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 bmr16694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -3.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 5.89 _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 114 GLU -7.24 2.40 0 10 LEU 3.36 2.52 1 11 LYS 5.10 4.45 1 12 GLU 3.46 2.78 1 13 ILE 4.70 3.50 1 14 LEU 5.39 3.33 1 15 GLU 3.92 3.54 1 16 GLN 4.06 3.60 1 17 LEU 4.52 3.41 1 18 LEU 3.43 2.59 1 19 GLU 2.72 2.35 1 20 ALA 3.75 2.15 1 21 ILE 4.12 4.02 1 22 VAL 4.13 3.05 1 23 VAL -0.35 -1.30 1 24 ALA -0.12 0.63 1 25 THR -5.14 -2.72 1 26 ASN 0.31 -0.22 1 28 SER 0.70 0.44 1 30 ARG -1.27 -0.83 1 31 LEU 0.53 -0.19 1 32 ILE 4.34 3.44 1 33 SER 0.01 0.50 1 34 GLU 3.88 4.24 1 35 LEU 3.22 0.55 1 36 PHE -1.02 -0.64 1 37 GLN 4.81 3.88 1 38 LYS -5.43 -2.65 1 39 LEU 0.84 0.08 1 41 SER -0.35 -0.59 1 42 LYS 3.29 2.62 1 43 VAL 3.08 2.16 1 44 GLN 0.38 1.32 1 45 TYR 0.04 -0.35 1 47 ASP 2.99 1.55 1 48 TYR 4.44 4.05 1 49 TYR 3.05 2.25 1 50 ALA 1.21 0.87 1 51 ILE -0.58 1.06 1 52 ILE 1.45 -3.67 1 53 LYS 1.45 0.76 1 54 GLU -2.72 -1.13 1 56 ILE -1.94 0.57 1 57 ASP -3.75 -1.99 1 58 LEU 3.25 2.38 1 59 LYS 5.07 3.46 1 60 THR 6.87 5.43 1 61 ILE 4.58 4.47 1 62 ALA 4.06 3.16 1 63 GLN 4.07 3.13 1 64 ARG 5.18 3.24 1 65 ILE 4.84 4.79 1 66 GLN 3.78 2.59 1 67 ASN 0.05 -0.92 1 69 SER 3.62 2.80 1 70 TYR -2.03 -2.78 1 71 LYS 1.20 -0.41 1 72 SER -3.40 -1.57 1 73 ILE 5.12 4.00 1 74 HIS 2.47 3.81 1 75 ALA 2.31 2.38 1 76 MET 4.74 3.19 1 77 ALA 3.71 2.40 1 78 LYS 4.18 3.09 1 79 ASP 3.88 2.51 1 80 ILE 4.85 0.05 1 81 ASP 5.09 3.25 1 82 LEU 4.45 2.88 1 83 LEU 3.77 3.92 1 84 ALA 2.62 2.21 1 85 LYS 4.39 3.34 1 86 ASN 3.71 2.17 1 87 ALA 2.07 2.29 1 88 LYS 3.17 1.85 1 89 THR 4.09 3.27 1 90 TYR 1.00 2.70 1 91 ASN 1.77 6.22 1 92 GLU 0.06 0.39 1 95 SER -1.42 0.00 1 96 GLN 3.25 3.15 1 97 VAL 4.79 3.41 1 98 PHE 2.30 3.78 1 99 LYS 0.03 -1.06 1 100 ASP 4.43 3.56 1 101 ALA 3.07 2.72 1 102 ASN 3.87 3.09 1 104 ILE 6.94 5.04 1 105 LYS 4.88 4.22 1 106 LYS 4.41 3.60 1 107 ILE 4.08 2.67 1 108 PHE 4.95 4.54 1 109 TYR 7.59 6.15 1 110 MET 3.87 3.60 1 111 LYS 3.66 0.25 1 112 LYS 3.81 3.89 1 113 ALA 3.18 1.90 1 115 ILE 2.42 2.59 1 116 GLU 1.93 1.29 1 117 HIS 1.97 1.67 1 118 HIS 0.84 1.38 1 119 GLU 0.25 0.14 1 120 MET 0.13 -0.05 1 121 ALA 0.53 1.37 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 3.