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 bmr16905_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 -2.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.44 _LACS_plot.Line_2_terminator_val_x_2 7.50 _LACS_plot.Line_2_terminator_val_y_2 5.76 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 ASP -1.22 2.99 0 10 ARG -1.34 -1.31 1 11 VAL -2.42 -0.64 1 12 LEU -0.20 -1.04 1 13 VAL -1.17 -0.64 1 14 VAL -0.54 -1.26 1 15 GLU -3.57 -1.29 1 16 ASP 0.03 0.49 1 17 GLU -0.14 -0.35 1 19 MET 4.38 3.66 1 20 ILE 3.33 0.46 1 21 ALA 4.74 3.44 1 22 MET 3.75 3.66 1 23 LEU 3.03 2.81 1 24 ILE 5.83 5.46 1 25 GLU 5.18 4.34 1 26 ASP 4.40 3.61 1 27 THR 6.75 5.39 1 28 LEU 4.18 3.34 1 30 GLU 3.31 2.47 1 31 LEU -0.82 0.21 1 33 HIS -3.50 0.31 1 34 GLU -6.07 -1.91 1 35 VAL -0.54 -0.01 1 36 ALA -0.27 0.94 1 37 ALA -3.40 -0.94 1 38 THR -3.25 -2.11 1 39 ALA -4.65 -1.57 1 40 SER -2.63 -0.49 1 41 ARG -5.09 -1.93 1 42 MET 5.01 3.04 1 43 GLN 5.58 3.99 1 44 GLU 2.05 2.46 1 45 ALA 1.61 2.19 1 46 LEU 3.55 3.34 1 47 ASP 3.16 3.62 1 48 ILE 2.71 2.34 1 49 ALA 3.48 2.81 1 50 ARG 2.41 2.44 1 51 LYS -1.22 0.99 1 53 GLN -0.91 -1.25 1 54 PHE -1.85 -2.39 1 56 ILE -6.67 -2.04 1 57 ALA -7.78 -2.19 1 58 ILE -1.67 -0.16 1 59 ILE -5.42 -3.29 1 60 ASP 0.03 -0.14 1 61 VAL 2.58 1.87 1 62 ASN -4.83 -0.92 1 63 LEU -3.95 -1.67 1 64 ASP 1.28 0.49 1 66 GLU -3.75 -1.39 1 68 SER -0.13 -0.49 1 69 TYR 7.50 4.51 1 71 VAL 3.83 3.11 1 72 ALA 2.86 2.19 1 73 ASP 4.41 2.99 1 74 ILE 3.96 3.59 1 75 LEU 5.43 3.34 1 76 ALA 2.86 2.19 1 77 GLU 2.68 2.46 1 78 ARG 0.53 0.56 1 79 ASN 2.68 0.96 1 80 VAL -0.32 0.51 1 82 PHE -6.22 -3.01 1 83 ILE -6.34 -2.29 1 84 PHE -5.60 -2.39 1 85 ALA -4.03 -2.82 1 86 THR -3.87 -2.73 1 88 TYR 0.91 0.54 1 90 SER -0.13 0.14 1 91 LYS 0.65 0.36 1 93 LEU -1.44 -0.41 1 94 ASP -1.78 0.56 1 95 THR 3.63 2.89 1 96 ARG 3.66 2.44 1 97 TYR -0.97 -1.34 1 98 SER 3.55 3.19 1 99 ASN 1.27 0.18 1 100 ILE -0.62 -2.14 1 102 LEU -4.57 -1.66 1 103 LEU -4.57 -1.66 1 104 THR -0.13 -0.24 1 105 LYS -2.83 -2.49 1 109 ASP -0.99 -0.53 1 110 SER 4.01 2.40 1 111 GLU 2.06 2.47 1 112 LEU 4.18 2.71 1 113 GLU 3.93 3.72 1 114 ALA 3.48 2.82 1 115 VAL 4.27 3.12 1 116 LEU 4.18 2.71 1 117 VAL 5.08 3.74 1 118 GLN 3.68 3.10 1 119 ILE 1.46 1.09 1 120 SER 1.75 1.39 1 121 LYS 1.28 0.99 1 122 GLU -0.45 -0.04 1 123 VAL 1.33 1.