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 bmr11308_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.08 _LACS_plot.Line_1_terminator_val_y_1 -1.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.35 _LACS_plot.Line_2_terminator_val_x_2 8.05 _LACS_plot.Line_2_terminator_val_y_2 5.97 _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 25 PHE -5.08 -0.21 0 10 ALA 0.11 0.09 1 11 HIS -0.44 0.98 1 13 ARG -0.07 0.03 1 14 GLN 0.00 0.14 1 15 HIS -4.17 0.05 1 16 THR -3.89 -1.13 1 19 LEU -1.25 1.59 1 20 PHE -0.59 0.13 1 22 ASP -0.18 -0.38 1 23 ARG 1.04 1.86 1 24 LEU -4.15 -1.82 1 26 ALA -0.74 -0.26 1 27 SER -4.29 -1.51 1 28 ALA 3.05 2.63 1 29 GLU 5.66 4.56 1 30 GLU 1.70 2.59 1 31 THR 8.05 5.50 1 32 PHE 5.12 2.94 1 33 SER 5.10 3.79 1 34 HIS 5.77 4.17 1 36 LYS 4.22 4.28 1 37 LEU 1.74 2.52 1 38 GLU 0.05 0.42 1 39 HIS -1.40 -1.12 1 40 GLN 5.58 1.87 1 41 PHE -3.28 -1.25 1 42 ASN -2.61 -2.34 1 43 ILE -0.05 -0.75 1 44 ASP 4.17 2.98 1 45 SER 3.87 2.46 1 46 MET 3.41 2.03 1 47 VAL 5.79 4.42 1 48 HIS 3.23 4.03 1 49 LYS 3.04 3.24 1 50 HIS -1.21 0.87 1 52 LEU 1.05 0.77 1 53 GLU -3.08 -2.63 1 54 PHE 4.94 5.25 1 55 TYR 5.88 4.36 1 57 TYR 4.51 4.15 1 58 ILE 4.87 3.29 1 59 LYS 3.68 2.78 1 60 LEU 5.37 3.37 1 61 ILE 4.96 0.68 1 62 ASN 5.13 4.13 1 63 PHE 4.66 4.48 1 64 ILE 5.35 4.01 1 65 ARG 2.33 2.26 1 66 LEU 0.57 1.92 1 67 LYS 0.22 -1.39 1 68 ASN 3.15 3.18 1 70 THR -2.83 -1.47 1 71 VAL 6.56 4.93 1 72 GLU 4.62 3.59 1 73 TYR 3.84 3.37 1 74 MET 3.98 0.44 1 75 ASN 1.73 1.27 1 76 SER -0.65 0.01 1 77 ILE 0.45 -0.16 1 78 TYR -2.31 -1.07 1 79 ASN 0.17 0.89 1 81 VAL 2.05 -1.08 1 83 TRP 2.89 -0.29 1 84 GLU 1.72 -0.21 1 85 LYS -2.64 -0.29 1 86 ASP 4.35 3.16 1 87 GLU 3.16 2.28 1 88 TYR 3.33 1.01 1 89 LEU 0.75 0.96 1 90 LYS -0.26 -0.30 1 92 VAL 3.57 2.98 1 93 LEU -2.34 -2.12 1 94 GLU 1.57 1.29 1 95 ASP 1.76 0.52 1 96 ASP -0.30 0.11 1 97 LEU 2.73 2.45 1 98 LEU 5.50 2.46 1 99 LEU 2.00 0.72 1 100 GLN -0.45 -0.82 1 101 PHE -1.65 -0.08 1 102 ASP -1.13 -1.58 1 103 VAL 2.00 0.88 1 104 GLU 2.47 1.56 1 105 ASP 2.02 1.22 1 106 LEU 0.64 0.01 1 107 TYR -0.16 -0.44 1 108 GLU -1.07 -0.17 1 110 VAL 0.25 0.10 1 111 SER -0.43 -0.22 1 112 THR -0.30 -0.24 1 114 PHE 0.42 0.12 1 115 SER -0.53 -0.35 1 119 SER 0.09 -0.04 1 120 SER -0.07 0.