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 bmr15808_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 -3.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 7.33 _LACS_plot.Line_2_terminator_val_y_2 5.98 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ILE -7.03 -3.65 0 10 LEU 2.99 2.71 1 11 LEU 5.18 4.07 1 12 LEU 3.36 3.08 1 13 TRP 6.53 5.55 1 15 GLN 5.68 4.18 1 16 ARG 4.02 3.57 1 17 LYS 0.71 0.07 1 18 THR -0.75 -0.63 1 19 ALA 7.33 5.88 1 21 TYR 1.11 -0.38 1 22 LYS 2.87 1.73 1 23 ASN 0.58 -1.16 1 24 VAL -3.02 -0.96 1 25 ASN -0.68 -0.53 1 26 VAL 3.98 2.34 1 27 GLN -3.72 -0.83 1 28 ASN -1.82 -1.03 1 29 PHE 1.97 1.25 1 30 HIS -0.79 2.12 1 31 ILE 5.11 5.46 1 32 SER 3.15 3.66 1 33 TRP 0.12 0.06 1 34 LYS 2.68 3.75 1 35 ASP 0.02 -0.42 1 37 LEU 6.76 4.20 1 38 ALA 5.66 3.90 1 39 PHE 3.96 5.41 1 40 ASN 2.62 5.27 1 41 ALA 4.54 3.07 1 42 LEU 1.69 2.96 1 43 ILE 4.60 4.99 1 44 HIS 3.60 6.18 1 45 ARG 1.95 0.49 1 46 HIS 1.73 4.06 1 47 ARG -2.49 -2.49 1 49 GLU 3.16 1.00 1 50 LEU -0.71 0.24 1 52 GLU -0.08 -2.21 1 53 TYR 5.29 5.38 1 54 ASP 2.58 1.89 1 55 LYS -0.25 0.15 1 56 LEU 1.37 -0.06 1 57 ARG -3.60 -1.36 1 58 LYS 3.31 3.23 1 59 ASP 0.32 -0.63 1 60 ASP -1.01 -0.61 1 62 VAL 7.13 5.87 1 63 THR 5.67 3.97 1 64 ASN 4.06 3.49 1 65 LEU 2.78 3.25 1 66 ASN 4.33 3.51 1 67 ASN 3.40 4.91 1 68 ALA 3.94 3.23 1 69 PHE 1.22 -1.12 1 70 GLU 2.96 3.09 1 71 VAL 5.45 4.97 1 72 ALA 3.18 2.92 1 73 GLU 2.26 3.38 1 74 LYS 2.31 3.01 1 75 TYR 0.16 1.68 1 76 LEU -1.33 -1.42 1 77 ASP 2.71 1.51 1 78 ILE -0.70 0.09 1 80 LYS 2.07 1.42 1 81 MET -1.95 1.16 1 82 LEU -3.92 -2.45 1 83 ASP -3.89 -1.28 1 84 ALA 2.35 3.86 1 85 GLU 4.08 3.54 1 86 ASP 2.33 2.95 1 87 ILE 3.67 2.90 1 88 VAL 3.87 3.46 1 89 ASN 0.65 1.09 1 90 THR -0.40 -0.38 1 91 ALA 3.50 2.94 1 92 ARG -2.65 -0.95 1 94 ASP 0.18 0.76 1 95 GLU -0.24 1.20 1 96 LYS 4.84 3.57 1 97 ALA 3.30 2.64 1 98 ILE 7.09 4.87 1 99 MET 4.92 5.02 1 100 THR 6.91 5.53 1 101 TYR 3.07 3.78 1 102 VAL 6.77 5.32 1 103 SER 5.62 4.50 1 104 SER 5.19 4.54 1 105 PHE 5.02 3.69 1 106 TYR 4.37 3.36 1 107 HIS 3.65 4.61 1 108 ALA 3.24 2.33 1 109 PHE -1.55 -1.92 1 110 SER 2.50 1.89 1 112 ALA -0.54 0.07 1 113 GLN 1.17 2.04 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15808_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 3.