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 bmr11463_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -1.25 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.74 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 5.89 _LACS_plot.Y_axis_chem_shift_offset 0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 HIS -2.89 1.84 0 87 THR -6.24 -1.26 0 10 ILE 5.12 4.26 1 11 LEU 4.16 2.62 1 12 LEU 4.72 2.98 1 13 ARG 4.55 4.08 1 14 LYS 3.41 2.13 1 15 THR 7.22 5.06 1 16 LEU 4.40 3.41 1 17 GLU 3.50 2.85 1 18 GLN 2.62 3.07 1 19 LEU 2.76 2.55 1 20 GLN 5.10 3.67 1 21 GLU 2.12 1.75 1 22 LYS 1.30 -1.43 1 23 ASP -1.42 -2.32 1 24 THR 3.98 2.49 1 26 ASN 3.62 1.56 1 27 ILE 1.62 1.56 1 28 PHE 0.06 -0.47 1 29 SER 3.33 3.60 1 30 GLU -1.99 -0.31 1 32 VAL 1.83 1.60 1 34 LEU 3.63 1.71 1 35 SER 3.86 2.03 1 36 GLU -1.62 -0.42 1 37 VAL 0.88 -1.04 1 39 ASP -1.10 -1.63 1 40 TYR 5.50 5.69 1 41 LEU 2.95 0.15 1 42 ASP 3.11 1.57 1 44 ILE -1.31 -3.68 1 45 LYS 0.60 0.53 1 46 LYS -2.52 -1.14 1 48 MET -0.87 -2.06 1 49 ASP -3.14 -0.80 1 50 PHE 5.15 4.35 1 51 PHE 5.63 4.37 1 52 THR 7.60 5.38 1 53 MET 4.84 5.47 1 54 LYS 4.52 3.13 1 55 GLN 3.71 2.63 1 56 ASN 3.63 2.11 1 57 LEU 2.53 2.87 1 58 GLU 2.01 0.33 1 59 ALA -0.46 -1.39 1 60 TYR 5.83 0.90 1 61 ARG 1.58 0.79 1 62 TYR -1.11 -2.52 1 63 LEU 0.19 -0.18 1 64 ASN -3.31 -1.38 1 65 PHE 4.27 4.85 1 66 ASP 5.04 3.82 1 67 ASP 3.12 3.10 1 68 PHE 2.96 2.38 1 69 GLU 3.68 3.15 1 70 GLU 3.43 2.71 1 71 ASP 5.84 3.01 1 72 PHE 5.52 3.84 1 73 ASN 3.67 1.96 1 74 LEU 1.61 1.95 1 75 ILE 7.18 5.42 1 76 VAL 4.44 3.82 1 77 SER 5.50 3.60 1 78 ASN 2.97 1.82 1 80 LEU 2.90 1.15 1 81 LYS 1.60 1.63 1 82 TYR 3.40 4.77 1 83 ASN -2.98 0.27 1 84 ALA -0.66 -0.71 1 85 LYS 2.78 1.78 1 86 ASP 0.87 -1.10 1 88 ILE 3.70 2.65 1 89 PHE 2.64 2.78 1 90 TYR 2.92 4.18 1 91 ARG 4.52 3.90 1 92 ALA 2.94 2.38 1 93 ALA 3.56 2.75 1 94 VAL 6.11 5.10 1 95 ARG 3.94 3.09 1 96 LEU 3.26 2.74 1 97 ARG 4.66 3.88 1 98 GLU 2.44 2.52 1 99 GLN 2.68 2.73 1 102 ALA 3.76 2.75 1 103 VAL 4.07 3.19 1 104 LEU 4.19 3.14 1 105 ARG 4.55 3.90 1 106 GLN 4.02 2.59 1 107 ALA 1.71 2.43 1 108 ARG 3.95 3.18 1 109 ARG 3.87 2.74 1 110 GLN 3.77 2.69 1 111 ALA 3.60 2.32 1 112 GLU 2.27 1.79 1 113 LYS 1.74 1.08 1 114 MET 1.21 1.40 1 116 SER -0.25 -0.12 1 119 SER 0.49 0.30 1 120 SER -0.17 -0.05 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11463_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 4.99 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -2.