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11308_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.08 _LACS_plot.Line_1_terminator_val_y_1 3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.65 _LACS_plot.Line_2_terminator_val_x_2 8.05 _LACS_plot.Line_2_terminator_val_y_2 -2.08 _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 25 PHE -5.08 4.87 0 10 ALA 0.11 -0.02 1 11 HIS -0.44 1.42 1 13 ARG -0.07 0.10 1 14 GLN 0.00 0.14 1 15 HIS -4.17 4.22 1 16 THR -3.89 2.76 1 19 LEU -1.25 2.84 1 20 PHE -0.59 0.72 1 22 ASP -0.18 -0.20 1 23 ARG 1.04 0.82 1 24 LEU -4.15 2.33 1 26 ALA -0.74 0.48 1 27 SER -4.29 2.78 1 28 ALA 3.05 -0.42 1 29 GLU 5.66 -1.10 1 30 GLU 1.70 0.89 1 31 THR 8.05 -2.55 1 32 PHE 5.12 -2.18 1 33 SER 5.10 -1.31 1 34 HIS 5.77 -1.60 1 36 LYS 4.22 0.06 1 37 LEU 1.74 0.78 1 38 GLU 0.05 0.37 1 39 HIS -1.40 0.28 1 40 GLN 5.58 -3.71 1 41 PHE -3.28 2.03 1 42 ASN -2.61 0.27 1 43 ILE -0.05 -0.70 1 44 ASP 4.17 -1.19 1 45 SER 3.87 -1.41 1 46 MET 3.41 -1.38 1 47 VAL 5.79 -1.37 1 48 HIS 3.23 0.80 1 49 LYS 3.04 0.20 1 50 HIS -1.21 2.08 1 52 LEU 1.05 -0.28 1 53 GLU -3.08 0.45 1 54 PHE 4.94 0.31 1 55 TYR 5.88 -1.52 1 57 TYR 4.51 -0.36 1 58 ILE 4.87 -1.58 1 59 LYS 3.68 -0.90 1 60 LEU 5.37 -2.00 1 61 ILE 4.96 -4.28 1 62 ASN 5.13 -1.00 1 63 PHE 4.66 -0.18 1 64 ILE 5.35 -1.34 1 65 ARG 2.33 -0.07 1 66 LEU 0.57 1.35 1 67 LYS 0.22 -1.61 1 68 ASN 3.15 0.03 1 70 THR -2.83 1.36 1 71 VAL 6.56 -1.63 1 72 GLU 4.62 -1.03 1 73 TYR 3.84 -0.47 1 74 MET 3.98 -3.54 1 75 ASN 1.73 -0.46 1 76 SER -0.65 0.66 1 77 ILE 0.45 -0.61 1 78 TYR -2.31 1.24 1 79 ASN 0.17 0.72 1 81 VAL 2.05 -3.13 1 83 TRP 2.89 -3.18 1 84 GLU 1.72 -1.93 1 85 LYS -2.64 2.35 1 86 ASP 4.35 -1.19 1 87 GLU 3.16 -0.88 1 88 TYR 3.33 -2.32 1 89 LEU 0.75 0.21 1 90 LYS -0.26 -0.04 1 92 VAL 3.57 -0.59 1 93 LEU -2.34 0.22 1 94 GLU 1.57 -0.28 1 95 ASP 1.76 -1.24 1 96 ASP -0.30 0.41 1 97 LEU 2.73 -0.28 1 98 LEU 5.50 -3.04 1 99 LEU 2.00 -1.28 1 100 GLN -0.45 -0.37 1 101 PHE -1.65 1.57 1 102 ASP -1.13 -0.45 1 103 VAL 2.00 -1.12 1 104 GLU 2.47 -0.91 1 105 ASP 2.02 -0.80 1 106 LEU 0.64 -0.63 1 107 TYR -0.16 -0.28 1 108 GLU -1.07 0.90 1 110 VAL 0.25 -0.15 1 111 SER -0.43 0.21 1 112 THR -0.30 0.06 1 114 PHE 0.42 -0.30 1 115 SER -0.53 0.18 1 119 SER 0.09 -0.13 1 120 SER -0.07 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11308_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.08 _LACS_plot.Line_1_terminator_val_y_1 0.