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 bmr19138_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -2.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 7.45 _LACS_plot.Line_2_terminator_val_y_2 4.98 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 16 THR 2.78 -3.02 0 10 TYR 3.65 2.39 1 11 GLN 1.61 1.31 1 12 ILE 1.21 1.11 1 13 LEU 0.38 0.27 1 17 SER 2.47 2.03 1 18 SER 2.06 1.60 1 19 ARG 1.81 1.34 1 20 LEU 0.23 0.52 1 21 ALA -0.37 0.04 1 22 ASN -0.60 -0.14 1 25 SER -0.21 0.08 1 27 GLN -0.62 -0.08 1 28 ILE -1.22 -0.13 1 29 GLN -3.32 -1.40 1 30 LEU 6.97 3.59 1 31 TRP 5.20 2.90 1 32 GLN 4.29 2.63 1 33 PHE 2.81 3.11 1 34 LEU 4.93 2.90 1 35 LEU 4.09 2.97 1 37 LEU 2.01 2.24 1 38 LEU 2.34 1.49 1 39 SER 1.72 1.77 1 40 ASP -3.78 -1.62 1 41 SER 4.09 2.91 1 42 SER 4.05 2.94 1 43 ASN 0.30 0.25 1 44 SER 4.22 3.36 1 45 SER 2.59 1.37 1 47 ILE -1.60 0.17 1 48 THR -3.55 -1.79 1 49 TRP -2.20 0.21 1 50 GLU -2.83 -0.73 1 52 THR 0.23 -0.36 1 53 ASN -0.52 0.15 1 55 GLU 1.11 1.00 1 56 PHE -5.02 -1.39 1 57 LYS -5.32 -1.61 1 58 MET 1.75 0.07 1 59 THR 2.64 1.06 1 60 ASP -0.84 -0.29 1 62 ASP 3.86 3.13 1 63 GLU 2.10 1.00 1 64 VAL 7.46 5.90 1 65 ALA 4.42 2.93 1 66 ARG 4.07 3.54 1 67 ARG 4.20 3.72 1 68 TRP -0.93 0.68 1 70 GLU 2.72 2.61 1 71 ARG 2.51 0.43 1 72 LYS 1.16 -3.18 1 73 SER 3.05 0.55 1 74 LYS -2.56 -3.26 1 76 ASN 0.23 -0.81 1 77 MET 4.09 0.30 1 78 ASN -2.21 -1.11 1 79 TYR 5.26 4.32 1 80 ASP 3.70 4.41 1 81 LYS 3.62 3.36 1 82 LEU 3.74 4.76 1 83 SER 6.75 3.48 1 84 ARG 3.96 1.66 1 85 ALA 2.75 2.49 1 86 LEU 5.78 2.30 1 88 TYR 4.11 3.30 1 89 TYR -0.25 -1.63 1 90 TYR 2.79 -0.37 1 91 ASP 1.37 1.15 1 92 LYS -1.54 -0.59 1 93 ASN 3.79 1.94 1 94 ILE -1.03 0.97 1 95 MET -6.64 -1.14 1 96 THR -4.43 -1.76 1 97 LYS -2.61 -2.16 1 98 VAL 2.66 -0.20 1 99 HIS 2.79 2.74 1 101 LYS -2.58 -1.53 1 102 ARG 1.88 1.37 1 103 TYR 0.28 -1.13 1 104 ALA -3.96 -1.49 1 105 TYR -5.96 -0.93 1 106 LYS -4.21 -1.27 1 107 PHE 0.79 2.67 1 108 ASP -1.25 -2.04 1 109 PHE 4.82 3.14 1 110 HIS 4.25 4.45 1 112 ILE 4.16 3.73 1 113 ALA 3.59 2.55 1 114 GLN 2.70 2.02 1 115 ALA 1.94 1.24 1 116 LEU -0.23 0.09 1 117 GLN 0.18 0.33 1 122 GLU 0.78 0.71 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19138_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 4.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.88 _LACS_plot.Line_2_terminator_val_x_2 7.45 _LACS_plot.Line_2_terminator_val_y_2 -2.47 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 16 THR 2.78 -5.80 0 10 TYR 3.65 -1.26 1 11 GLN 1.61 -0.30 1 12 ILE 1.21 -0.10 1 13 LEU 0.38 -0.11 1 17 SER 2.47 -0.44 1 18 SER 2.06 -0.46 1 19 ARG 1.81 -0.47 1 20 LEU 0.23 0.29 1 21 ALA -0.37 0.41 1 22 ASN -0.60 0.46 1 25 SER -0.21 0.29 1 27 GLN -0.62 0.54 1 28 ILE -1.22 1.09 1 29 GLN -3.32 1.92 1 30 LEU 6.97 -3.38 1 