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 -1.71 _LACS_plot.Y_axis_chem_shift_offset 0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 HIS -2.89 4.73 0 87 THR -6.24 4.98 0 10 ILE 5.12 -0.86 1 11 LEU 4.16 -1.54 1 12 LEU 4.72 -1.74 1 13 ARG 4.55 -0.47 1 14 LYS 3.41 -1.28 1 15 THR 7.22 -2.16 1 16 LEU 4.40 -0.99 1 17 GLU 3.50 -0.65 1 18 GLN 2.62 0.45 1 19 LEU 2.76 -0.21 1 20 GLN 5.10 -1.43 1 21 GLU 2.12 -0.37 1 22 LYS 1.30 -2.73 1 23 ASP -1.42 -0.90 1 24 THR 3.98 -1.49 1 26 ASN 3.62 -2.06 1 27 ILE 1.62 -0.06 1 28 PHE 0.06 -0.53 1 29 SER 3.33 0.27 1 30 GLU -1.99 1.68 1 32 VAL 1.83 -0.23 1 34 LEU 3.63 -1.92 1 35 SER 3.86 -1.83 1 36 GLU -1.62 1.20 1 37 VAL 0.88 -1.92 1 39 ASP -1.10 -0.53 1 40 TYR 5.50 0.19 1 41 LEU 2.95 -2.80 1 42 ASP 3.11 -1.54 1 44 ILE -1.31 -2.37 1 45 LYS 0.60 -0.07 1 46 LYS -2.52 1.38 1 48 MET -0.87 -1.19 1 49 ASP -3.14 2.34 1 50 PHE 5.15 -0.80 1 51 PHE 5.63 -1.26 1 52 THR 7.60 -2.22 1 53 MET 4.84 0.63 1 54 LYS 4.52 -1.39 1 55 GLN 3.71 -1.08 1 56 ASN 3.63 -1.52 1 57 LEU 2.53 0.34 1 58 GLU 2.01 -1.68 1 59 ALA -0.46 -0.93 1 60 TYR 5.83 -4.93 1 61 ARG 1.58 -0.79 1 62 TYR -1.11 -1.41 1 63 LEU 0.19 -0.37 1 64 ASN -3.31 1.93 1 65 PHE 4.27 0.58 1 66 ASP 5.04 -1.22 1 67 ASP 3.12 -0.02 1 68 PHE 2.96 -0.58 1 69 GLU 3.68 -0.53 1 70 GLU 3.43 -0.72 1 71 ASP 5.84 -2.83 1 72 PHE 5.52 -1.68 1 73 ASN 3.67 -1.71 1 74 LEU 1.61 0.34 1 75 ILE 7.18 -1.76 1 76 VAL 4.44 -0.62 1 77 SER 5.50 -1.90 1 78 ASN 2.97 -1.15 1 80 LEU 2.90 -1.75 1 81 LYS 1.60 0.03 1 82 TYR 3.40 1.37 1 83 ASN -2.98 3.25 1 84 ALA -0.66 -0.05 1 85 LYS 2.78 -1.00 1 86 ASP 0.87 -1.97 1 88 ILE 3.70 -1.05 1 89 PHE 2.64 0.14 1 90 TYR 2.92 1.26 1 91 ARG 4.52 -0.62 1 92 ALA 2.94 -0.56 1 93 ALA 3.56 -0.81 1 94 VAL 6.11 -1.01 1 95 ARG 3.94 -0.85 1 96 LEU 3.26 -0.52 1 97 ARG 4.66 -0.78 1 98 GLU 2.44 0.08 1 99 GLN 2.68 0.05 1 102 ALA 3.76 -1.01 1 103 VAL 4.07 -0.88 1 104 LEU 4.19 -1.05 1 105 ARG 4.55 -0.65 1 106 GLN 4.02 -1.43 1 107 ALA 1.71 0.72 1 108 ARG 3.95 -0.77 1 109 ARG 3.87 -1.13 1 110 GLN 3.77 -1.08 1 111 ALA 3.60 -1.28 1 112 GLU 2.27 -0.48 1 113 LYS 1.74 -0.66 1 114 MET 1.21 0.19 1 116 