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 7.33 _LACS_plot.Line_2_terminator_val_y_2 -1.35 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 ILE -7.03 3.38 0 10 LEU 2.99 -0.28 1 11 LEU 5.18 -1.11 1 12 LEU 3.36 -0.28 1 13 TRP 6.53 -0.98 1 15 GLN 5.68 -1.50 1 16 ARG 4.02 -0.45 1 17 LYS 0.71 -0.64 1 18 THR -0.75 0.12 1 19 ALA 7.33 -1.45 1 21 TYR 1.11 -1.49 1 22 LYS 2.87 -1.14 1 23 ASN 0.58 -1.74 1 24 VAL -3.02 2.06 1 25 ASN -0.68 0.15 1 26 VAL 3.98 -1.64 1 27 GLN -3.72 2.89 1 28 ASN -1.82 0.79 1 29 PHE 1.97 -0.72 1 30 HIS -0.79 2.91 1 31 ILE 5.11 0.35 1 32 SER 3.15 0.51 1 33 TRP 0.12 -0.06 1 34 LYS 2.68 1.07 1 35 ASP 0.02 -0.44 1 37 LEU 6.76 -2.56 1 38 ALA 5.66 -1.76 1 39 PHE 3.96 1.45 1 40 ASN 2.62 2.65 1 41 ALA 4.54 -1.47 1 42 LEU 1.69 1.27 1 43 ILE 4.60 0.39 1 44 HIS 3.60 2.58 1 45 ARG 1.95 -1.46 1 46 HIS 1.73 2.33 1 47 ARG -2.49 0.00 1 49 GLU 3.16 -2.16 1 50 LEU -0.71 0.95 1 52 GLU -0.08 -2.13 1 53 TYR 5.29 0.09 1 54 ASP 2.58 -0.69 1 55 LYS -0.25 0.40 1 56 LEU 1.37 -1.43 1 57 ARG -3.60 2.24 1 58 LYS 3.31 -0.08 1 59 ASP 0.32 -0.95 1 60 ASP -1.01 0.40 1 62 VAL 7.13 -1.26 1 63 THR 5.67 -1.70 1 64 ASN 4.06 -0.57 1 65 LEU 2.78 0.47 1 66 ASN 4.33 -0.82 1 67 ASN 3.40 1.51 1 68 ALA 3.94 -0.71 1 69 PHE 1.22 -2.34 1 70 GLU 2.96 0.13 1 71 VAL 5.45 -0.48 1 72 ALA 3.18 -0.26 1 73 GLU 2.26 1.12 1 74 LYS 2.31 0.70 1 75 TYR 0.16 1.52 1 76 LEU -1.33 -0.09 1 77 ASP 2.71 -1.20 1 78 ILE -0.70 0.79 1 80 LYS 2.07 -0.65 1 81 MET -1.95 3.11 1 82 LEU -3.92 1.47 1 83 ASP -3.89 2.61 1 84 ALA 2.35 1.51 1 85 GLU 4.08 -0.54 1 86 ASP 2.33 0.62 1 87 ILE 3.67 -0.77 1 88 VAL 3.87 -0.41 1 89 ASN 0.65 0.44 1 90 THR -0.40 0.02 1 91 ALA 3.50 -0.56 1 92 ARG -2.65 1.70 1 94 ASP 0.18 0.58 1 95 GLU -0.24 1.44 1 96 LYS 4.84 -1.27 1 97 ALA 3.30 -0.66 1 98 ILE 7.09 -2.22 1 99 MET 4.92 0.10 1 100 THR 6.91 -1.38 1 101 TYR 3.07 0.71 1 102 VAL 6.77 -1.45 1 103 SER 5.62 -1.12 1 104 SER 5.19 -0.65 1 105 PHE 5.02 -1.33 1 106 TYR 4.37 -1.01 1 107 HIS 3.65 0.96 1 108 ALA 3.24 -0.91 1 109 PHE -1.55 -0.37 1 110 SER 2.50 -0.61 1 112 ALA -0.54 0.61 1 113 GLN 1.17 0.87 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15808_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 0.