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 8.05 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 LEU 5.37 -1.36 0 10 ALA 0.11 -0.10 1 11 HIS -0.44 -0.11 1 13 ARG -0.07 0.02 1 14 GLN 0.00 -0.03 1 15 HIS -4.17 0.31 1 16 THR -3.89 0.45 1 19 LEU -1.25 -0.61 1 20 PHE -0.59 -0.08 1 22 ASP -0.18 0.02 1 23 ARG 1.04 -0.50 1 24 LEU -4.15 0.44 1 25 PHE -5.08 0.02 1 26 ALA -0.74 0.03 1 27 SER -4.29 0.25 1 28 ALA 3.05 -0.78 1 29 GLU 5.66 -0.38 1 30 GLU 1.70 -0.32 1 31 THR 8.05 -0.54 1 32 PHE 5.12 0.09 1 33 SER 5.10 -0.09 1 34 HIS 5.77 -0.16 1 36 LYS 4.22 -0.53 1 37 LEU 1.74 -0.21 1 38 GLU 0.05 -0.01 1 39 HIS -1.40 0.30 1 40 GLN 5.58 -0.35 1 41 PHE -3.28 0.12 1 42 ASN -2.61 -0.08 1 43 ILE -0.05 -0.63 1 44 ASP 4.17 -0.61 1 45 SER 3.87 -0.27 1 46 MET 3.41 -0.10 1 47 VAL 5.79 -0.62 1 48 HIS 3.23 -0.25 1 49 LYS 3.04 -0.44 1 50 HIS -1.21 0.08 1 52 LEU 1.05 0.13 1 53 GLU -3.08 0.38 1 54 PHE 4.94 -0.48 1 55 TYR 5.88 -0.43 1 57 TYR 4.51 -0.68 1 58 ILE 4.87 -0.92 1 59 LYS 3.68 0.04 1 61 ILE 4.96 -0.82 1 62 ASN 5.13 -0.29 1 63 PHE 4.66 -0.93 1 64 ILE 5.35 -1.12 1 65 ARG 2.33 -0.52 1 66 LEU 0.57 -0.16 1 67 LYS 0.22 -0.23 1 68 ASN 3.15 -0.47 1 70 THR -2.83 0.22 1 71 VAL 6.56 -1.04 1 72 GLU 4.62 -0.34 1 73 TYR 3.84 -0.34 1 74 MET 3.98 0.09 1 75 ASN 1.73 -0.01 1 76 SER -0.65 0.12 1 77 ILE 0.45 -0.34 1 78 TYR -2.31 0.17 1 79 ASN 0.17 -0.61 1 81 VAL 2.05 -0.72 1 83 TRP 2.89 -0.21 1 84 GLU 1.72 -0.05 1 85 LYS -2.64 0.15 1 86 ASP 4.35 -0.38 1 87 GLU 3.16 -0.35 1 88 TYR 3.33 0.31 1 89 LEU 0.75 -0.07 1 90 LYS -0.26 -0.10 1 92 VAL 3.57 -0.43 1 93 LEU -2.34 0.23 1 94 GLU 1.57 -0.44 1 95 ASP 1.76 -0.33 1 96 ASP -0.30 -0.35 1 97 LEU 2.73 -0.28 1 98 LEU 5.50 -0.31 1 99 LEU 2.00 0.13 1 100 GLN -0.45 0.26 1 101 PHE -1.65 -0.14 1 102 ASP -1.13 -0.12 1 103 VAL 2.00 -0.64 1 104 GLU 2.47 -0.60 1 105 ASP 2.02 -0.20 1 106 LEU 0.64 -0.09 1 107 TYR -0.16 0.00 1 108 GLU -1.07 -0.10 1 110 VAL 0.25 -0.02 1 111 SER -0.43 0.06 1 112 THR -0.30 -0.01 1 114 PHE 0.42 -0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11308_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.08 _LACS_plot.Line_1_terminator_val_y_1 -1.