SER -0.25 0.13 1 119 SER 0.49 -0.19 1 120 SER -0.17 0.12 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11463_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 0.32 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.06 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 85 LYS 2.78 -1.91 0 10 ILE 5.12 -0.69 1 11 LEU 4.16 -0.21 1 12 LEU 4.72 -1.20 1 13 ARG 4.55 -0.60 1 14 LYS 3.41 -0.28 1 15 THR 7.22 -0.54 1 16 LEU 4.40 -0.29 1 17 GLU 3.50 -0.36 1 18 GLN 2.62 -0.38 1 19 LEU 2.76 -0.46 1 20 GLN 5.10 -0.98 1 21 GLU 2.12 -0.42 1 22 LYS 1.30 -0.03 1 23 ASP -1.42 0.48 1 24 THR 3.98 -0.30 1 26 ASN 3.62 -0.33 1 27 ILE 1.62 -0.52 1 28 PHE 0.06 0.26 1 29 SER 3.33 -0.05 1 30 GLU -1.99 0.24 1 32 VAL 1.83 -0.77 1 34 LEU 3.63 -0.55 1 35 SER 3.86 -0.46 1 36 GLU -1.62 0.02 1 37 VAL 0.88 0.10 1 39 ASP -1.10 0.17 1 40 TYR 5.50 -0.75 1 41 LEU 2.95 0.21 1 42 ASP 3.11 -0.37 1 43 HIS -2.89 -0.40 1 44 ILE -1.31 -0.20 1 45 LYS 0.60 -0.11 1 46 LYS -2.52 0.01 1 48 MET -0.87 0.42 1 49 ASP -3.14 -0.26 1 50 PHE 5.15 -0.16 1 51 PHE 5.63 -0.23 1 52 THR 7.60 -0.73 1 53 MET 4.84 -0.09 1 54 LYS 4.52 -0.44 1 55 GLN 3.71 -0.60 1 56 ASN 3.63 -0.72 1 57 LEU 2.53 -0.07 1 58 GLU 2.01 -0.29 1 59 ALA -0.46 -0.03 1 60 TYR 5.83 -0.15 1 61 ARG 1.58 -0.26 1 62 TYR -1.11 0.54 1 63 LEU 0.19 0.08 1 64 ASN -3.31 -0.24 1 65 PHE 4.27 -0.69 1 66 ASP 5.04 -0.32 1 67 ASP 3.12 -0.29 1 68 PHE 2.96 -1.52 1 69 GLU 3.68 -0.88 1 70 GLU 3.43 -0.31 1 71 ASP 5.84 0.15 1 72 PHE 5.52 -0.82 1 73 ASN 3.67 -0.85 1 74 LEU 1.61 -0.24 1 75 ILE 7.18 -1.15 1 76 VAL 4.44 -1.11 1 77 SER 5.50 -0.63 1 78 ASN 2.97 -0.43 1 80 LEU 2.90 -0.20 1 81 LYS 1.60 -0.09 1 82 TYR 3.40 -0.90 1 83 ASN -2.98 -0.25 1 84 ALA -0.66 -0.19 1 86 ASP 0.87 -0.04 1 87 THR -6.24 0.29 1 88 ILE 3.70 -0.38 1 89 PHE 2.64 -0.74 1 90 TYR 2.92 -0.73 1 91 ARG 4.52 -0.31 1 92 ALA 2.94 -0.02 1 93 ALA 3.56 -0.24 1 94 VAL 6.11 -0.75 1 95 ARG 3.94 -0.07 1 96 LEU 3.26 -0.09 1 97 ARG 4.66 -0.39 1 98 GLU 2.44 -0.19 1 99 GLN 2.68 -0.13 1 102 ALA 3.76 -0.20 1 103 VAL 4.07 -0.45 1 104 LEU 4.19 -0.35 1 105 ARG 4.55 -0.37 1 106 GLN 4.02 -0.29 1 107 ALA 1.71 -0.29 1 108 ARG 3.95 -1.74 1 109 ARG 3.87 -0.36 1 110 GLN 3.77 -0.35 1 111 ALA 3.60 -0.29 1 112 GLU 2.27 -0.35 1 113 LYS 1.74 -0.11 1 114 MET 1.21 -0.14 1 116 SER -0.25 0.01 1 119 SER 0.49 -0.05 1 120 SER -0.17 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11463_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -1.97 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.50 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 3.10 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 THR -6.24 1.08 0 10 ILE 5.12 1.90 1 11 LEU 4.16 3.40 1 12 LEU 4.72 0.61 1 13 ARG 4.55 3.08 1 14 LYS 3.41 2.19 1 15 THR 7.22 1.01 1 16 LEU 4.40 0.47 1 17 GLU 3.50 3.21 1 18 GLN 2.62 3.34 1 19 LEU 2.76 0.81 1 20 GLN 5.10 3.76 1 21 GLU 2.12 1.86 1 22 LYS 1.30 1.08 1 23 ASP -1.42 0.80 1 24 THR 3.98 1.79 1 26 ASN 3.62 0.29 1 27 ILE 1.62 1.96 1 28 PHE 0.06 -0.69 1 29 SER 3.33 -1.32 1 30 GLU -1.99 -0.98 1 32 VAL 1.83 0.50 1 34 LEU 3.63 1.58 1 35 SER 3.86 1.14 1 36 GLU -1.62 -0.47 1 37 VAL 0.88 -1.31 1 39 ASP -1.10 2.21 1 40 TYR 5.50 2.49 1 41 LEU 2.95 0.30 1 42 ASP 3.11 0.49 1 43 HIS -2.89 -0.15 1 44 ILE -1.31 -2.58 1 45 LYS 0.60 0.77 1 46 LYS -2.52 1.66 1 48 MET -0.87 -4.04 1 49 ASP -3.14 -1.14 1 50 PHE 5.15 1.71 1 51 PHE 5.63 2.56 1 52 THR 7.60 2.21 1 53 MET 4.84 2.01 1 54 LYS 4.52 1.45 1 55 GLN 3.71 3.75 1 56 ASN 3.63 1.39 1 57 LEU 2.53 3.46 1 58 GLU 2.01 -0.05 1 59 ALA -0.46 -1.68 1 60 TYR 5.83 0.18 1 61 ARG 1.58 0.95 1 62 TYR -1.11 -1.38 1 63 LEU 0.19 -0.99 1 64 ASN -3.31 -0.46 1 65 PHE 4.27 0.92 1 66 ASP 5.04 2.12 1 67 ASP 3.12 1.40 1 68 PHE 2.96 -0.21 1 69 GLU 3.68 1.01 1 70 GLU 3.43 2.71 1 71 ASP 5.84 1.36 1 72 PHE 5.52 0.64 1 73 ASN 3.67 2.90 1 74 LEU 1.61 0.49 1 75 ILE 7.18 2.70 1 76 VAL 4.44 1.01 1 77 SER 5.50 3.49 1 78 ASN 2.97 0.69 1 80 LEU 2.90 -0.21 1 81 LYS 1.60 1.78 1 82 TYR 3.40 -0.55 1 83 ASN -2.98 -1.37 1 84 ALA -0.66 -0.34 1 85 LYS 2.78 2.49 1 86 ASP 0.87 -0.07 1 88 ILE 3.70 1.80 1 89 PHE 2.64 -0.13 1 90 TYR 2.92 1.79 1 91 ARG 4.52 3.15 1 92 ALA 2.94 3.13 1 93 ALA 3.56 0.85 1 94 VAL 6.11 2.67 1 95 ARG 3.94 2.01 1 96 LEU 3.26 2.03 1 97 ARG 4.66 3.22 1 98 GLU 2.44 3.15 1 99 GLN 2.68 3.61 1 102 ALA 3.76 2.68 1 103 VAL 4.07 2.95 1 104 LEU 4.19 1.41 1 105 ARG 4.55 2.90 1 106 GLN 4.02 2.26 1 107 ALA 1.71 0.89 1 108 ARG 3.95 2.03 1 109 ARG 3.87 3.14 1 110 GLN 3.77 2.73 1 111 ALA 3.60 2.51 1 112 GLU 2.27 2.06 1 113 LYS 1.74 1.15 1 114 MET 1.21 0.55 1 116 SER -0.25 0.03 1 119 SER 0.49 0.11 1 120 SER -0.17 -0.64 1 stop_ save_