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.08 _LACS_plot.Line_2_terminator_val_x_2 7.33 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 TYR 4.37 -1.30 0 51 ILE -7.03 0.40 0 99 MET 4.92 -1.43 0 10 LEU 2.99 -0.09 1 11 LEU 5.18 -0.37 1 12 LEU 3.36 -0.06 1 13 TRP 6.53 -0.35 1 15 GLN 5.68 -0.67 1 16 ARG 4.02 -0.26 1 17 LYS 0.71 -0.36 1 18 THR -0.75 0.25 1 19 ALA 7.33 -0.38 1 21 TYR 1.11 -0.34 1 22 LYS 2.87 -0.13 1 23 ASN 0.58 -0.11 1 24 VAL -3.02 -0.24 1 25 ASN -0.68 -0.15 1 26 VAL 3.98 -0.83 1 27 GLN -3.72 -0.12 1 28 ASN -1.82 -0.49 1 29 PHE 1.97 0.56 1 30 HIS -0.79 0.31 1 31 ILE 5.11 -0.24 1 32 SER 3.15 -0.09 1 33 TRP 0.12 -0.44 1 34 LYS 2.68 -0.34 1 35 ASP 0.02 0.13 1 37 LEU 6.76 -0.41 1 38 ALA 5.66 -0.69 1 39 PHE 3.96 -0.14 1 40 ASN 2.62 -0.39 1 41 ALA 4.54 -1.28 1 42 LEU 1.69 -0.62 1 43 ILE 4.60 -0.21 1 44 HIS 3.60 -1.02 1 45 ARG 1.95 -0.41 1 46 HIS 1.73 -0.42 1 47 ARG -2.49 0.23 1 49 GLU 3.16 -0.05 1 50 LEU -0.71 -0.10 1 52 GLU -0.08 0.40 1 53 TYR 5.29 -1.18 1 54 ASP 2.58 -0.35 1 55 LYS -0.25 -0.10 1 56 LEU 1.37 -0.09 1 57 ARG -3.60 0.24 1 58 LYS 3.31 -0.65 1 59 ASP 0.32 -0.10 1 60 ASP -1.01 0.30 1 62 VAL 7.13 -0.68 1 63 THR 5.67 -0.45 1 64 ASN 4.06 -0.57 1 65 LEU 2.78 -0.86 1 66 ASN 4.33 -0.39 1 67 ASN 3.40 -0.28 1 68 ALA 3.94 -0.36 1 69 PHE 1.22 0.32 1 70 GLU 2.96 -0.02 1 71 VAL 5.45 -0.13 1 72 ALA 3.18 -0.27 1 73 GLU 2.26 -0.16 1 74 LYS 2.31 -0.37 1 75 TYR 0.16 0.26 1 76 LEU -1.33 0.44 1 77 ASP 2.71 -0.29 1 78 ILE -0.70 -0.10 1 80 LYS 2.07 -0.07 1 81 MET -1.95 -0.17 1 82 LEU -3.92 -0.02 1 83 ASP -3.89 0.20 1 84 ALA 2.35 -0.25 1 85 GLU 4.08 -0.43 1 86 ASP 2.33 -0.17 1 87 ILE 3.67 -0.30 1 88 VAL 3.87 -0.25 1 89 ASN 0.65 0.08 1 90 THR -0.40 0.10 1 91 ALA 3.50 -0.21 1 92 ARG -2.65 0.13 1 94 ASP 0.18 -0.19 1 95 GLU -0.24 0.51 1 96 LYS 4.84 -0.31 1 97 ALA 3.30 -0.24 1 98 ILE 7.09 -0.50 1 100 THR 6.91 -0.62 1 101 TYR 3.07 -0.06 1 102 VAL 6.77 -0.58 1 103 SER 5.62 -0.47 1 104 SER 5.19 -0.14 1 105 PHE 5.02 -0.82 1 107 HIS 3.65 -0.68 1 108 ALA 3.24 -0.32 1 109 PHE -1.55 0.43 1 110 SER 2.50 -0.18 1 112 ALA -0.54 0.11 1 113 GLN 1.17 