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 bmr18486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 -4.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.77 _LACS_plot.Line_2_terminator_val_x_2 5.64 _LACS_plot.Line_2_terminator_val_y_2 3.15 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ARG -7.50 -0.69 0 11 THR -1.23 -0.96 1 12 GLU -1.44 -1.26 1 13 ILE 2.16 1.97 1 15 LEU 3.95 2.81 1 16 SER 2.55 0.48 1 17 GLU -0.97 -0.86 1 18 ILE 0.96 -0.15 1 19 ARG 3.25 3.30 1 22 LEU 1.91 -0.40 1 23 ALA 0.03 -0.22 1 25 VAL 1.23 -0.21 1 26 LEU -0.47 -1.09 1 27 ASP 0.15 0.16 1 29 GLN 3.10 1.52 1 30 LYS 2.57 1.19 1 31 ILE 2.93 1.32 1 33 ALA -0.45 -0.66 1 34 MET -4.19 -4.86 1 35 VAL -2.50 -6.11 1 36 ALA 1.81 0.90 1 37 THR 1.95 1.05 1 41 ILE -1.74 -3.01 1 43 THR 0.25 -0.36 1 44 ALA 0.07 -0.40 1 45 SER 0.21 -0.39 1 46 LYS -0.53 -0.18 1 47 THR 0.37 -0.33 1 49 SER 0.12 -0.39 1 50 LEU 1.87 0.38 1 51 GLU 1.05 0.10 1 52 GLN 1.11 0.22 1 53 ALA 0.85 0.12 1 54 GLU -1.55 0.62 1 55 ALA 0.85 -0.05 1 56 ALA 5.64 -0.42 1 57 ALA 2.14 1.12 1 58 SER 0.03 -0.39 1 59 ALA 0.45 -0.14 1 61 GLU -0.86 -1.12 1 62 LEU -0.99 -2.74 1 65 VAL -1.46 -1.25 1 66 ASP 0.35 0.16 1 67 VAL -6.51 -4.11 1 68 LEU -2.47 -2.48 1 70 VAL -3.72 -2.90 1 71 ARG 0.39 -1.30 1 72 VAL -1.99 -1.43 1 73 LYS 4.56 0.93 1 76 THR 1.84 0.36 1 77 LEU -3.43 -2.57 1 78 TYR -3.05 -1.98 1 79 TYR -4.09 -1.98 1 80 ALA -0.76 -2.65 1 81 PHE -0.84 -0.48 1 85 HIS -0.07 2.13 1 87 LEU 3.09 1.86 1 88 GLN 1.02 -1.17 1 89 ALA 3.54 2.03 1 90 TYR 5.01 3.83 1 91 ASP 4.51 3.02 1 92 ARG 5.17 2.78 1 93 ARG 4.38 0.78 1 94 ALA 2.50 2.20 1 95 ARG 4.64 2.60 1 97 THR -0.93 -0.68 1 98 GLN 4.22 0.56 1 99 ASN -2.27 -2.73 1 100 ALA 2.59 1.08 1 101 ALA -0.62 -2.57 1 102 PHE 0.76 1.62 1 104 VAL -1.20 -2.64 1 105 ARG 2.56 0.26 1 111 ALA 0.59 -0.14 1 112 THR 0.80 0.01 1 115 GLN -0.65 -0.22 1 116 ILE 1.99 0.11 1 117 ARG 1.70 -0.08 1 118 MET -2.03 2.69 1 120 LEU 1.09 -0.05 1 122 SER -0.22 -0.47 1 123 SER 0.74 -0.04 1 124 LEU 0.48 -0.40 1 125 ASP 0.42 -0.46 1 126 ILE -0.01 -0.67 1 127 GLU 0.44 0.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 2.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 5.64 _LACS_plot.Line_2_terminator_val_y_2 -2.49 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 ARG -7.50 6.81 0 11 THR -1.23 0.27 1 12 GLU -1.44 0.18 1 13 ILE 2.16 -0.19 1 15 LEU 3.95 -1.14 1 16 SER 2.55 -2.07 1 17 GLU -0.97 0.11 1 18 ILE 0.96 -1.11 1 19 ARG 3.25 0.05 1 22 LEU 1.91 -2.31 1 23 ALA 0.03 -0.25 1 25 VAL 1.23 -1.44 1 26 LEU -0.47 -0.62 1 27 ASP 0.15 0.01 1 29 GLN 3.10 -1.58 1 30 LYS 2.57 -1.38 1 31 ILE 2.93 -1.61 1 33 ALA -0.45 -0.21 1 34 MET -4.19 -0.67 1 35 VAL -2.50 -3.61 1 36 ALA 1.81 -0.91 1 37 THR 1.95 -0.90 1 41 ILE -1.74 -1.27 1 43 THR 0.25 -0.61 1 44 ALA 0.07 -0.47 1 45 SER 0.21 -0.60 1 46 LYS -0.53 0.35 1 47 THR 0.37 -0.70 1 49 SER 0.12 -0.51 1 50 LEU 1.87 -1.49 1 51 GLU 1.05 -0.95 1 52 GLN 1.11 -0.89 1 53 ALA 0.85 -0.73 1 54 GLU -1.55 2.17 1 55 ALA 0.85 -0.90 1 56 ALA 5.64 -6.06 1 57 ALA 2.14 -1.02 1 58 SER 0.03 -0.42 1 59 ALA 0.45 -0.59 1 61 GLU -0.86 -0.26 1 62 LEU -0.99 -1.75 1 65 VAL -1.46 0.21 1 66 ASP 0.35 -0.19 1 67 VAL -6.51 2.40 1 68 LEU -2.47 -0.01 1 70 VAL -3.72 0.82 1 71 ARG 0.39 -1.69 1 72 VAL -1.99 0.56 1 73 LYS 4.56 -3.63 1 76 THR 1.84 -1.48 1 77 LEU -3.43 0.86 1 78 TYR -3.05 1.07 1 79 TYR -4.09 2.11 1 80 ALA -0.76 -1.89 1 81 PHE -0.84 0.36 1 85 HIS -0.07 2.20 1 87 LEU 3.09 -1.23 1 88 GLN 1.02 -2.19 1 89 ALA 3.54 -1.51 1 90 TYR 5.01 -1.18 1 91 ASP 4.51 -1.49 1 92 ARG 5.17 -2.39 1 93 ARG 4.38 -3.60 1 94 ALA 2.50 -0.30 1 95 ARG 4.64 -2.04 1 97 THR -0.93 0.25 1 98 GLN 4.22 -3.66 1 99 ASN -2.27 -0.46 1 100 ALA 2.59 -1.51 1 101 ALA -0.62 -1.95 1 102 PHE 0.76 0.86 1 104 VAL -1.20 -1.44 1 105 ARG 2.56 -2.30 1 111 ALA 0.59 -0.73 1 112 THR 0.80 -0.79 1 115 GLN -0.65 0.43 1 116 ILE 1.99 -1.88 1 117 ARG 1.70 -1.78 1 118 MET -2.03 4.72 1 120 LEU 1.09 -1.14 1 122 SER -0.22 -0.25 1 123 SER 0.74 -0.78 1 124 LEU 0.48 -0.88 1 125 ASP 0.42 -0.88 1 126 ILE -0.01 -0.66 1 127 GLU 0.44 0.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.50 _LACS_plot.Line_1_terminator_val_y_1 0.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.03 _LACS_plot.Line_2_terminator_val_x_2 5.64 _LACS_plot.Line_2_terminator_val_y_2 -0.49 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 LEU -2.47 0.85 0 86 ARG -7.50 0.05 0 67 VAL -6.51 0.88 0 18 ILE 0.96 -1.17 0 11 THR -1.23 -0.02 1 12 GLU -1.44 -0.10 1 13 ILE 2.16 -0.32 1 15 LEU 3.95 -0.37 1 16 SER 2.55 -0.48 1 17 GLU -0.97 -0.12 1 19 ARG 3.25 -0.56 1 22 LEU 1.91 -0.13 1 23 ALA 0.03 -0.16 1 25 VAL 1.23 -0.13 1 26 LEU -0.47 -0.04 1 27 ASP 0.15 -0.89 1 29 GLN 3.10 -0.20 1 30 LYS 2.57 -0.23 1 31 ILE 2.93 -0.39 1 33 ALA -0.45 -0.18 1 34 MET -4.19 -0.14 1 35 VAL -2.50 -0.16 1 36 ALA 1.81 -0.16 1 37 THR 1.95 -0.13 1 41 ILE -1.74 0.24 1 44 ALA 0.07 -0.20 1 45 SER 0.21 -0.25 1 46 LYS -0.53 -0.03 1 47 THR 0.37 -0.03 1 49 SER 0.12 -0.04 1 50 LEU 1.87 -0.17 1 51 GLU 1.05 -0.20 1 52 GLN 1.11 -0.26 1 53 ALA 0.85 -0.21 1 54 GLU -1.55 -0.25 1 55 ALA 0.85 -0.25 1 56 ALA 5.64 -0.22 1 57 ALA 2.14 -0.17 1 58 SER 0.03 -0.17 1 59 ALA 0.45 -0.10 1 61 GLU -0.86 -0.20 1 62 LEU -0.99 0.04 1 65 VAL -1.46 -0.13 1 66 ASP 