 1 67 THR -0.02 -0.42 1 68 GLU -3.31 -1.29 1 69 ILE -1.09 -0.19 1 70 LYS -2.89 -1.60 1 71 ASN -3.63 0.57 1 72 PHE -3.88 -1.90 1 73 THR -2.49 -2.08 1 74 VAL -2.31 -2.79 1 75 PHE -1.44 -0.49 1 76 PHE -3.75 0.16 1 77 GLU -3.19 0.97 1 78 ASN 3.25 1.21 1 79 GLU 2.92 -0.93 1 80 GLN -6.71 0.34 1 81 VAL 1.58 2.47 1 82 VAL -1.30 -1.63 1 83 ARG -1.26 -3.68 1 84 TRP -3.23 -1.82 1 85 GLU -4.99 -2.96 1 87 ASP -3.21 -2.57 1 88 TYR -4.99 -0.45 1 91 SER -0.24 0.94 1 92 GLN 0.22 0.08 1 93 ASP 0.36 0.81 1 94 GLU 0.77 0.76 1 95 GLN 1.17 0.98 1 96 LEU 0.65 0.28 1 97 ALA 0.46 0.46 1 98 LYS 0.20 -0.01 1 99 ALA -0.84 -0.57 1 102 LYS 0.18 0.20 1 103 GLN -0.49 -0.18 1 104 PHE 0.08 0.66 1 106 ARG 0.24 0.04 1 107 ASN 0.44 0.24 1 108 LEU 0.29 0.02 1 109 ALA 0.52 0.59 1 110 ARG 0.54 0.29 1 111 ASP -0.05 0.44 1 112 LYS 0.40 0.15 1 113 LYS 0.53 0.63 1 114 LYS 0.39 0.25 1 115 GLN -0.40 0.21 1 116 ARG 0.27 -0.86 1 stop_ save_