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.40 _LACS_plot.Line_2_terminator_val_x_2 8.05 _LACS_plot.Line_2_terminator_val_y_2 2.68 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 GLN 5.58 -2.11 0 10 ALA 0.11 -0.09 1 11 HIS -0.44 1.71 1 13 ARG -0.07 -0.10 1 14 GLN 0.00 -1.18 1 15 HIS -4.17 0.54 1 16 THR -3.89 1.44 1 19 LEU -1.25 -0.07 1 20 PHE -0.59 -1.52 1 22 ASP -0.18 0.79 1 23 ARG 1.04 -2.56 1 24 LEU -4.15 -0.68 1 25 PHE -5.08 -0.19 1 26 ALA -0.74 -1.65 1 27 SER -4.29 0.59 1 28 ALA 3.05 0.09 1 29 GLU 5.66 3.23 1 30 GLU 1.70 2.53 1 31 THR 8.05 2.69 1 32 PHE 5.12 3.89 1 33 SER 5.10 2.00 1 34 HIS 5.77 3.48 1 36 LYS 4.22 1.54 1 37 LEU 1.74 0.93 1 38 GLU 0.05 0.52 1 39 HIS -1.40 -0.42 1 41 PHE -3.28 -2.57 1 42 ASN -2.61 -0.41 1 43 ILE -0.05 -1.89 1 44 ASP 4.17 2.15 1 45 SER 3.87 2.41 1 46 MET 3.41 1.86 1 47 VAL 5.79 1.95 1 48 HIS 3.23 3.81 1 49 LYS 3.04 1.40 1 50 HIS -1.21 1.01 1 52 LEU 1.05 -0.75 1 53 GLU -3.08 -1.19 1 54 PHE 4.94 0.38 1 55 TYR 5.88 2.10 1 57 TYR 4.51 -0.71 1 58 ILE 4.87 1.06 1 59 LYS 3.68 1.78 1 60 LEU 5.37 -0.07 1 61 ILE 4.96 2.07 1 62 ASN 5.13 2.24 1 63 PHE 4.66 1.64 1 64 ILE 5.35 3.24 1 65 ARG 2.33 2.03 1 66 LEU 0.57 0.73 1 67 LYS 0.22 -0.08 1 68 ASN 3.15 2.92 1 70 THR -2.83 1.74 1 71 VAL 6.56 1.54 1 72 GLU 4.62 3.09 1 73 TYR 3.84 3.19 1 74 MET 3.98 2.79 1 75 ASN 1.73 0.84 1 76 SER -0.65 -0.65 1 77 ILE 0.45 -1.27 1 78 TYR -2.31 -2.90 1 79 ASN 0.17 -0.60 1 81 VAL 2.05 1.34 1 83 TRP 2.89 -1.66 1 84 GLU 1.72 -0.44 1 85 LYS -2.64 0.70 1 86 ASP 4.35 2.76 1 87 GLU 3.16 1.47 1 88 TYR 3.33 -1.78 1 89 LEU 0.75 0.32 1 90 LYS -0.26 3.12 1 92 VAL 3.57 0.34 1 93 LEU -2.34 -1.51 1 94 GLU 1.57 0.15 1 95 ASP 1.76 -1.15 1 96 ASP -0.30 3.70 1 97 LEU 2.73 3.09 1 98 LEU 5.50 2.28 1 99 LEU 2.00 -0.87 1 100 GLN -0.45 -1.22 1 101 PHE -1.65 -2.35 1 102 ASP -1.13 -0.93 1 103 VAL 2.00 -0.14 1 104 GLU 2.47 1.12 1 105 ASP 2.02 0.48 1 106 LEU 0.64 -0.48 1 107 TYR -0.16 -0.43 1 108 GLU -1.07 0.57 1 110 VAL 0.25 0.04 1 111 SER -0.43 -0.38 1 112 THR -0.30 1.02 1 114 PHE 0.42 0.03 1 115 SER -0.53 1.23 1 119 SER 0.09 0.09 1 120 SER -0.07 0.09 1 stop_ save_