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 bmr7302_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _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 -1.46 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 5.19 _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 46 PHE 6.17 5.71 0 101 LEU 2.90 4.18 0 66 ILE -4.79 -4.11 0 72 GLU -4.09 -0.18 0 44 ARG -7.70 -3.51 0 41 ALA -6.16 -1.80 0 124 LEU -4.24 -0.18 0 10 ASP 2.25 2.62 1 12 GLU -5.40 -1.99 1 13 LYS 0.02 -0.15 1 14 ILE -0.18 -1.41 1 16 ASP -3.87 -1.11 1 18 MET 2.50 1.62 1 19 ASN -0.48 -0.43 1 20 ALA -1.08 -0.21 1 21 TYR -4.24 -2.18 1 22 VAL -1.64 -1.26 1 23 ALA -5.93 -2.69 1 24 TYR -3.40 -0.73 1 25 LYS 0.60 0.06 1 26 VAL -0.07 -0.74 1 27 THR -0.51 -0.35 1 28 THR 1.59 0.69 1 29 GLN -4.14 -1.75 1 30 THR -2.44 -2.02 1 31 SER -1.25 -1.00 1 32 LEU -0.51 0.36 1 34 LEU 0.12 0.65 1 35 PHE -2.84 -0.88 1 36 ARG 2.79 2.15 1 37 SER -3.10 -1.99 1 38 LYS 0.51 0.66 1 39 GLN -2.13 -0.64 1 40 PHE -1.57 -1.93 1 42 VAL -6.72 -3.06 1 43 LYS -2.41 -1.47 1 45 ARG -4.85 -2.01 1 48 ASP 2.89 3.33 1 49 PHE 5.49 4.05 1 50 LEU 4.18 2.71 1 52 LEU 4.11 2.68 1 53 TYR 5.01 3.64 1 54 GLU 3.77 3.11 1 55 LYS 3.40 2.87 1 56 LEU 2.34 2.28 1 57 SER 4.18 2.95 1 58 GLU 1.80 1.58 1 59 LYS 1.36 1.40 1 60 HIS 0.26 1.81 1 61 SER 2.52 1.71 1 62 GLN 1.21 0.65 1 63 ASN 0.14 0.19 1 65 PHE -0.41 -0.25 1 67 VAL -0.98 -1.12 1 73 LYS 0.50 0.23 1 74 SER 0.38 0.22 1 75 LEU 0.86 0.49 1 76 ILE 0.15 0.20 1 78 MET 0.19 0.14 1 79 THR 0.44 0.17 1 80 LYS 0.05 -0.07 1 81 VAL -0.09 -0.11 1 82 LYS 0.30 0.14 1 83 VAL -0.02 -0.05 1 85 LYS -0.24 -0.03 1 86 GLU -0.34 -0.21 1 87 ASP 1.00 0.36 1 88 SER 0.09 0.33 1 89 SER 0.17 0.41 1 90 SER 3.63 2.75 1 91 ALA 3.27 2.78 1 92 GLU 3.89 3.48 1 93 PHE 3.60 2.51 1 94 LEU 3.05 1.02 1 95 GLU 4.08 3.12 1 96 LYS 3.77 2.72 1 97 ARG 5.21 3.92 1 98 ARG 3.40 2.63 1 99 ALA 3.02 2.35 1 100 ALA 3.78 2.14 1 102 GLU 3.85 3.25 1 103 ARG 3.10 2.81 1 104 TYR 1.74 1.89 1 105 LEU 4.56 2.96 1 106 GLN 3.83 2.86 1 107 ARG 5.09 3.73 1 108 ILE 3.88 1.93 1 109 VAL -0.07 0.02 1 110 ASN -0.84 1.59 1 111 HIS -1.21 -2.08 1 113 THR 3.96 1.30 1 114 MET 3.19 1.80 1 115 LEU -0.10 -0.64 1 116 GLN -2.42 0.03 1 117 ASP 4.12 3.73 1 119 ASP 6.22 4.51 1 120 VAL 6.86 5.06 1 121 ARG 2.84 2.90 1 122 GLU 4.68 4.39 1 123 PHE 1.49 1.23 1 125 GLU 1.83 2.02 1 126 LYS -0.76 0.49 1 127 GLU 0.06 1.35 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7302_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 4.