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15808_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.03 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _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 7.33 _LACS_plot.Line_2_terminator_val_y_2 2.47 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 113 GLN 1.17 4.95 0 29 PHE 1.97 -3.93 0 51 ILE -7.03 -1.39 0 10 LEU 2.99 1.96 1 11 LEU 5.18 1.00 1 12 LEU 3.36 1.78 1 13 TRP 6.53 2.03 1 15 GLN 5.68 2.16 1 16 ARG 4.02 4.33 1 17 LYS 0.71 0.25 1 18 THR -0.75 0.20 1 19 ALA 7.33 -0.30 1 21 TYR 1.11 0.00 1 22 LYS 2.87 0.10 1 23 ASN 0.58 -1.92 1 24 VAL -3.02 -2.10 1 25 ASN -0.68 -1.02 1 26 VAL 3.98 -1.10 1 27 GLN -3.72 -2.12 1 28 ASN -1.82 -1.51 1 30 HIS -0.79 2.79 1 31 ILE 5.11 2.11 1 32 SER 3.15 -0.87 1 33 TRP 0.12 1.02 1 34 LYS 2.68 -1.40 1 35 ASP 0.02 0.87 1 37 LEU 6.76 1.11 1 38 ALA 5.66 1.50 1 39 PHE 3.96 2.19 1 40 ASN 2.62 1.64 1 41 ALA 4.54 0.19 1 42 LEU 1.69 1.48 1 43 ILE 4.60 0.79 1 44 HIS 3.60 1.37 1 45 ARG 1.95 0.07 1 46 HIS 1.73 1.05 1 47 ARG -2.49 -2.02 1 49 GLU 3.16 1.00 1 50 LEU -0.71 -1.05 1 52 GLU -0.08 0.33 1 53 TYR 5.29 1.20 1 54 ASP 2.58 0.29 1 55 LYS -0.25 0.52 1 56 LEU 1.37 -0.16 1 57 ARG -3.60 1.29 1 58 LYS 3.31 -1.35 1 59 ASP 0.32 -1.71 1 62 VAL 7.13 1.69 1 63 THR 5.67 2.42 1 64 ASN 4.06 3.55 1 65 LEU 2.78 -1.71 1 66 ASN 4.33 2.77 1 67 ASN 3.40 1.35 1 68 ALA 3.94 1.38 1 69 PHE 1.22 4.37 1 70 GLU 2.96 2.28 1 71 VAL 5.45 2.49 1 72 ALA 3.18 1.84 1 73 GLU 2.26 1.89 1 74 LYS 2.31 2.02 1 75 TYR 0.16 1.03 1 76 LEU -1.33 -2.21 1 77 ASP 2.71 -1.66 1 78 ILE -0.70 -1.61 1 80 LYS 2.07 0.84 1 81 MET -1.95 -1.79 1 82 LEU -3.92 -3.24 1 83 ASP -3.89 0.35 1 84 ALA 2.35 1.17 1 85 GLU 4.08 1.88 1 86 ASP 2.33 1.88 1 87 ILE 3.67 0.55 1 88 VAL 3.87 1.46 1 89 ASN 0.65 0.10 1 90 THR -0.40 -0.96 1 91 ALA 3.50 0.80 1 92 ARG -2.65 -2.23 1 94 ASP 0.18 -0.15 1 95 GLU -0.24 1.53 1 96 LYS 4.84 2.96 1 97 ALA 3.30 2.47 1 98 ILE 7.09 1.42 1 99 MET 4.92 2.08 1 100 THR 6.91 1.46 1 101 TYR 3.07 2.46 1 102 VAL 6.77 2.79 1 103 SER 5.62 1.46 1 104 SER 5.19 2.64 1 105 PHE 5.02 0.59 1 106 TYR 4.37 1.95 1 107 HIS 3.65 3.63 1 108 ALA 3.24 1.89 1 109 PHE -1.55 1.29 1 110 SER 2.50 0.79 1 112 ALA -0.54 -0.81 1 stop_ save_