31 TRP 5.20 -2.30 1 32 GLN 4.29 -1.66 1 33 PHE 2.81 0.30 1 34 LEU 4.93 -2.03 1 35 LEU 4.09 -1.12 1 37 LEU 2.01 0.23 1 38 LEU 2.34 -0.85 1 39 SER 1.72 0.05 1 40 ASP -3.78 2.16 1 41 SER 4.09 -1.18 1 42 SER 4.05 -1.11 1 43 ASN 0.30 -0.05 1 44 SER 4.22 -0.86 1 45 SER 2.59 -1.22 1 47 ILE -1.60 1.77 1 48 THR -3.55 1.76 1 49 TRP -2.20 2.41 1 50 GLU -2.83 2.10 1 52 THR 0.23 -0.59 1 53 ASN -0.52 0.67 1 55 GLU 1.11 -0.11 1 56 PHE -5.02 3.63 1 57 LYS -5.32 3.71 1 58 MET 1.75 -1.68 1 59 THR 2.64 -1.58 1 60 ASP -0.84 0.55 1 62 ASP 3.86 -0.73 1 63 GLU 2.10 -1.10 1 64 VAL 7.46 -1.56 1 65 ALA 4.42 -1.49 1 66 ARG 4.07 -0.53 1 67 ARG 4.20 -0.48 1 68 TRP -0.93 1.61 1 70 GLU 2.72 -0.11 1 71 ARG 2.51 -2.08 1 72 LYS 1.16 -4.34 1 73 SER 3.05 -2.50 1 74 LYS -2.56 -0.70 1 76 ASN 0.23 -1.04 1 77 MET 4.09 -3.79 1 78 ASN -2.21 1.10 1 79 TYR 5.26 -0.94 1 80 ASP 3.70 0.71 1 81 LYS 3.62 -0.26 1 82 LEU 3.74 1.02 1 83 SER 6.75 -3.27 1 84 ARG 3.96 -2.30 1 85 ALA 2.75 -0.26 1 86 LEU 5.78 -3.48 1 88 TYR 4.11 -0.81 1 89 TYR -0.25 -1.38 1 90 TYR 2.79 -3.16 1 91 ASP 1.37 -0.22 1 92 LYS -1.54 0.95 1 93 ASN 3.79 -1.85 1 94 ILE -1.03 2.00 1 95 MET -6.64 5.50 1 96 THR -4.43 2.67 1 97 LYS -2.61 0.45 1 98 VAL 2.66 -2.86 1 99 HIS 2.79 -0.05 1 101 LYS -2.58 1.05 1 102 ARG 1.88 -0.51 1 103 TYR 0.28 -1.41 1 104 ALA -3.96 2.47 1 105 TYR -5.96 5.03 1 106 LYS -4.21 2.94 1 107 PHE 0.79 1.88 1 108 ASP -1.25 -0.79 1 109 PHE 4.82 -1.68 1 110 HIS 4.25 0.20 1 112 ILE 4.16 -0.43 1 113 ALA 3.59 -1.04 1 114 GLN 2.70 -0.68 1 115 ALA 1.94 -0.70 1 116 LEU -0.23 0.32 1 117 GLN 0.18 0.15 1 122 GLU 0.78 -0.07 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19138_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.45 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 TYR 2.79 0.83 0 10 TYR 3.65 -0.31 1 11 GLN 1.61 -0.17 1 12 ILE 1.21 -0.23 1 13 LEU 0.38 -0.15 1 16 THR 2.78 -0.06 1 17 SER 2.47 -0.19 1 18 SER 2.06 0.10 1 19 ARG 1.81 -0.32 1 20 LEU 0.23 -0.09 1 21 ALA -0.37 -0.19 1 22 ASN -0.60 -0.18 1 25 SER -0.21 0.03 1 27 GLN -0.62 0.04 1 28 ILE -1.22 0.05 1 29 GLN -3.32 0.68 1 30 LEU 6.97 -1.34 1 31 TRP 5.20 -0.62 1 32 GLN 4.29 -0.95 1 33 PHE 2.81 -0.41 1 34 LEU 4.93 -0.80 1 35 LEU 4.09 -0.52 1 37 LEU 2.01 -0.47 1 38 LEU 2.34 -0.61 1 39 SER 1.72 0.05 1 40 ASP -3.78 0.38 1 42 SER 4.05 -0.05 1 43 ASN 0.30 0.43 1 44 SER 4.22 0.11 1 45 SER 2.59 -0.19 1 47 ILE -1.60 0.85 1 48 THR -3.55 0.41 1 49 TRP -2.20 0.52 1 50 GLU -2.83 0.42 1 52 THR 0.23 0.08 1 53 ASN -0.52 0.26 1 55 GLU 1.11 0.61 1 56 PHE -5.02 0.91 1 57 LYS -5.32 0.81 1 58 MET 1.75 0.46 1 59 THR 2.64 -0.32 1 60 ASP -0.84 -0.09 1 62 ASP 3.86 -0.16 1 63 GLU 2.10 0.11 1 64 VAL 7.46 -0.76 1 65 ALA 4.42 -0.21 1 66 ARG 4.07 -0.27 1 67 ARG 4.20 -0.23 1 68 TRP -0.93 -0.56 1 70 GLU 2.72 -0.40 1 71 ARG 2.51 -0.26 1 72 LYS 1.16 -0.35 1 73 SER 3.05 -0.57 1 74 LYS -2.56 0.17 1 76 ASN 0.23 0.25 1 77 MET 4.09 -0.15 1 78 ASN -2.21 0.06 1 79 TYR 5.26 -0.24 1 80 ASP 3.70 -0.56 1 81 LYS 3.62 -0.23 1 82 LEU 3.74 -0.44 1 83 SER 6.75 -0.89 1 84 ARG 3.96 -0.01 1 85 ALA 2.75 -0.43 1 86 LEU 5.78 -0.55 1 88 TYR 4.11 0.00 1 89 TYR -0.25 0.16 1 91 ASP 1.37 0.20 1 92 LYS -1.54 0.17 1 93 ASN 3.79 -0.28 1 94 ILE -1.03 -0.10 1 95 MET -6.64 0.75 1 96 THR -4.43 0.12 1 97 LYS -2.61 -0.22 1 98 VAL 2.66 -0.23 1 99 HIS 2.79 -0.54 1 101 LYS -2.58 0.16 1 103 TYR 0.28 -0.22 1 104 ALA -3.96 1.09 1 106 LYS -4.21 0.80 1 107 PHE 0.79 -0.08 1 108 ASP -1.25 0.05 1 109 PHE 4.82 -0.28 1 110 HIS 4.25 -0.34 1 112 ILE 4.16 -0.80 1 113 ALA 3.59 -0.32 1 114 GLN 2.70 -0.30 1 115 ALA 1.94 -0.07 1 116 LEU -0.23 0.02 1 117 GLN 0.18 -0.12 1 122 GLU 0.78 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19138_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.64 _LACS_plot.Line_1_terminator_val_y_1 -2.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 7.45 _LACS_plot.Line_2_terminator_val_y_2 2.43 _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 77 MET 4.09 -2.80 0 47 ILE -1.60 -5.10 0 10 TYR 3.65 1.50 1 11 GLN 1.61 0.60 1 12 ILE 1.21 0.30 1 13 LEU 0.38 0.10 1 17 SER 2.47 0.40 1 18 SER 2.06 0.90 1 19 ARG 1.81 1.00 1 20 LEU 0.23 -0.70 1 21 ALA -0.37 -0.90 1 25 SER -0.21 0.40 1 27 GLN -0.62 0.00 1 28 ILE -1.22 -3.10 1 29 GLN -3.32 2.00 1 30 LEU 6.97 0.80 1 31 TRP 5.20 0.40 1 32 GLN 4.29 2.10 1 33 PHE 2.81 0.90 1 34 LEU 4.93 0.90 1 37 LEU 2.01 3.00 1 38 LEU 2.34 -0.80 1 39 SER 1.72 -1.70 1 41 SER 4.09 2.10 1 42 SER 4.05 1.20 1 43 ASN 0.30 0.90 1 44 SER 4.22 0.10 1 45 SER 2.59 0.00 1 49 TRP -2.20 0.80 1 50 GLU -2.83 -1.70 1 52 THR 0.23 -0.40 1 53 ASN -0.52 0.00 1 55 GLU 1.11 -0.10 1 56 PHE -5.02 -3.90 1 57 LYS -5.32 -1.10 1 58 MET 1.75 -2.60 1 59 THR 2.64 1.20 1 62 ASP 3.86 2.50 1 63 GLU 2.10 2.10 1 64 VAL 7.46 1.50 1 65 ALA 4.42 0.70 1 66 ARG 4.07 4.10 1 67 ARG 4.20 3.00 1 68 TRP -0.93 1.10 1 70 GLU 2.72 2.80 1 71 ARG 2.51 1.50 1 72 LYS 1.16 -1.00 1 73 SER 3.05 -0.80 1 76 ASN 0.23 1.50 1 78 ASN -2.21 -0.10 1 79 TYR 5.26 0.70 1 80 ASP 3.70 3.40 1 81 LYS 3.62 2.40 1 82 LEU 3.74 1.60 1 83 SER 6.75 1.60 1 84 ARG 3.96 2.40 1 85 ALA 2.75 1.50 1 88 TYR 4.11 2.10 1 89 TYR -0.25 3.20 1 90 TYR 2.79 4.20 1 91 ASP 1.37 0.60 1 92 LYS -1.54 -1.20 1 93 ASN 3.79 -2.60 1 94 ILE -1.03 -1.40 1 95 MET -6.64 -2.50 1 96 THR -4.43 -1.60 1 97 LYS -2.61 0.60 1 98 VAL 2.66 -0.40 1 101 LYS -2.58 -1.90 1 102 ARG 1.88 0.80 1 103 TYR 0.28 -1.00 1 104 ALA -3.96 -1.10 1 105 TYR -5.96 -4.00 1 106 LYS -4.21 0.50 1 107 PHE 0.79 -0.90 1 108 ASP -1.25 -0.30 1 110 HIS 4.25 3.40 1 112 ILE 4.16 0.40 1 113 ALA 3.59 2.40 1 114 GLN 2.70 1.50 1 115 ALA 1.94 1.00 1 116 LEU -0.23 -0.40 1 122 GLU 0.78 0.20 1 stop_ save_