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16905_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 4.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.56 _LACS_plot.Line_2_terminator_val_x_2 7.50 _LACS_plot.Line_2_terminator_val_y_2 -1.74 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 ASP -1.22 4.21 0 10 ARG -1.34 0.03 1 11 VAL -2.42 1.78 1 12 LEU -0.20 -0.84 1 13 VAL -1.17 0.53 1 14 VAL -0.54 -0.72 1 15 GLU -3.57 2.28 1 16 ASP 0.03 0.46 1 17 GLU -0.14 -0.21 1 19 MET 4.38 -0.72 1 20 ILE 3.33 -2.87 1 21 ALA 4.74 -1.30 1 22 MET 3.75 -0.09 1 23 LEU 3.03 -0.22 1 24 ILE 5.83 -0.37 1 25 GLU 5.18 -0.84 1 26 ASP 4.40 -0.79 1 27 THR 6.75 -1.36 1 28 LEU 4.18 -0.84 1 30 GLU 3.31 -0.84 1 31 LEU -0.82 1.03 1 33 HIS -3.50 3.81 1 34 GLU -6.07 4.16 1 35 VAL -0.54 0.53 1 36 ALA -0.27 1.21 1 37 ALA -3.40 2.46 1 38 THR -3.25 1.14 1 39 ALA -4.65 3.08 1 40 SER -2.63 2.14 1 41 ARG -5.09 3.16 1 42 MET 5.01 -1.97 1 43 GLN 5.58 -1.59 1 44 GLU 2.05 0.41 1 45 ALA 1.61 0.58 1 46 LEU 3.55 -0.21 1 47 ASP 3.16 0.46 1 48 ILE 2.71 -0.37 1 49 ALA 3.48 -0.67 1 50 ARG 2.41 0.03 1 51 LYS -1.22 2.21 1 53 GLN -0.91 -0.34 1 54 PHE -1.85 -0.54 1 56 ILE -6.67 4.63 1 57 ALA -7.78 5.59 1 58 ILE -1.67 1.51 1 59 ILE -5.42 2.13 1 60 ASP 0.03 -0.17 1 61 VAL 2.58 -0.71 1 62 ASN -4.83 3.91 1 63 LEU -3.95 2.28 1 64 ASP 1.28 -0.79 1 66 GLU -3.75 2.36 1 68 SER -0.13 -0.36 1 69 TYR 7.50 -2.99 1 71 VAL 3.83 -0.72 1 72 ALA 2.86 -0.67 1 73 ASP 4.41 -1.42 1 74 ILE 3.96 -0.37 1 75 LEU 5.43 -2.09 1 76 ALA 2.86 -0.67 1 77 GLU 2.68 -0.22 1 78 ARG 0.53 0.03 1 79 ASN 2.68 -1.72 1 80 VAL -0.32 0.83 1 82 PHE -6.22 3.21 1 83 ILE -6.34 4.05 1 84 PHE -5.60 3.21 1 85 ALA -4.03 1.21 1 86 THR -3.87 1.14 1 88 TYR 0.91 -0.37 1 90 SER -0.13 0.27 1 91 LYS 0.65 -0.29 1 93 LEU -1.44 1.03 1 94 ASP -1.78 2.34 1 95 THR 3.63 -0.74 1 96 ARG 3.66 -1.22 1 97 TYR -0.97 -0.37 1 98 SER 3.55 -0.36 1 99 ASN 1.27 -1.09 1 100 ILE -0.62 -1.52 1 102 LEU -4.57 2.91 1 103 LEU -4.57 2.91 1 104 THR -0.13 -0.11 1 105 LYS -2.83 0.34 1 109 ASP -0.99 0.46 1 110 SER 4.01 -1.61 1 111 GLU 2.06 0.41 1 112 LEU 4.18 -1.47 1 113 GLU 3.93 -0.21 1 114 ALA 3.48 -0.66 1 115 VAL 4.27 -1.15 1 116 LEU 4.18 -1.47 1 117 VAL 5.08 -1.34 1 118 GLN 3.68 -0.58 1 119 ILE 1.46 -0.37 1 120 SER 1.75 -0.36 1 121 LYS 1.28 -0.29 1 122 GLU -0.45 0.41 1 123 VAL 1.33 0.54 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16905_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 7.50 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _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 72 ALA 2.86 -1.38 0 10 ARG -1.34 0.61 1 11 VAL -2.42 0.62 1 12 LEU -0.20 0.30 1 13 VAL -1.17 0.55 1 14 VAL -0.54 0.87 1 15 GLU -3.57 0.21 1 16 ASP 0.03 -0.08 1 17 GLU -0.14 0.01 1 19 MET 4.38 -0.24 1 20 ILE 3.33 -0.35 1 21 ALA 4.74 -0.61 1 22 MET 3.75 -0.24 1 23 LEU 3.03 0.01 1 24 ILE 5.83 -0.71 1 25 GLU 5.18 -0.64 1 26 ASP 4.40 -0.29 1 27 THR 6.75 -0.11 1 28 LEU 4.18 -0.42 1 30 GLU 3.31 -0.22 1 31 LEU -0.82 -0.10 1 33 HIS -3.50 0.47 1 34 GLU -6.07 0.32 1 35 VAL -0.54 0.55 1 36 ALA -0.27 -0.08 1 37 ALA -3.40 0.10 1 38 THR -3.25 1.13 1 39 ALA -4.65 0.32 1 40 SER -2.63 0.06 1 41 ARG -5.09 0.40 1 42 MET 5.01 -0.48 1 43 GLN 5.58 0.30 1 44 GLU 2.05 -0.25 1 45 ALA 1.61 -0.64 1 46 LEU 3.55 -0.55 1 47 ASP 3.16 -0.22 1 48 ILE 2.71 -0.28 1 49 ALA 3.48 -0.32 1 50 ARG 2.41 -0.34 1 51 LYS -1.22 0.00 1 53 GLN -0.91 0.40 1 54 PHE -1.85 -0.20 1 55 ASP -1.22 0.10 1 56 ILE -6.67 1.00 1 57 ALA -7.78 1.20 1 58 ILE -1.67 0.39 1 59 ILE -5.42 0.82 1 60 ASP 0.03 0.56 1 61 VAL 2.58 -0.41 1 62 ASN -4.83 0.46 1 63 LEU -3.95 0.12 1 64 ASP 1.28 -0.40 1 66 GLU -3.75 0.32 1 68 SER -0.13 0.17 1 69 TYR 7.50 -0.42 1 71 VAL 3.83 -0.76 1 73 ASP 4.41 -0.22 1 74 ILE 3.96 -0.38 1 75 LEU 5.43 -0.55 1 76 ALA 2.86 0.21 1 77 GLU 2.68 -0.24 1 78 ARG 0.53 -0.02 1 79 ASN 2.68 -0.42 1 80 VAL -0.32 -0.02 1 82 PHE -6.22 0.97 1 83 ILE -6.34 0.04 1 84 PHE -5.60 1.50 1 85 ALA -4.03 1.27 1 86 THR -3.87 -0.03 1 88 TYR 0.91 0.12 1 90 SER -0.13 0.17 1 91 LYS 0.65 0.32 1 93 LEU -1.44 -0.02 1 94 ASP -1.78 -0.22 1 95 THR 3.63 0.29 1 96 ARG 3.66 0.30 1 97 TYR -0.97 0.40 1 98 SER 3.55 -0.26 1 99 ASN 1.27 0.00 1 100 ILE -0.62 -0.24 1 102 LEU -4.57 0.57 1 103 LEU -4.57 0.19 1 104 THR -0.13 0.39 1 105 LYS -2.83 0.00 1 109 ASP -0.99 0.04 1 110 SER 4.01 -0.23 1 111 GLU 2.06 -0.25 1 112 LEU 4.18 -0.34 1 113 GLU 3.93 -0.56 1 114 ALA 3.48 -0.22 1 115 VAL 4.27 -0.12 1 116 LEU 4.18 -0.02 1 117 VAL 5.08 -0.44 1 118 GLN 3.68 -0.45 1 119 ILE 1.46 0.04 1 120 SER 1.75 -0.23 1 121 LYS 1.28 0.03 1 122 GLU -0.45 0.00 1 123 VAL 1.33 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16905_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 -2.