0.35 0.57 1 70 VAL -3.72 0.32 1 71 ARG 0.39 0.44 1 72 VAL -1.99 0.01 1 73 LYS 4.56 -0.59 1 76 THR 1.84 0.15 1 77 LEU -3.43 -0.13 1 78 TYR -3.05 -0.34 1 79 TYR -4.09 0.42 1 80 ALA -0.76 0.17 1 87 LEU 3.09 -0.12 1 89 ALA 3.54 -0.34 1 90 TYR 5.01 -0.86 1 91 ASP 4.51 -0.45 1 92 ARG 5.17 -0.55 1 93 ARG 4.38 -0.53 1 94 ALA 2.50 -0.51 1 95 ARG 4.64 -0.36 1 97 THR -0.93 -0.01 1 98 GLN 4.22 -0.58 1 99 ASN -2.27 0.19 1 100 ALA 2.59 -0.33 1 101 ALA -0.62 -0.37 1 102 PHE 0.76 -0.53 1 104 VAL -1.20 -0.37 1 105 ARG 2.56 -0.14 1 111 ALA 0.59 -0.22 1 112 THR 0.80 -0.14 1 115 GLN -0.65 -0.19 1 116 ILE 1.99 -0.70 1 117 ARG 1.70 0.21 1 118 MET -2.03 -0.54 1 120 LEU 1.09 -0.12 1 122 SER -0.22 -0.17 1 123 SER 0.74 -0.17 1 124 LEU 0.48 -0.19 1 125 ASP 0.42 -0.16 1 126 ILE -0.01 -0.08 1 127 GLU 0.44 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 -2.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 5.64 _LACS_plot.Line_2_terminator_val_y_2 1.55 _LACS_plot.Y_axis_chem_shift_offset 0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 ALA 3.54 -7.59 0 12 GLU -1.44 -0.60 1 13 ILE 2.16 0.69 1 15 LEU 3.95 0.74 1 16 SER 2.55 1.24 1 17 GLU -0.97 -0.37 1 19 ARG 3.25 6.31 1 22 LEU 1.91 -0.71 1 23 ALA 0.03 -0.97 1 25 VAL 1.23 -0.35 1 26 LEU -0.47 -1.53 1 31 ILE 2.93 0.43 1 34 MET -4.19 -1.86 1 35 VAL -2.50 0.77 1 36 ALA 1.81 1.30 1 37 THR 1.95 -0.80 1 41 ILE -1.74 -1.49 1 43 THR 0.25 3.00 1 44 ALA 0.07 -0.10 1 45 SER 0.21 0.06 1 46 LYS -0.53 0.30 1 47 THR 0.37 -0.23 1 49 SER 0.12 0.10 1 50 LEU 1.87 0.25 1 51 GLU 1.05 0.64 1 52 GLN 1.11 0.41 1 53 ALA 0.85 0.77 1 54 GLU -1.55 1.06 1 56 ALA 5.64 0.50 1 57 ALA 2.14 0.78 1 58 SER 0.03 -0.13 1 59 ALA 0.45 0.28 1 61 GLU -0.86 -0.34 1 62 LEU -0.99 -3.05 1 66 ASP 0.35 -0.81 1 67 VAL -6.51 -2.23 1 68 LEU -2.47 -0.58 1 70 VAL -3.72 -2.81 1 71 ARG 0.39 -0.52 1 72 VAL -1.99 -0.84 1 73 LYS 4.56 0.07 1 76 THR 1.84 -2.24 1 77 LEU -3.43 -2.82 1 78 TYR -3.05 -0.97 1 79 TYR -4.09 -0.52 1 80 ALA -0.76 -2.42 1 81 PHE -0.84 -2.92 1 85 HIS -0.07 0.08 1 87 LEU 3.09 -4.42 1 88 GLN 1.02 2.71 1 90 TYR 5.01 1.31 1 91 ASP 4.51 2.96 1 92 ARG 5.17 2.08 1 93 ARG 4.38 3.24 1 94 ALA 2.50 2.40 1 95 ARG 4.64 3.71 1 98 GLN 4.22 -1.79 1 99 ASN -2.27 -1.12 1 100 ALA 2.59 -0.72 1 101 ALA -0.62 -2.93 1 102 PHE 0.76 -1.52 1 104 VAL -1.20 0.60 1 105 ARG 2.56 -1.26 1 111 ALA 0.59 0.36 1 112 THR 0.80 0.19 1 115 GLN -0.65 -0.52 1 116 ILE 1.99 -0.75 1 117 ARG 1.70 -0.43 1 118 MET -2.03 -1.85 1 120 LEU 1.09 0.65 1 122 SER -0.22 -0.16 1 123 SER 0.74 -0.35 1 124 LEU 0.48 -1.15 1 125 ASP 0.42 -0.19 1 126 ILE -0.01 -1.16 1 127 GLU 0.44 4.29 1 stop_ save_