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 -1.69 _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 114 GLU -7.24 9.64 0 10 LEU 3.36 -0.84 1 11 LYS 5.10 -0.65 1 12 GLU 3.46 -0.68 1 13 ILE 4.70 -1.20 1 14 LEU 5.39 -2.06 1 15 GLU 3.92 -0.38 1 16 GLN 4.06 -0.46 1 17 LEU 4.52 -1.11 1 18 LEU 3.43 -0.84 1 19 GLU 2.72 -0.37 1 20 ALA 3.75 -1.60 1 21 ILE 4.12 -0.10 1 22 VAL 4.13 -1.08 1 23 VAL -0.35 -0.95 1 24 ALA -0.12 0.75 1 25 THR -5.14 2.42 1 26 ASN 0.31 -0.53 1 28 SER 0.70 -0.26 1 30 ARG -1.27 0.44 1 31 LEU 0.53 -0.72 1 32 ILE 4.34 -0.90 1 33 SER 0.01 0.49 1 34 GLU 3.88 0.36 1 35 LEU 3.22 -2.67 1 36 PHE -1.02 0.38 1 37 GLN 4.81 -0.93 1 38 LYS -5.43 2.78 1 39 LEU 0.84 -0.76 1 41 SER -0.35 -0.24 1 42 LYS 3.29 -0.67 1 43 VAL 3.08 -0.92 1 44 GLN 0.38 0.94 1 45 TYR 0.04 -0.39 1 47 ASP 2.99 -1.44 1 48 TYR 4.44 -0.39 1 49 TYR 3.05 -0.80 1 50 ALA 1.21 -0.34 1 51 ILE -0.58 1.64 1 52 ILE 1.45 -5.12 1 53 LYS 1.45 -0.69 1 54 GLU -2.72 1.59 1 56 ILE -1.94 2.51 1 57 ASP -3.75 1.76 1 58 LEU 3.25 -0.87 1 59 LYS 5.07 -1.61 1 60 THR 6.87 -1.44 1 61 ILE 4.58 -0.11 1 62 ALA 4.06 -0.90 1 63 GLN 4.07 -0.94 1 64 ARG 5.18 -1.94 1 65 ILE 4.84 -0.05 1 66 GLN 3.78 -1.19 1 67 ASN 0.05 -0.97 1 69 SER 3.62 -0.82 1 70 TYR -2.03 -0.75 1 71 LYS 1.20 -1.61 1 72 SER -3.40 1.83 1 73 ILE 5.12 -1.12 1 74 HIS 2.47 1.34 1 75 ALA 2.31 0.07 1 76 MET 4.74 -1.55 1 77 ALA 3.71 -1.31 1 78 LYS 4.18 -1.09 1 79 ASP 3.88 -1.37 1 80 ILE 4.85 -4.80 1 81 ASP 5.09 -1.84 1 82 LEU 4.45 -1.57 1 83 LEU 3.77 0.15 1 84 ALA 2.62 -0.41 1 85 LYS 4.39 -1.05 1 86 ASN 3.71 -1.54 1 87 ALA 2.07 0.22 1 88 LYS 3.17 -1.32 1 89 THR 4.09 -0.82 1 90 TYR 1.00 1.70 1 91 ASN 1.77 4.45 1 92 GLU 0.06 0.33 1 95 SER -1.42 1.42 1 96 GLN 3.25 -0.10 1 97 VAL 4.79 -1.38 1 98 PHE 2.30 1.48 1 99 LYS 0.03 -1.09 1 100 ASP 4.43 -0.87 1 101 ALA 3.07 -0.35 1 102 ASN 3.87 -0.78 1 104 ILE 6.94 -1.90 1 105 LYS 4.88 -0.66 1 106 LYS 4.41 -0.81 1 107 ILE 4.08 -1.41 1 108 PHE 4.95 -0.41 1 109 TYR 7.59 -1.44 1 110 MET 3.87 -0.27 1 111 LYS 3.66 -3.41 1 112 LYS 3.81 0.08 1 113 ALA 3.18 -1.28 1 115 ILE 2.42 0.17 1 116 GLU 1.93 -0.64 1 117 HIS 1.97 -0.30 1 118 HIS 0.84 0.54 1 119 GLU 0.25 -0.11 1 120 MET 0.13 -0.18 1 121 ALA 0.53 0.