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 bmr6211_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.88 _LACS_plot.Line_1_terminator_val_y_1 -1.33 _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 -1.57 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 5.30 _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 51 ILE 5.72 1.66 0 10 LEU 4.27 2.88 1 11 ASN 3.90 2.98 1 12 LEU 3.70 3.00 1 13 SER 5.43 3.91 1 14 GLU 2.36 2.04 1 15 ALA 3.80 2.53 1 16 TYR 2.19 1.49 1 17 LYS 0.50 0.50 1 18 ASP -1.71 -0.78 1 20 GLU 1.92 2.08 1 21 VAL 5.02 3.51 1 22 LYS 3.61 2.83 1 23 ALA 0.00 -0.15 1 24 ASN -2.58 -0.45 1 25 GLU 3.91 3.68 1 26 PHE 4.07 3.92 1 27 LEU 2.20 2.07 1 28 SER 5.65 4.46 1 29 LYS 4.92 3.84 1 30 LEU 2.94 2.81 1 31 VAL 6.58 5.22 1 32 VAL 5.35 4.29 1 33 GLN 3.84 3.02 1 35 ALA 5.28 3.58 1 37 LYS 3.07 2.90 1 38 LEU 1.90 1.76 1 39 THR 2.10 1.43 1 40 ALA 0.00 0.32 1 41 SER -0.25 -0.20 1 42 ASN -0.08 -0.28 1 43 SER -1.64 -0.66 1 44 GLU 1.83 2.12 1 45 ASN 2.07 1.58 1 46 SER 4.10 3.22 1 47 TYR 4.99 4.44 1 48 ILE 3.80 1.04 1 49 GLU 3.23 2.59 1 50 VAL 6.74 4.91 1 52 SER 5.20 3.91 1 53 LEU 1.75 2.85 1 54 LEU 1.77 2.71 1 56 ARG 4.07 3.18 1 58 ILE 6.48 5.08 1 60 SER 4.26 3.10 1 61 TYR 4.30 4.55 1 63 LEU 2.47 1.91 1 64 SER 0.84 0.89 1 65 HIS 2.35 0.92 1 66 LYS 3.54 0.57 1 69 ILE 1.91 1.58 1 72 SER 5.33 2.75 1 73 MET 1.51 -0.71 1 74 LEU 4.55 2.85 1 75 THR 5.98 4.85 1 76 ILE 4.29 3.84 1 77 TYR 4.08 4.62 1 78 THR 5.51 4.38 1 79 GLN 4.77 3.02 1 80 ILE 5.69 4.61 1 81 GLN 4.46 3.02 1 82 LYS 4.19 3.61 1 83 ASP 3.58 2.50 1 84 ILE 4.55 3.99 1 85 LYS 3.61 2.82 1 86 ASN 0.18 -0.28 1 88 ASN 1.83 1.55 1 89 ILE -2.88 -0.98 1 90 ASP -0.46 -0.81 1 91 THR 5.05 3.45 1 92 GLU 3.14 2.26 1 93 LYS 3.89 3.46 1 94 LEU 3.09 3.10 1 95 ARG 3.86 3.06 1 96 LYS 3.89 3.46 1 97 TYR 3.75 3.38 1 98 GLU 4.88 3.83 1 99 ILE 4.26 3.53 1 100 ALA 3.57 2.18 1 101 LYS -0.72 -1.67 1 103 LEU -0.60 -1.19 1 104 MET -0.75 -0.72 1 105 SER 0.99 0.42 1 106 VAL -1.56 -0.92 1 108 TYR -0.29 -0.56 1 109 ILE -0.94 -0.59 1 110 TYR -0.65 -0.48 1 111 PHE 0.54 1.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6211_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.88 _LACS_plot.Line_1_terminator_val_y_1 1.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.43 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -1.43 _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 51 ILE 5.72 -4.06 0 10 LEU 4.27 -1.39 1 11 ASN 3.90 -0.92 1 12 LEU 3.70 -0.70 1 13 SER 5.43 -1.52 1 14 GLU 2.36 -0.32 1 15 ALA 3.80 -1.27 1 16 TYR 2.19 -0.70 1 17 LYS 0.50 0.00 1 18 ASP -1.71 0.93 1 20 GLU 1.92 0.16 1 21 VAL 5.02 -1.51 1 22 LYS 3.61 -0.78 1 23 ALA 0.00 -0.15 1 24 ASN -2.58 2.13 1 25 GLU 3.91 -0.23 1 