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.54 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 -1.67 _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 46 PHE 6.17 -0.46 0 101 LEU 2.90 1.28 0 66 ILE -4.79 0.68 0 72 GLU -4.09 3.91 0 44 ARG -7.70 4.19 0 41 ALA -6.16 4.36 0 124 LEU -4.24 4.06 0 10 ASP 2.25 0.37 1 12 GLU -5.40 3.41 1 13 LYS 0.02 -0.17 1 14 ILE -0.18 -1.23 1 16 ASP -3.87 2.76 1 18 MET 2.50 -0.88 1 19 ASN -0.48 0.05 1 20 ALA -1.08 0.87 1 21 TYR -4.24 2.06 1 22 VAL -1.64 0.38 1 23 ALA -5.93 3.24 1 24 TYR -3.40 2.67 1 25 LYS 0.60 -0.54 1 26 VAL -0.07 -0.67 1 27 THR -0.51 0.16 1 28 THR 1.59 -0.90 1 29 GLN -4.14 2.39 1 30 THR -2.44 0.42 1 31 SER -1.25 0.25 1 32 LEU -0.51 0.87 1 34 LEU 0.12 0.53 1 35 PHE -2.84 1.96 1 36 ARG 2.79 -0.64 1 37 SER -3.10 1.11 1 38 LYS 0.51 0.15 1 39 GLN -2.13 1.49 1 40 PHE -1.57 -0.36 1 42 VAL -6.72 3.66 1 43 LYS -2.41 0.94 1 45 ARG -4.85 2.84 1 48 ASP 2.89 0.44 1 49 PHE 5.49 -1.44 1 50 LEU 4.18 -1.47 1 52 LEU 4.11 -1.43 1 53 TYR 5.01 -1.37 1 54 GLU 3.77 -0.66 1 55 LYS 3.40 -0.53 1 56 LEU 2.34 -0.06 1 57 SER 4.18 -1.23 1 58 GLU 1.80 -0.22 1 59 LYS 1.36 0.04 1 60 HIS 0.26 1.55 1 61 SER 2.52 -0.81 1 62 GLN 1.21 -0.56 1 63 ASN 0.14 0.05 1 65 PHE -0.41 0.16 1 67 VAL -0.98 -0.14 1 73 LYS 0.50 -0.27 1 74 SER 0.38 -0.16 1 75 LEU 0.86 -0.37 1 76 ILE 0.15 0.05 1 78 MET 0.19 -0.05 1 79 THR 0.44 -0.27 1 80 LYS 0.05 -0.12 1 81 VAL -0.09 -0.02 1 82 LYS 0.30 -0.16 1 83 VAL -0.02 -0.03 1 85 LYS -0.24 0.21 1 86 GLU -0.34 0.13 1 87 ASP 1.00 -0.64 1 88 SER 0.09 0.24 1 89 SER 0.17 0.24 1 90 SER 3.63 -0.88 1 91 ALA 3.27 -0.49 1 92 GLU 3.89 -0.41 1 93 PHE 3.60 -1.09 1 94 LEU 3.05 -2.03 1 95 GLU 4.08 -0.96 1 96 LYS 3.77 -1.05 1 97 ARG 5.21 -1.29 1 98 ARG 3.40 -0.77 1 99 ALA 3.02 -0.67 1 100 ALA 3.78 -1.64 1 102 GLU 3.85 -0.60 1 103 ARG 3.10 -0.29 1 104 TYR 1.74 0.15 1 105 LEU 4.56 -1.60 1 106 GLN 3.83 -0.97 1 107 ARG 5.09 -1.36 1 108 ILE 3.88 -1.95 1 109 VAL -0.07 0.09 1 110 ASN -0.84 2.43 1 111 HIS -1.21 -0.87 1 113 THR 3.96 -2.66 1 114 MET 3.19 -1.39 1 115 LEU -0.10 -0.54 1 116 GLN -2.42 2.45 1 117 ASP 4.12 -0.39 1 119 ASP 6.22 -1.71 1 120 VAL 6.86 -1.80 1 121 ARG 2.84 0.06 1 122 GLU 4.68 -0.29 1 123 PHE 1.49 -0.26 1 125 GLU 1.83 0.19 1 126 LYS -0.76 1.25 1 127 GLU 0.06 1.29 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7302_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 0.