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16694_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.43 _LACS_plot.Line_1_terminator_val_y_1 0.42 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 7.58 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 MET 4.74 -1.44 0 25 THR -5.14 0.99 0 10 LEU 3.36 -0.44 1 11 LYS 5.10 -0.53 1 12 GLU 3.46 -0.28 1 13 ILE 4.70 -0.50 1 14 LEU 5.39 -0.33 1 15 GLU 3.92 -0.45 1 16 GLN 4.06 -0.28 1 17 LEU 4.52 -0.53 1 18 LEU 3.43 -0.35 1 19 GLU 2.72 -0.36 1 20 ALA 3.75 -0.35 1 21 ILE 4.12 -0.57 1 22 VAL 4.13 -0.25 1 23 VAL -0.35 0.33 1 24 ALA -0.12 -0.03 1 26 ASN 0.31 0.03 1 28 SER 0.70 0.00 1 30 ARG -1.27 -0.02 1 31 LEU 0.53 0.22 1 32 ILE 4.34 -0.29 1 33 SER 0.01 -0.79 1 34 GLU 3.88 -0.38 1 35 LEU 3.22 -0.10 1 36 PHE -1.02 -0.03 1 37 GLN 4.81 -0.26 1 38 LYS -5.43 0.64 1 39 LEU 0.84 -0.53 1 41 SER -0.35 -0.05 1 42 LYS 3.29 -0.35 1 43 VAL 3.08 -0.41 1 44 GLN 0.38 -0.33 1 45 TYR 0.04 0.28 1 47 ASP 2.99 -0.21 1 48 TYR 4.44 -0.98 1 49 TYR 3.05 -0.53 1 50 ALA 1.21 -0.01 1 51 ILE -0.58 -0.16 1 52 ILE 1.45 -0.34 1 53 LYS 1.45 -0.20 1 54 GLU -2.72 0.08 1 56 ILE -1.94 0.27 1 57 ASP -3.75 0.09 1 58 LEU 3.25 -0.19 1 59 LYS 5.07 -0.23 1 60 THR 6.87 -0.44 1 61 ILE 4.58 -0.10 1 62 ALA 4.06 -0.31 1 63 GLN 4.07 -0.37 1 65 ILE 4.84 -0.36 1 66 GLN 3.78 -0.43 1 67 ASN 0.05 -0.06 1 69 SER 3.62 -0.39 1 70 TYR -2.03 0.28 1 71 LYS 1.20 0.20 1 72 SER -3.40 0.08 1 73 ILE 5.12 -0.55 1 74 HIS 2.47 -0.55 1 75 ALA 2.31 -0.36 1 77 ALA 3.71 -1.07 1 78 LYS 4.18 -0.45 1 79 ASP 3.88 0.03 1 80 ILE 4.85 -0.75 1 81 ASP 5.09 -0.60 1 82 LEU 4.45 -0.26 1 83 LEU 3.77 -0.69 1 84 ALA 2.62 -0.36 1 85 LYS 4.39 -0.49 1 86 ASN 3.71 -0.46 1 87 ALA 2.07 -0.02 1 89 THR 4.09 -0.15 1 90 TYR 1.00 -0.35 1 91 ASN 1.77 -0.92 1 92 GLU 0.06 -0.23 1 95 SER -1.42 -0.07 1 96 GLN 3.25 0.10 1 97 VAL 4.79 -0.03 1 98 PHE 2.30 -0.81 1 99 LYS 0.03 -0.01 1 100 ASP 4.43 -0.24 1 101 ALA 3.07 -0.80 1 102 ASN 3.87 -0.32 1 104 ILE 6.94 -0.82 1 107 ILE 4.08 -0.54 1 108 PHE 4.95 -0.87 1 109 TYR 7.59 -0.66 1 111 LYS 3.66 -0.19 1 112 LYS 3.81 -0.92 1 113 ALA 3.18 -0.16 1 115 ILE 2.42 -0.37 1 stop_ save_