26 PHE 4.07 -0.15 1 27 LEU 2.20 -0.13 1 28 SER 5.65 -1.19 1 29 LYS 4.92 -1.08 1 30 LEU 2.94 -0.13 1 31 VAL 6.58 -1.36 1 32 VAL 5.35 -1.06 1 33 GLN 3.84 -0.82 1 35 ALA 5.28 -1.70 1 37 LYS 3.07 -0.17 1 38 LEU 1.90 -0.14 1 39 THR 2.10 -0.67 1 40 ALA 0.00 0.32 1 41 SER -0.25 0.05 1 42 ASN -0.08 -0.20 1 43 SER -1.64 0.98 1 44 GLU 1.83 0.29 1 45 ASN 2.07 -0.49 1 46 SER 4.10 -0.88 1 47 TYR 4.99 -0.55 1 48 ILE 3.80 -2.76 1 49 GLU 3.23 -0.64 1 50 VAL 6.74 -1.83 1 52 SER 5.20 -1.29 1 53 LEU 1.75 1.10 1 54 LEU 1.77 0.94 1 56 ARG 4.07 -0.89 1 58 ILE 6.48 -1.40 1 60 SER 4.26 -1.16 1 61 TYR 4.30 0.25 1 63 LEU 2.47 -0.56 1 64 SER 0.84 0.05 1 65 HIS 2.35 -1.43 1 66 LYS 3.54 -2.97 1 69 ILE 1.91 -0.33 1 72 SER 5.33 -2.58 1 73 MET 1.51 -2.22 1 74 LEU 4.55 -1.70 1 75 THR 5.98 -1.13 1 76 ILE 4.29 -0.45 1 77 TYR 4.08 0.54 1 78 THR 5.51 -1.13 1 79 GLN 4.77 -1.75 1 80 ILE 5.69 -1.08 1 81 GLN 4.46 -1.44 1 82 LYS 4.19 -0.58 1 83 ASP 3.58 -1.08 1 84 ILE 4.55 -0.56 1 85 LYS 3.61 -0.79 1 86 ASN 0.18 -0.46 1 88 ASN 1.83 -0.28 1 89 ILE -2.88 1.90 1 90 ASP -0.46 -0.35 1 91 THR 5.05 -1.60 1 92 GLU 3.14 -0.88 1 93 LYS 3.89 -0.43 1 94 LEU 3.09 0.01 1 95 ARG 3.86 -0.80 1 96 LYS 3.89 -0.43 1 97 TYR 3.75 -0.37 1 98 GLU 4.88 -1.05 1 99 ILE 4.26 -0.73 1 100 ALA 3.57 -1.39 1 101 LYS -0.72 -0.95 1 103 LEU -0.60 -0.59 1 104 MET -0.75 0.03 1 105 SER 0.99 -0.57 1 106 VAL -1.56 0.64 1 108 TYR -0.29 -0.27 1 109 ILE -0.94 0.35 1 110 TYR -0.65 0.17 1 111 PHE 0.54 0.79 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6211_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.88 _LACS_plot.Line_1_terminator_val_y_1 0.19 _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 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -0.51 _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 49 GLU 3.23 -1.13 0 10 LEU 4.27 -0.33 1 11 ASN 3.90 -0.13 1 12 LEU 3.70 -0.33 1 13 SER 5.43 -0.48 1 14 GLU 2.36 -0.22 1 15 ALA 3.80 -0.09 1 16 TYR 2.19 -0.44 1 17 LYS 0.50 -0.38 1 18 ASP -1.71 -0.16 1 20 GLU 1.92 -0.26 1 21 VAL 5.02 -0.48 1 22 LYS 3.61 -0.53 1 23 ALA 0.00 -0.03 1 24 ASN -2.58 0.21 1 25 GLU 3.91 -0.28 1 26 PHE 4.07 -0.39 1 27 LEU 2.20 -0.49 1 28 SER 5.65 -0.55 1 29 LYS 4.92 -0.36 1 30 LEU 2.94 -0.20 1 31 VAL 6.58 -0.65 1 32 VAL 5.35 -0.61 1 33 GLN 3.84 -0.22 1 35 ALA 5.28 -0.28 1 37 LYS 3.07 -0.16 1 38 LEU 1.90 0.00 1 39 THR 2.10 -0.23 1 40 ALA 0.00 0.05 1 41 SER -0.25 0.01 1 42 ASN -0.08 0.21 1 43 SER -1.64 0.18 1 44 GLU 1.83 -0.04 1 45 ASN 2.07 -0.03 1 46 SER 4.10 -0.19 1 47 TYR 4.99 -0.56 1 48 ILE 3.80 -0.72 1 50 VAL 6.74 -0.47 1 51 ILE 5.72 -0.51 1 52 SER 5.20 -0.33 1 53 LEU 1.75 -0.21 1 54 LEU 1.77 -0.21 1 56 ARG 4.07 -0.15 1 58 ILE 6.48 -0.48 1 60 SER 4.26 -0.20 1 61 TYR 4.30 -0.63 