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.04 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 LYS -2.41 1.10 0 45 ARG -4.85 1.26 0 41 ALA -6.16 1.33 0 10 ASP 2.25 -0.68 1 12 GLU -5.40 0.04 1 13 LYS 0.02 0.04 1 14 ILE -0.18 -0.25 1 16 ASP -3.87 0.08 1 19 ASN -0.48 0.08 1 20 ALA -1.08 0.32 1 21 TYR -4.24 0.39 1 22 VAL -1.64 0.48 1 23 ALA -5.93 0.65 1 24 TYR -3.40 -0.16 1 25 LYS 0.60 0.42 1 26 VAL -0.07 0.56 1 27 THR -0.51 0.54 1 28 THR 1.59 0.24 1 29 GLN -4.14 0.69 1 30 THR -2.44 0.57 1 31 SER -1.25 0.21 1 32 LEU -0.51 -0.26 1 34 LEU 0.12 -0.48 1 35 PHE -2.84 -0.11 1 36 ARG 2.79 -0.44 1 37 SER -3.10 0.14 1 38 LYS 0.51 -0.35 1 39 GLN -2.13 0.82 1 40 PHE -1.57 0.17 1 42 VAL -6.72 0.48 1 44 ARG -7.70 0.65 1 46 PHE 6.17 -0.25 1 48 ASP 2.89 -0.05 1 49 PHE 5.49 -0.76 1 50 LEU 4.18 -0.48 1 52 LEU 4.11 -0.26 1 53 TYR 5.01 -0.70 1 54 GLU 3.77 -0.91 1 55 LYS 3.40 -0.39 1 56 LEU 2.34 -0.42 1 57 SER 4.18 -0.78 1 58 GLU 1.80 -0.37 1 59 LYS 1.36 -0.26 1 60 HIS 0.26 -0.19 1 61 SER 2.52 -0.44 1 62 GLN 1.21 0.01 1 63 ASN 0.14 -0.32 1 65 PHE -0.41 -0.02 1 66 ILE -4.79 -0.12 1 67 VAL -0.98 -0.23 1 72 GLU 0.38 -0.10 1 75 LEU 0.86 -0.24 1 76 ILE 0.44 -0.10 1 80 LYS 0.05 -0.14 1 81 VAL -0.09 -0.11 1 82 LYS 0.30 -0.14 1 83 VAL -0.02 -0.09 1 85 LYS -0.24 -0.80 1 86 GLU 0.17 0.21 1 90 SER 3.63 -0.32 1 91 ALA 3.27 -0.35 1 92 GLU 3.89 -0.55 1 93 PHE 3.60 -0.46 1 94 LEU 3.05 0.07 1 95 GLU 4.08 -0.41 1 96 LYS 3.77 -0.64 1 97 ARG 5.21 -0.41 1 98 ARG 3.40 -0.55 1 99 ALA 3.02 -0.34 1 100 ALA 3.78 -0.68 1 101 LEU 2.90 -0.73 1 102 GLU 3.85 -0.34 1 103 ARG 3.10 -0.39 1 104 TYR 1.74 -0.61 1 105 LEU 4.56 -0.62 1 106 GLN 3.83 -0.40 1 107 ARG 5.09 -0.61 1 108 ILE 3.88 -0.38 1 109 VAL -0.07 -0.12 1 110 ASN -0.84 -0.40 1 111 HIS -1.21 -0.27 1 113 THR 3.96 -0.26 1 114 MET 3.19 -0.38 1 115 LEU -0.10 -0.27 1 116 GLN -2.42 -0.19 1 117 ASP 4.12 -0.20 1 119 ASP 6.22 -0.72 1 120 VAL 6.86 -0.45 1 121 ARG 2.84 -0.35 1 122 GLU 4.68 -0.64 1 123 PHE 1.49 -0.31 1 124 LEU -4.24 0.12 1 125 GLU 1.83 -0.27 1 126 LYS -0.76 -0.05 1 127 GLU 0.06 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7302_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -2.