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 bmr16864_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _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 -1.86 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 4.78 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 THR -5.19 -6.00 0 15 ILE 7.40 0.53 0 12 SER 0.16 -0.67 1 13 HIS -0.17 0.77 1 14 VAL 3.09 -0.28 1 16 SER 3.16 1.97 1 17 SER -0.23 -0.87 1 18 ILE 0.76 -0.29 1 19 ALA 0.19 -0.55 1 20 SER 0.21 -0.66 1 21 MET 0.38 -0.60 1 22 ALA 0.17 -0.55 1 23 GLU -0.07 -0.49 1 24 HIS -0.60 0.13 1 25 GLN -0.02 -0.85 1 26 LEU -0.48 -0.96 1 29 ILE 6.31 2.34 1 30 ALA 2.10 1.85 1 32 ALA 2.49 1.53 1 33 ILE 6.02 3.98 1 34 LYS 3.87 2.97 1 35 SER 4.08 2.41 1 36 LYS 4.09 3.19 1 37 VAL 6.63 3.96 1 38 GLU 4.63 2.79 1 39 ALA 2.44 1.22 1 40 ALA -0.30 0.67 1 41 LEU -0.90 -1.92 1 42 SER 2.30 0.71 1 44 THR 2.43 0.11 1 45 HIS -2.65 1.01 1 46 PHE -4.06 -1.81 1 47 LYS -4.11 -1.19 1 48 LEU -4.76 -2.39 1 49 ILE -3.61 -1.28 1 50 ASN 0.85 -0.80 1 51 ASP -0.33 0.41 1 52 SER 6.44 4.59 1 53 HIS 3.26 2.59 1 54 LYS 2.07 -0.09 1 55 HIS -1.87 -0.63 1 56 ALA 0.29 -0.21 1 58 HIS -0.33 0.45 1 59 TYR -0.44 -1.02 1 60 ALA -0.50 -1.19 1 61 ARG -0.13 -0.28 1 62 ASP -0.21 -0.94 1 64 SER -0.15 -0.56 1 65 THR 0.94 0.11 1 66 ALA 0.73 0.00 1 67 SER 1.00 0.11 1 68 ASP 0.56 -0.17 1 69 ALA -0.49 -1.08 1 71 GLU -3.58 -2.02 1 72 THR 1.76 0.45 1 73 HIS -3.24 0.66 1 74 PHE -6.62 -2.68 1 75 ARG -3.28 -1.53 1 76 LEU -6.39 -2.83 1 77 GLU -3.69 -3.33 1 78 VAL -4.42 -2.48 1 79 THR -1.42 -2.72 1 80 SER -1.95 -2.39 1 81 ASP 2.62 1.92 1 82 ALA 0.90 0.44 1 83 PHE -1.25 -3.66 1 84 LYS 2.67 1.99 1 86 LEU -2.36 -2.14 1 87 THR -1.28 -1.63 1 88 LEU 5.79 3.86 1 89 VAL 4.95 2.77 1 90 LYS 3.17 1.98 1 91 ARG 5.09 3.21 1 92 HIS 1.79 2.51 1 93 GLN 4.22 2.59 1 94 LEU 3.45 2.67 1 95 ILE 5.72 1.99 1 96 TYR 5.52 3.03 1 98 LEU 0.60 0.78 1 99 LEU -0.93 -2.22 1 100 SER 0.21 0.76 1 101 ASP 4.93 2.35 1 102 GLU 7.01 4.22 1 103 PHE 5.30 3.44 1 104 LYS 3.39 1.77 1 105 ALA -0.60 -1.09 1 107 LEU 1.36 0.57 1 108 HIS -0.85 1.18 1 109 ALA -4.48 -1.29 1 110 LEU -6.95 -3.15 1 111 SER -1.18 -2.30 1 112 MET -4.81 -0.82 1 113 THR 0.00 -0.10 1 115 LYS -5.26 -2.06 1 116 THR 1.54 -1.24 1 118 ALA 0.17 -0.54 1 119 GLU -1.21 -1.36 1 120 GLN 1.64 1.49 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16864_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 4.