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 bmr7322_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 -1.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.66 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 5.49 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 PHE 2.77 4.92 0 10 ASP 4.51 2.82 1 11 ILE 5.46 4.93 1 12 ALA 4.24 2.84 1 13 ALA 3.81 2.43 1 14 ALA 2.66 1.97 1 15 LEU 3.14 1.71 1 16 GLN 4.56 3.26 1 17 GLU 0.84 1.14 1 19 GLN 3.90 3.71 1 20 ASP 1.87 0.67 1 22 ASP 7.23 4.40 1 23 THR -0.30 0.76 1 24 PHE 1.70 1.40 1 25 GLU -4.86 -1.77 1 27 GLN 5.71 4.03 1 28 LYS 3.55 2.88 1 29 PHE 3.57 4.02 1 30 PHE 3.77 0.72 1 31 GLN 3.49 2.57 1 32 THR 6.45 4.50 1 33 SER 3.00 2.79 1 35 LEU 3.38 3.73 1 36 SER 2.80 2.45 1 37 LYS -0.47 -0.53 1 38 MET -2.66 -0.65 1 39 SER -2.24 -0.90 1 40 ALA 4.48 3.38 1 41 SER 4.71 3.45 1 42 GLN 2.90 3.50 1 43 VAL 7.16 5.40 1 44 LYS 5.14 4.04 1 45 ASP 3.73 3.18 1 46 ILE 5.21 3.85 1 47 PHE 5.58 4.46 1 48 ARG 3.88 2.79 1 49 PHE 2.64 2.14 1 50 ILE 2.83 1.74 1 51 ASP -0.05 -1.88 1 52 ASN 3.18 3.00 1 53 ASP 0.63 -0.75 1 54 GLN 4.20 1.15 1 55 SER 0.78 1.33 1 57 TYR -4.64 -1.54 1 58 LEU -2.39 -1.83 1 59 ASP -2.98 -1.29 1 61 ASP 3.00 2.36 1 62 GLU -0.04 0.47 1 63 LEU 3.31 2.58 1 64 LYS 4.40 2.51 1 65 TYR 0.55 -0.97 1 67 LEU 4.01 2.51 1 68 GLN 2.85 0.25 1 69 LYS 1.80 -0.87 1 70 PHE 2.86 2.17 1 71 GLN -1.99 1.21 1 72 SER 4.39 3.79 1 73 ASP 0.71 -0.60 1 74 ALA -2.79 -0.49 1 75 ARG -0.36 -1.06 1 76 GLU -1.59 -0.41 1 77 LEU -1.47 -0.94 1 78 THR -2.48 -1.32 1 79 GLU 4.00 3.29 1 80 SER 4.76 3.50 1 81 GLU 0.76 2.14 1 82 THR 7.40 5.50 1 83 LYS 4.55 3.22 1 84 SER 4.43 3.35 1 85 LEU 3.03 3.20 1 86 MET 3.49 2.89 1 87 ASP 2.76 2.16 1 88 ALA 1.99 1.01 1 89 ALA -1.55 -0.24 1 90 ASP 1.00 -0.20 1 91 ASN -0.28 0.50 1 92 ASP 1.20 0.60 1 94 ASP 0.21 -0.18 1 96 LYS -3.40 -1.33 1 97 ILE -1.16 0.31 1 99 ALA 3.58 2.99 1 100 ASP 4.57 3.10 1 101 GLU 4.04 3.29 1 102 PHE 3.24 3.70 1 103 GLN 5.22 3.56 1 104 GLU 2.62 1.91 1 105 MET 3.08 3.12 1 106 VAL 3.11 1.10 1 107 HIS -0.11 0.18 1 108 SER 1.41 2.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7322_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 3.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -1.90 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 PHE 2.77 2.15 0 10 ASP 4.51 -1.69 1 11 ILE 5.46 -0.53 1 12 ALA 4.24 -1.40 1 13 ALA 3.81 -1.38 1 14 ALA 2.66 -0.69 1 15 LEU 3.14 -1.43 1 16 GLN 4.56 -1.30 1 17 GLU 0.84 0.30 1 19 GLN 3.90 -0.19 1 20 ASP 1.87 -1.20 1 22 ASP 7.23 -2.83 1 23 THR -0.30 1.06 1 24 PHE 1.70 -0.30 1 25 GLU -4.86 3.09 1 27 GLN 5.71 -1.68 1 28 LYS 3.55 -0.67 1 29 PHE 3.57 0.45 1 30 PHE 3.77 -3.05 1 31 GLN 3.49 -0.92 1 32 THR 6.45 -1.95 1 33 SER 3.00 -0.21 1 35 LEU 3.38 0.35 1 36 SER 2.80 -0.35 1 37 LYS -0.47 -0.06 1 38 MET -2.66 2.01 1 39 SER -2.24 1.34 1 40 ALA 4.48 -1.10 1 41 SER 4.71 -1.26 1 42 GLN 2.90 0.60 1 43 VAL 7.16 -1.76 1 44 LYS 5.14 -1.10 1 45 ASP 3.73 -0.55 1 46 ILE 5.21 -1.36 1 47 PHE 5.58 -1.12 1 48 ARG 3.88 -1.09 1 49 PHE 2.64 -0.50 1 50 ILE 2.83 -1.09 1 51 ASP -0.05 -1.83 1 52 ASN 3.18 -0.18 1 53 ASP 0.63 -1.38 1 54 GLN 4.20 -3.05 1 55 SER 0.78 0.55 1 57 TYR -4.64 3.10 1 58 LEU -2.39 0.56 1 59 ASP -2.98 1.69 1 61 ASP 3.00 -0.64 1 62 GLU -0.04 0.51 1 63 LEU 3.31 -0.73 1 64 LYS 4.40 -1.89 1 65 TYR 0.55 -1.52 1 67 LEU 4.01 -1.50 1 68 GLN 2.85 -2.60 1 69 LYS 1.80 -2.67 1 70 PHE 2.86 -0.69 1 71 GLN -1.99 3.20 1 72 SER 4.39 -0.60 1 73 ASP 0.71 -1.31 1 74 ALA -2.79 2.30 1 75 ARG -0.36 -0.70 1 76 GLU -1.59 1.18 1 77 LEU -1.47 0.53 1 78 THR -2.48 1.16 1 79 GLU 4.00 -0.71 1 80 SER 4.76 -1.26 1 81 GLU 0.76 1.38 1 82 THR 7.40 -1.90 1 83 LYS 4.55 -1.33 1 84 SER 4.43 -1.08 1 85 LEU 3.03 0.17 1 86 MET 3.49 -0.60 1 87 ASP 2.76 -0.60 1 88 ALA 1.99 -0.98 1 89 ALA -1.55 1.31 1 90 ASP 1.00 -1.20 1 91 ASN -0.28 0.78 1 92 ASP 1.20 -0.60 1 94 ASP 0.21 -0.39 1 96 LYS -3.40 2.07 1 97 ILE -1.16 1.47 1 99 ALA 3.58 -0.59 1 100 ASP 4.57 -1.47 1 101 GLU 4.04 -0.75 1 102 PHE 3.24 0.46 1 103 GLN 5.22 -1.66 1 104 GLU 2.62 -0.71 1 105 MET 3.08 0.04 1 106 VAL 3.11 -2.01 1 107 HIS -0.11 0.29 1 108 SER 1.41 1.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7322_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 0.33 _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 0.11 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _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 99 ALA 3.58 -1.81 0 10 ASP 4.51 -0.22 1 11 ILE 5.46 -0.98 1 12 ALA 4.24 -0.28 1 13 ALA 3.81 -0.26 1 14 ALA 2.66 -0.42 1 15 LEU 3.14 -0.01 1 16 GLN 4.56 -0.29 1 17 GLU 0.84 -0.13 1 19 GLN 3.90 -0.19 1 20 ASP 1.87 0.04 1 22 ASP 7.23 -0.21 1 23 THR -0.30 0.23 1 24 PHE 1.70 -0.16 1 25 GLU -4.86 -0.17 1 27 GLN 5.71 -0.54 1 28 LYS 3.55 -0.37 1 29 PHE 3.57 -0.31 1 30 PHE 3.77 -0.25 1 31 GLN 3.49 0.01 1 32 THR 6.45 -0.67 1 33 SER 3.00 -1.07 1 35 LEU 3.38 -0.43 1 36 SER 2.80 -0.49 1 37 LYS -0.47 0.18 1 38 MET -2.66 0.13 1 39 SER -2.24 0.01 1 40 ALA 4.48 -0.22 1 41 SER 4.71 -0.41 1 42 GLN 2.90 -0.05 1 43 VAL 7.16 -0.57 1 44 LYS 5.14 -0.30 1 45 ASP 3.73 -0.27 1 46 ILE 5.21 -0.40 1 47 PHE 5.58 -1.19 1 48 ARG 3.88 -0.40 1 49 PHE 2.64 -0.27 1 50 ILE 2.83 -0.58 1 51 ASP -0.05 -0.43 1 52 ASN 3.18 -0.48 1 53 ASP 0.63 -0.13 1 54 GLN 4.20 -0.50 1 55 SER 0.78 -0.19 1 57 TYR -4.64 0.80 1 58 LEU -2.39 0.38 1 59 ASP -2.98 0.24 1 61 ASP 3.00 -0.17 1 62 GLU -0.04 0.10 1 63 LEU 3.31 -0.34 1 64 LYS 4.40 -0.47 1 65 TYR 0.55 0.07 1 66 PHE 2.77 -0.53 1 67 LEU 4.01 -0.51 1 68 GLN 2.85 0.32 1 69 LYS 1.80 -0.39 1 70 PHE 2.86 -0.53 1 71 GLN -1.99 -0.03 1 72 SER 4.39 -0.13 1 73 ASP 0.71 0.02 1 74 ALA -2.79 -0.08 1 75 ARG -0.36 0.10 1 76 GLU -1.59 -0.21 1 77 LEU -1.47 0.18 1 78 THR -2.48 -0.01 1 79 GLU 4.00 -0.26 1 80 SER 4.76 -0.27 1 81 GLU 0.76 -0.15 1 82 THR 7.40 -0.72 1 83 LYS 4.55 -0.31 1 84 SER 4.43 -0.18 1 85 LEU 3.03 -0.30 1 86 MET 3.49 -0.42 1 87 ASP 2.76 -0.23 1 88 ALA 1.99 -0.09 1 89 ALA -1.55 0.01 1 90 ASP 1.00 -0.06 1 91 ASN -0.28 -0.02 1 92 ASP 1.20 -0.10 1 94 ASP 0.21 -0.13 1 96 LYS -3.40 0.50 1 97 ILE -1.16 0.20 1 100 ASP 4.57 -0.35 1 101 GLU 4.04 -0.27 1 102 PHE 3.24 -0.47 1 103 GLN 5.22 -0.63 1 104 GLU 2.62 -0.35 1 105 MET 3.08 -0.39 1 106 VAL 3.11 -1.02 1 107 HIS -0.11 0.08 1 108 SER 1.41 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7322_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.86 _LACS_plot.Line_1_terminator_val_y_1 -1.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.12 _LACS_plot.Line_2_terminator_val_x_2 7.39 _LACS_plot.Line_2_terminator_val_y_2 2.47 _LACS_plot.Y_axis_chem_shift_offset -0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 PHE 3.57 4.82 0 25 GLU -4.86 -1.31 0 108 SER 1.41 4.46 0 22 ASP 7.23 -0.37 0 57 TYR -4.64 -2.31 0 10 ASP 4.51 2.37 1 11 ILE 5.46 0.70 1 12 ALA 4.24 3.21 1 13 ALA 3.81 2.43 1 14 ALA 2.66 2.82 1 15 LEU 3.14 3.02 1 16 GLN 4.56 3.05 1 17 GLU 0.84 0.11 1 19 GLN 3.90 0.71 1 20 ASP 1.87 -1.02 1 23 THR -0.30 2.01 1 24 PHE 1.70 -1.82 1 27 GLN 5.71 2.67 1 28 LYS 3.55 0.89 1 30 PHE 3.77 1.30 1 31 GLN 3.49 3.45 1 32 THR 6.45 1.23 1 33 SER 3.00 -1.40 1 35 LEU 3.38 0.68 1 36 SER 2.80 0.16 1 37 LYS -0.47 0.50 1 38 MET -2.66 0.41 1 39 SER -2.24 -0.23 1 40 ALA 4.48 2.43 1 41 SER 4.71 2.50 1 42 GLN 2.90 3.06 1 43 VAL 7.16 1.58 1 44 LYS 5.14 2.46 1 45 ASP 3.73 2.37 1 46 ILE 5.21 1.09 1 47 PHE 5.58 0.52 1 48 ARG 3.88 1.98 1 49 PHE 2.64 0.91 1 50 ILE 2.83 -0.86 1 51 ASP -0.05 0.41 1 52 ASN 3.18 1.12 1 53 ASP 0.63 -0.37 1 54 GLN 4.20 0.32 1 55 SER 0.78 1.50 1 58 LEU -2.39 -1.67 1 59 ASP -2.98 0.80 1 61 ASP 3.00 1.19 1 62 GLU -0.04 2.85 1 63 LEU 3.31 0.28 1 64 LYS 4.40 1.28 1 65 TYR 0.55 0.03 1 66 PHE 2.77 1.30 1 67 LEU 4.01 3.02 1 68 GLN 2.85 1.88 1 69 LYS 1.80 -0.28 1 70 PHE 2.86 -0.26 1 71 GLN -1.99 0.32 1 72 SER 4.39 -0.62 1 73 ASP 0.71 -0.37 1 74 ALA -2.79 -1.48 1 75 ARG -0.36 -0.37 1 76 GLU -1.59 1.68 1 77 LEU -1.47 0.68 1 78 THR -2.48 1.23 1 79 GLU 4.00 2.85 1 80 SER 4.76 2.89 1 81 GLU 0.76 3.24 1 82 THR 7.40 2.40 1 83 LYS 4.55 1.68 1 84 SER 4.43 2.50 1 85 LEU 3.03 -0.89 1 86 MET 3.49 2.76 1 87 ASP 2.76 1.98 1 88 ALA 1.99 0.08 1 89 ALA -1.55 -0.70 1 90 ASP 1.00 -0.76 1 91 ASN -0.28 0.73 1 92 ASP 1.20 0.41 1 94 ASP 0.21 0.80 1 96 LYS -3.40 -1.06 1 97 ILE -1.16 -0.86 1 99 ALA 3.58 2.43 1 100 ASP 4.57 2.76 1 101 GLU 4.04 2.85 1 102 PHE 3.24 0.13 1 103 GLN 5.22 1.49 1 104 GLU 2.62 2.46 1 105 MET 3.08 1.58 1 106 VAL 3.11 -0.37 1 107 HIS -0.11 -0.51 1 stop_ save_