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.67 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 2.30 _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 127 GLU 0.06 3.97 0 44 ARG -7.70 -1.43 0 72 GLU -4.09 2.48 0 45 ARG -4.85 2.12 0 10 ASP 2.25 -3.50 0 12 GLU -5.40 -2.94 1 13 LYS 0.02 -1.46 1 14 ILE -0.18 -1.12 1 16 ASP -3.87 -0.40 1 18 MET 2.50 0.22 1 19 ASN -0.48 -0.48 1 20 ALA -1.08 -0.87 1 21 TYR -4.24 -3.61 1 22 VAL -1.64 -1.23 1 23 ALA -5.93 -2.89 1 24 TYR -3.40 -1.37 1 25 LYS 0.60 -1.46 1 26 VAL -0.07 -0.04 1 27 THR -0.51 -1.37 1 28 THR 1.59 -1.83 1 29 GLN -4.14 -1.07 1 30 THR -2.44 -3.56 1 31 SER -1.25 0.69 1 32 LEU -0.51 1.48 1 34 LEU 0.12 -1.49 1 35 PHE -2.84 -0.12 1 36 ARG 2.79 -0.12 1 37 SER -3.10 -1.89 1 38 LYS 0.51 -0.06 1 39 GLN -2.13 -1.93 1 40 PHE -1.57 -3.88 1 41 ALA -6.16 -1.08 1 42 VAL -6.72 -2.22 1 43 LYS -2.41 0.94 1 46 PHE 6.17 2.67 1 48 ASP 2.89 3.57 1 49 PHE 5.49 1.68 1 50 LEU 4.18 1.39 1 52 LEU 4.11 0.04 1 53 TYR 5.01 1.70 1 54 GLU 3.77 2.43 1 55 LYS 3.40 3.22 1 56 LEU 2.34 1.98 1 57 SER 4.18 1.82 1 58 GLU 1.80 1.12 1 59 LYS 1.36 0.83 1 60 HIS 0.26 2.14 1 61 SER 2.52 1.03 1 62 GLN 1.21 0.11 1 63 ASN 0.14 0.61 1 65 PHE -0.41 -0.13 1 66 ILE -4.79 0.20 1 67 VAL -0.98 -2.00 1 73 LYS 0.50 -0.10 1 74 SER 0.38 -0.28 1 75 LEU 0.86 0.22 1 76 ILE 0.15 0.05 1 78 MET 0.19 -0.44 1 79 THR 0.44 -0.33 1 80 LYS 0.05 -0.59 1 81 VAL -0.09 -0.51 1 82 LYS 0.30 0.05 1 83 VAL -0.02 -0.01 1 85 LYS -0.24 -0.63 1 86 GLU -0.34 0.18 1 87 ASP 1.00 0.82 1 88 SER 0.09 0.04 1 89 SER 0.17 0.27 1 90 SER 3.63 2.71 1 91 ALA 3.27 1.79 1 92 GLU 3.89 1.92 1 93 PHE 3.60 1.31 1 94 LEU 3.05 1.03 1 95 GLU 4.08 3.70 1 96 LYS 3.77 0.64 1 97 ARG 5.21 1.33 1 98 ARG 3.40 2.52 1 99 ALA 3.02 3.54 1 100 ALA 3.78 0.24 1 101 LEU 2.90 0.72 1 102 GLU 3.85 2.55 1 103 ARG 3.10 0.63 1 104 TYR 1.74 0.99 1 105 LEU 4.56 1.55 1 106 GLN 3.83 2.50 1 107 ARG 5.09 0.89 1 108 ILE 3.88 -1.04 1 109 VAL -0.07 -0.04 1 110 ASN -0.84 2.10 1 111 HIS -1.21 1.12 1 113 THR 3.96 0.27 1 114 MET 3.19 -1.12 1 115 LEU -0.10 -0.16 1 116 GLN -2.42 0.29 1 117 ASP 4.12 3.40 1 119 ASP 6.22 0.78 1 120 VAL 6.86 1.85 1 121 ARG 2.84 2.01 1 122 GLU 4.68 1.28 1 123 PHE 1.49 -0.91 1 124 LEU -4.24 0.85 1 125 GLU 1.83 -0.09 1 126 LYS -0.76 -1.22 1 stop_ save_