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -2.62 _LACS_plot.Y_axis_chem_shift_offset 0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 THR -5.19 -0.81 0 15 ILE 7.40 -6.87 0 12 SER 0.16 -0.83 1 13 HIS -0.17 0.94 1 14 VAL 3.09 -3.37 1 16 SER 3.16 -1.19 1 17 SER -0.23 -0.64 1 18 ILE 0.76 -1.05 1 19 ALA 0.19 -0.74 1 20 SER 0.21 -0.87 1 21 MET 0.38 -0.98 1 22 ALA 0.17 -0.72 1 23 GLU -0.07 -0.42 1 24 HIS -0.60 0.73 1 25 GLN -0.02 -0.83 1 26 LEU -0.48 -0.48 1 29 ILE 6.31 -3.97 1 30 ALA 2.10 -0.25 1 32 ALA 2.49 -0.96 1 33 ILE 6.02 -2.04 1 34 LYS 3.87 -0.90 1 35 SER 4.08 -1.67 1 36 LYS 4.09 -0.90 1 37 VAL 6.63 -2.67 1 38 GLU 4.63 -1.84 1 39 ALA 2.44 -1.22 1 40 ALA -0.30 0.97 1 41 LEU -0.90 -1.02 1 42 SER 2.30 -1.59 1 44 THR 2.43 -2.32 1 45 HIS -2.65 3.66 1 46 PHE -4.06 2.25 1 47 LYS -4.11 2.92 1 48 LEU -4.76 2.37 1 49 ILE -3.61 2.33 1 50 ASN 0.85 -1.65 1 51 ASP -0.33 0.74 1 52 SER 6.44 -1.85 1 53 HIS 3.26 -0.67 1 54 LYS 2.07 -2.16 1 55 HIS -1.87 1.24 1 56 ALA 0.29 -0.50 1 58 HIS -0.33 0.78 1 59 TYR -0.44 -0.58 1 60 ALA -0.50 -0.69 1 61 ARG -0.13 -0.15 1 62 ASP -0.21 -0.73 1 64 SER -0.15 -0.41 1 65 THR 0.94 -0.83 1 66 ALA 0.73 -0.73 1 67 SER 1.00 -0.89 1 68 ASP 0.56 -0.73 1 69 ALA -0.49 -0.59 1 71 GLU -3.58 1.56 1 72 THR 1.76 -1.31 1 73 HIS -3.24 3.90 1 74 PHE -6.62 3.94 1 75 ARG -3.28 1.75 1 76 LEU -6.39 3.56 1 77 GLU -3.69 0.36 1 78 VAL -4.42 1.94 1 79 THR -1.42 -1.30 1 80 SER -1.95 -0.44 1 81 ASP 2.62 -0.70 1 82 ALA 0.90 -0.46 1 83 PHE -1.25 -2.41 1 84 LYS 2.67 -0.68 1 86 LEU -2.36 0.22 1 87 THR -1.28 -0.35 1 88 LEU 5.79 -1.93 1 89 VAL 4.95 -2.18 1 90 LYS 3.17 -1.19 1 91 ARG 5.09 -1.88 1 92 HIS 1.79 0.72 1 93 GLN 4.22 -1.63 1 94 LEU 3.45 -0.78 1 95 ILE 5.72 -3.73 1 96 TYR 5.52 -2.49 1 98 LEU 0.60 0.18 1 99 LEU -0.93 -1.29 1 100 SER 0.21 0.55 1 101 ASP 4.93 -2.58 1 102 GLU 7.01 -2.79 1 103 PHE 5.30 -1.86 1 104 LYS 3.39 -1.62 1 105 ALA -0.60 -0.49 1 107 LEU 1.36 -0.79 1 108 HIS -0.85 2.03 1 109 ALA -4.48 3.19 1 110 LEU -6.95 3.80 1 111 SER -1.18 -1.12 1 112 MET -4.81 3.99 1 113 THR 0.00 -0.10 1 115 LYS -5.26 3.20 1 116 THR 1.54 -2.78 1 118 ALA 0.17 -0.71 1 119 GLU -1.21 -0.15 1 120 GLN 1.64 -0.15 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16864_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 0.