1 63 LEU 2.47 -0.26 1 64 SER 0.84 -0.05 1 65 HIS 2.35 -0.11 1 66 LYS 3.54 -0.44 1 69 ILE 1.91 -0.08 1 72 SER 5.33 -0.30 1 73 MET 1.51 0.27 1 74 LEU 4.55 -0.24 1 75 THR 5.98 -0.39 1 76 ILE 4.29 -0.39 1 77 TYR 4.08 -0.58 1 78 THR 5.51 -0.45 1 79 GLN 4.77 -0.36 1 80 ILE 5.69 -0.40 1 81 GLN 4.46 -0.57 1 82 LYS 4.19 -0.32 1 83 ASP 3.58 0.32 1 84 ILE 4.55 -0.23 1 85 LYS 3.61 -0.17 1 86 ASN 0.18 0.06 1 88 ASN 1.83 -0.07 1 89 ILE -2.88 0.04 1 90 ASP -0.46 0.08 1 91 THR 5.05 -0.41 1 92 GLU 3.14 0.03 1 93 LYS 3.89 -0.27 1 94 LEU 3.09 -0.17 1 95 ARG 3.86 -0.11 1 96 LYS 3.89 -0.36 1 97 TYR 3.75 -0.29 1 98 GLU 4.88 -0.77 1 99 ILE 4.26 -0.30 1 100 ALA 3.57 -0.16 1 101 LYS -0.72 -0.07 1 103 LEU -0.60 0.04 1 104 MET -0.75 0.03 1 105 SER 0.99 -0.05 1 106 VAL -1.56 0.15 1 108 TYR -0.29 0.02 1 109 ILE -0.94 -0.09 1 110 TYR -0.65 0.04 1 111 PHE 0.54 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6211_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.88 _LACS_plot.Line_1_terminator_val_y_1 -1.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.61 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 2.78 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 LEU 1.75 4.41 0 108 TYR -0.29 3.63 0 10 LEU 4.27 2.17 1 11 ASN 3.90 4.25 1 12 LEU 3.70 0.41 1 13 SER 5.43 2.39 1 14 GLU 2.36 3.15 1 15 ALA 3.80 0.96 1 16 TYR 2.19 -0.70 1 17 LYS 0.50 0.53 1 20 GLU 1.92 2.06 1 21 VAL 5.02 1.65 1 22 LYS 3.61 1.09 1 23 ALA 0.00 -1.65 1 24 ASN -2.58 -0.91 1 25 GLU 3.91 0.46 1 26 PHE 4.07 2.52 1 27 LEU 2.20 0.64 1 28 SER 5.65 1.63 1 29 LYS 4.92 2.40 1 30 LEU 2.94 1.15 1 31 VAL 6.58 1.30 1 32 VAL 5.35 3.42 1 33 GLN 3.84 3.96 1 35 ALA 5.28 1.96 1 37 LYS 3.07 2.75 1 38 LEU 1.90 0.82 1 39 THR 2.10 0.87 1 40 ALA 0.00 -0.05 1 41 SER -0.25 -0.42 1 42 ASN -0.08 -0.11 1 43 SER -1.64 0.80 1 44 GLU 1.83 1.15 1 45 ASN 2.07 1.59 1 46 SER 4.10 0.48 1 47 TYR 4.99 0.60 1 48 ILE 3.80 0.32 1 49 GLU 3.23 1.85 1 50 VAL 6.74 0.87 1 51 ILE 5.72 3.35 1 52 SER 5.20 1.88 1 54 LEU 1.77 1.30 1 56 ARG 4.07 3.07 1 58 ILE 6.48 1.05 1 60 SER 4.26 3.13 1 63 LEU 2.47 1.68 1 64 SER 0.84 0.00 1 72 SER 5.33 2.98 1 74 LEU 4.55 1.99 1 75 THR 5.98 1.74 1 76 ILE 4.29 0.58 1 77 TYR 4.08 1.38 1 78 THR 5.51 2.10 1 79 GLN 4.77 1.79 1 80 ILE 5.69 1.25 1 81 GLN 4.46 3.33 1 82 LYS 4.19 1.79 1 83 ASP 3.58 2.98 1 84 ILE 4.55 3.02 1 85 LYS 3.61 1.80 1 86 ASN 0.18 1.23 1 88 ASN 1.83 0.87 1 89 ILE -2.88 -2.31 1 90 ASP -0.46 0.22 1 91 THR 5.05 2.42 1 92 GLU 3.14 2.49 1 94 LEU 3.09 -0.31 1 95 ARG 3.86 2.38 1 97 TYR 3.75 0.70 1 98 GLU 4.88 2.74 1 99 ILE 4.26 4.01 1 100 ALA 3.57 1.76 1 101 LYS -0.72 0.10 1 103 LEU -0.60 -0.76 1 104 MET -0.75 0.35 1 105 SER 0.99 -0.42 1 109 ILE -0.94 -1.85 1 110 TYR -0.65 -1.43 1 stop_ save_