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 7.50 _LACS_plot.Line_2_terminator_val_y_2 2.87 _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 82 PHE -6.22 8.36 0 10 ARG -1.34 1.25 1 11 VAL -2.42 0.01 1 12 LEU -0.20 -3.64 1 13 VAL -1.17 -2.00 1 14 VAL -0.54 -2.49 1 15 GLU -3.57 -3.17 1 16 ASP 0.03 0.33 1 19 MET 4.38 2.53 1 20 ILE 3.33 1.26 1 21 ALA 4.74 1.48 1 22 MET 3.75 1.19 1 23 LEU 3.03 3.34 1 24 ILE 5.83 0.87 1 25 GLU 5.18 1.75 1 26 ASP 4.40 3.20 1 27 THR 6.75 1.61 1 28 LEU 4.18 1.20 1 30 GLU 3.31 1.71 1 31 LEU -0.82 -1.28 1 33 HIS -3.50 -0.69 1 34 GLU -6.07 -1.33 1 35 VAL -0.54 -0.48 1 36 ALA -0.27 -0.31 1 37 ALA -3.40 -3.06 1 38 THR -3.25 -1.37 1 39 ALA -4.65 -2.29 1 40 SER -2.63 -1.92 1 41 ARG -5.09 0.30 1 42 MET 5.01 1.11 1 43 GLN 5.58 2.36 1 44 GLU 2.05 1.61 1 45 ALA 1.61 0.69 1 46 LEU 3.55 1.20 1 47 ASP 3.16 2.48 1 48 ILE 2.71 2.26 1 49 ALA 3.48 0.55 1 50 ARG 2.41 1.32 1 51 LYS -1.22 1.89 1 53 GLN -0.91 -2.43 1 54 PHE -1.85 -2.67 1 55 ASP -1.22 -0.81 1 56 ILE -6.67 -2.97 1 57 ALA -7.78 -3.09 1 58 ILE -1.67 -2.38 1 59 ILE -5.42 -1.58 1 60 ASP 0.03 0.98 1 61 VAL 2.58 -0.62 1 62 ASN -4.83 -2.20 1 63 LEU -3.95 -1.54 1 64 ASP 1.28 -0.26 1 66 GLU -3.75 3.48 1 68 SER -0.13 3.86 1 69 TYR 7.50 9.98 1 71 VAL 3.83 0.88 1 72 ALA 2.86 0.55 1 73 ASP 4.41 3.41 1 74 ILE 3.96 1.60 1 75 LEU 5.43 1.64 1 76 ALA 2.86 4.56 1 77 GLU 2.68 1.69 1 78 ARG 0.53 -1.00 1 79 ASN 2.68 -1.04 1 80 VAL -0.32 -0.46 1 83 ILE -6.34 -1.10 1 84 PHE -5.60 -0.29 1 85 ALA -4.03 -1.63 1 86 THR -3.87 -1.67 1 88 TYR 0.91 0.84 1 90 SER -0.13 0.18 1 91 LYS 0.65 0.36 1 93 LEU -1.44 -0.43 1 94 ASP -1.78 1.19 1 95 THR 3.63 1.83 1 96 ARG 3.66 0.58 1 97 TYR -0.97 0.70 1 98 SER 3.55 -0.20 1 99 ASN 1.27 -0.49 1 102 LEU -4.57 -1.36 1 103 LEU -4.57 -1.95 1 104 THR -0.13 -1.10 1 105 LYS -2.83 -1.67 1 110 SER 4.01 2.89 1 111 GLU 2.06 2.18 1 112 LEU 4.18 0.14 1 113 GLU 3.93 1.06 1 114 ALA 3.48 3.30 1 115 VAL 4.27 1.36 1 116 LEU 4.18 2.53 1 117 VAL 5.08 2.16 1 118 GLN 3.68 2.66 1 119 ILE 1.46 0.61 1 120 SER 1.75 0.01 1 121 LYS 1.28 0.19 1 122 GLU -0.45 -0.91 1 123 VAL 1.33 4.67 1 stop_ save_