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.05 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -0.21 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 VAL 6.63 -0.77 0 99 LEU -0.93 0.69 0 95 ILE 5.72 0.51 0 12 SER 0.16 -0.20 1 13 HIS -0.17 -0.48 1 14 VAL 3.09 0.10 1 15 ILE 7.40 -0.11 1 16 SER 3.16 -0.41 1 17 SER -0.23 -0.06 1 18 ILE 0.76 -0.22 1 19 ALA 0.19 -0.11 1 20 SER 0.21 -0.19 1 21 MET 0.38 -0.16 1 22 ALA 0.17 -0.16 1 23 GLU -0.07 -0.28 1 24 HIS -0.60 -0.06 1 25 GLN -0.02 -0.13 1 26 LEU -0.48 -0.02 1 29 ILE 6.31 0.34 1 30 ALA 2.10 0.17 1 32 ALA 2.49 -0.26 1 33 ILE 6.02 0.01 1 34 LYS 3.87 -0.43 1 35 SER 4.08 -0.16 1 36 LYS 4.09 0.12 1 38 GLU 4.63 0.04 1 39 ALA 2.44 -0.36 1 40 ALA -0.30 -0.11 1 41 LEU -0.90 -0.02 1 42 SER 2.30 -0.66 1 44 THR 2.43 -0.08 1 45 HIS -2.65 -0.02 1 46 PHE -4.06 0.05 1 47 LYS -4.11 -0.29 1 48 LEU -4.76 0.07 1 49 ILE -3.61 0.09 1 50 ASN 0.85 -0.05 1 51 ASP -0.33 0.05 1 52 SER 6.44 -0.08 1 53 HIS 3.26 -0.04 1 54 LYS 2.07 0.06 1 55 HIS -1.87 -0.48 1 56 ALA 0.29 -0.15 1 58 HIS -0.33 -0.06 1 59 TYR -0.44 -0.13 1 60 ALA -0.50 -0.15 1 61 ARG -0.13 -0.17 1 62 ASP -0.21 -0.17 1 64 SER -0.15 -0.10 1 65 THR 0.94 0.32 1 66 ALA 0.73 -0.16 1 67 SER 1.00 -0.25 1 68 ASP 0.56 -0.17 1 69 ALA -0.49 -0.06 1 71 GLU -3.58 -0.13 1 72 THR 1.76 0.12 1 73 HIS -3.24 -0.04 1 74 PHE -6.62 0.07 1 75 ARG -3.28 0.10 1 76 LEU -6.39 0.12 1 77 GLU -3.69 0.09 1 78 VAL -4.42 0.09 1 79 THR -1.42 -0.09 1 80 SER -1.95 -0.01 1 81 ASP 2.62 -0.12 1 82 ALA 0.90 -0.31 1 83 PHE -1.25 -0.25 1 84 LYS 2.67 -0.51 1 86 LEU -2.36 0.12 1 87 THR -1.28 -0.20 1 88 LEU 5.79 0.33 1 89 VAL 4.95 0.09 1 90 LYS 3.17 -0.31 1 91 ARG 5.09 0.07 1 92 HIS 1.79 -0.57 1 93 GLN 4.22 -0.36 1 94 LEU 3.45 -0.28 1 96 TYR 5.52 0.17 1 98 LEU 0.60 -0.13 1 100 SER 0.21 -0.31 1 101 ASP 4.93 0.03 1 102 GLU 7.01 -0.54 1 103 PHE 5.30 0.10 1 104 LYS 3.39 -0.22 1 105 ALA -0.60 0.00 1 107 LEU 1.36 -0.28 1 108 HIS -0.85 -0.01 1 109 ALA -4.48 0.22 1 110 LEU -6.95 0.10 1 111 SER -1.18 0.27 1 112 MET -4.81 0.19 1 113 THR 0.00 0.12 1 114 THR -5.19 0.32 1 115 LYS -5.26 0.56 1 116 THR 1.54 -0.59 1 118 ALA 0.17 -0.15 1 119 GLU -1.21 -0.29 1 120 GLN 1.64 -0.48 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16864_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.95 _LACS_plot.Line_1_terminator_val_y_1 -4.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.40 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 1.42 _LACS_plot.Y_axis_chem_shift_offset 1.56 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 74 PHE -6.62 -1.18 0 15 ILE 7.40 -2.32 0 12 SER 0.16 -2.24 1 13 HIS -0.17 1.05 1 14 VAL 3.09 1.56 1 16 SER 3.16 -0.30 1 17 SER -0.23 -1.85 1 18 ILE 0.76 -1.95 1 19 ALA 0.19 -1.77 1 20 SER 0.21 -1.56 1 21 MET 0.38 -1.92 1 22 ALA 0.17 -1.77 1 23 GLU -0.07 -2.00 1 24 HIS -0.60 -0.88 1 25 GLN -0.02 -2.31 1 26 LEU -0.48 -1.88 1 29 ILE 6.31 0.32 1 30 ALA 2.10 0.26 1 32 ALA 2.49 -0.52 1 33 ILE 6.02 -0.85 1 34 LYS 3.87 -0.98 1 35 SER 4.08 0.96 1 36 LYS 4.09 1.78 1 37 VAL 6.63 2.21 1 38 GLU 4.63 0.86 1 39 ALA 2.44 -0.28 1 40 ALA -0.30 0.03 1 41 LEU -0.90 -2.59 1 42 SER 2.30 1.84 1 44 THR 2.43 -1.34 1 45 HIS -2.65 -3.23 1 46 PHE -4.06 -4.82 1 47 LYS -4.11 -6.20 1 48 LEU -4.76 -4.16 1 49 ILE -3.61 -3.61 1 50 ASN 0.85 -2.28 1 51 ASP -0.33 -0.06 1 52 SER 6.44 -0.98 1 53 HIS 3.26 0.52 1 54 LYS 2.07 -2.15 1 55 HIS -1.87 -1.50 1 56 ALA 0.29 -1.47 1 58 HIS -0.33 -1.12 1 59 TYR -0.44 -2.61 1 60 ALA -0.50 -2.09 1 61 ARG -0.13 -1.70 1 62 ASP -0.21 0.44 1 64 SER -0.15 -1.70 1 65 THR 0.94 -1.65 1 66 ALA 0.73 -1.46 1 67 SER 1.00 -1.29 1 68 ASP 0.56 -1.92 1 69 ALA -0.49 -1.93 1 71 GLU -3.58 -5.28 1 72 THR 1.76 -0.74 1 73 HIS -3.24 -2.21 1 75 ARG -3.28 -3.65 1 76 LEU -6.39 -4.94 1 77 GLU -3.69 -3.92 1 78 VAL -4.42 -4.10 1 79 THR -1.42 -2.27 1 80 SER -1.95 -1.38 1 81 ASP 2.62 -0.36 1 82 ALA 0.90 -1.54 1 83 PHE -1.25 -2.66 1 84 LYS 2.67 -0.96 1 86 LEU -2.36 -0.72 1 87 THR -1.28 -1.64 1 88 LEU 5.79 -1.36 1 89 VAL 4.95 0.24 1 90 LYS 3.17 1.54 1 91 ARG 5.09 -0.75 1 92 HIS 1.79 1.77 1 93 GLN 4.22 0.89 1 94 LEU 3.45 0.15 1 95 ILE 5.72 -0.46 1 96 TYR 5.52 2.08 1 98 LEU 0.60 -0.56 1 99 LEU -0.93 -4.01 1 100 SER 0.21 1.40 1 101 ASP 4.93 0.12 1 102 GLU 7.01 0.39 1 103 PHE 5.30 1.64 1 104 LYS 3.39 -0.98 1 105 ALA -0.60 -2.87 1 107 LEU 1.36 -4.63 1 108 HIS -0.85 -0.34 1 109 ALA -4.48 -5.17 1 110 LEU -6.95 -4.21 1 111 SER -1.18 -1.22 1 112 MET -4.81 -2.93 1 113 THR 0.00 -2.25 1 114 THR -5.19 -1.23 1 115 LYS -5.26 -2.76 1 116 THR 1.54 0.41 1 118 ALA 0.17 -1.30 1 119 GLU -1.21 -2.54 1 120 GLN 1.64 3.07 1 stop_ save_