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 bmr6396_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 -1.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.56 _LACS_plot.Line_2_terminator_val_x_2 9.75 _LACS_plot.Line_2_terminator_val_y_2 7.87 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 92 LYS 5.43 2.32 0 50 TYR 5.00 5.59 0 44 ASN 9.76 7.44 0 77 LEU -5.78 -1.04 0 10 ALA 3.32 2.73 1 11 GLU 3.40 2.70 1 12 VAL 4.70 3.35 1 13 GLU 3.94 3.14 1 14 GLU 3.51 2.73 1 15 THR 6.74 5.33 1 16 LEU 4.91 3.91 1 17 LYS 3.95 3.30 1 18 ARG 3.99 3.23 1 19 LEU 1.83 2.31 1 20 GLN 2.92 2.52 1 21 SER 0.01 0.23 1 22 GLN 0.19 0.15 1 23 LYS 2.03 1.45 1 25 VAL 3.64 2.69 1 26 GLN -0.03 0.47 1 28 ILE -4.49 -0.64 1 29 ILE -4.66 -0.48 1 30 VAL -1.15 -1.01 1 31 VAL -5.46 -3.50 1 32 ASN -1.49 -1.66 1 33 THR 5.08 4.08 1 34 GLU -0.02 -0.15 1 36 ILE -0.89 -1.36 1 38 ILE -0.26 -0.11 1 39 LYS -3.62 -0.45 1 40 SER -3.79 -2.56 1 41 THR 1.19 0.01 1 42 MET -3.67 -1.08 1 43 ASP -0.26 -0.49 1 46 THR 7.55 5.32 1 47 THR 7.05 5.84 1 48 THR 6.13 5.35 1 49 GLN 3.95 3.62 1 51 ALA 4.86 4.04 1 52 ASN 3.51 3.34 1 53 LEU 2.51 2.70 1 54 MET 2.34 0.29 1 55 HIS 4.97 4.94 1 56 ASN 3.63 3.28 1 57 PHE 3.36 3.61 1 58 ILE 5.42 4.09 1 59 LEU 4.38 3.24 1 60 LYS 2.74 1.27 1 61 ALA 3.03 2.98 1 62 ARG 4.92 4.55 1 63 SER 4.51 3.50 1 64 THR 7.20 5.88 1 65 VAL 5.71 4.34 1 66 ARG 2.48 1.95 1 67 GLU 2.59 2.03 1 68 ILE 2.93 2.82 1 69 ASP -3.16 -0.78 1 71 GLN 0.35 -0.25 1 72 ASN -4.59 -2.75 1 73 ASP -4.06 -1.06 1 74 LEU -2.29 0.50 1 75 THR 1.65 1.38 1 76 PHE -1.33 1.60 1 78 ARG -4.71 -0.63 1 79 ILE -2.71 -0.69 1 80 ARG -1.45 -0.16 1 81 SER -4.34 -1.39 1 82 LYS 3.68 3.12 1 83 LYS -1.59 0.64 1 84 ASN -1.01 -0.33 1 85 GLU -5.15 -1.26 1 86 ILE -3.86 -1.25 1 87 MET -4.13 -1.43 1 88 VAL -3.32 -1.72 1 89 ALA -5.80 -1.98 1 91 ASP -1.10 -0.79 1 93 ASP 0.88 0.05 1 94 TYR -4.80 -2.67 1 95 PHE -2.34 -0.28 1 96 LEU -1.95 -0.77 1 97 ILE -1.23 -0.55 1 98 VAL -2.84 -1.02 1 99 ILE -0.53 -0.21 1 100 GLN -6.15 -1.80 1 101 ASN 1.23 0.12 1 103 THR -0.22 0.16 1 104 GLU 0.17 1.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6396_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 4.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.44 _LACS_plot.Line_2_terminator_val_x_2 9.75 _LACS_plot.Line_2_terminator_val_y_2 -1.88 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 92 LYS 5.43 -3.11 0 50 TYR 5.00 0.59 0 44 ASN 9.76 -2.32 0 77 LEU -5.78 4.74 0 10 ALA 3.32 -0.59 1 11 GLU 3.40 -0.70 1 12 VAL 4.70 -1.35 1 13 GLU 3.94 -0.80 1 14 GLU 3.51 -0.78 1 15 THR 6.74 -1.41 1 16 LEU 4.91 -1.00 1 17 LYS 3.95 -0.65 1 18 ARG 3.99 -0.76 1 19 LEU 1.83 0.48 1 20 GLN 2.92 -0.40 1 21 SER 0.01 0.22 1 22 GLN 0.19 -0.04 1 23 LYS 2.03 -0.58 1 25 VAL 3.64 -0.95 1 26 GLN -0.03 0.50 1 28 ILE -4.49 3.85 1 29 ILE -4.66 4.18 1 30 VAL -1.15 0.14 1 31 VAL -5.46 1.96 1 32 ASN -1.49 -0.17 1 33 THR 5.08 -1.00 1 34 GLU -0.02 -0.13 1 36 ILE -0.89 -0.47 1 38 ILE -0.26 0.15 1 39 LYS -3.62 3.17 1 40 SER -3.79 1.23 1 41 THR 1.19 -1.18 1 42 MET -3.67 2.59 1 43 ASP -0.26 -0.23 1 46 THR 7.55 -2.23 1 47 THR 7.05 -1.21 1 48 THR 6.13 -0.78 1 49 GLN 3.95 -0.33 1 51 ALA 4.86 -0.82 1 52 ASN 3.51 -0.17 1 53 LEU 2.51 0.19 1 54 MET 2.34 -2.05 1 55 HIS 4.97 -0.03 1 56 ASN 3.63 -0.35 1 57 PHE 3.36 0.25 1 58 ILE 5.42 -1.33 1 59 LEU 4.38 -1.14 1 60 LYS 2.74 -1.47 1 61 ALA 3.03 -0.05 1 62 ARG 4.92 -0.37 1 63 SER 4.51 -1.01 1 64 THR 7.20 -1.32 1 65 VAL 5.71 -1.37 1 66 ARG 2.48 -0.53 1 67 GLU 2.59 -0.56 1 68 ILE 2.93 -0.11 1 69 ASP -3.16 2.38 1 71 GLN 0.35 -0.60 1 72 ASN -4.59 1.84 1 73 ASP -4.06 3.00 1 74 LEU -2.29 2.79 1 75 THR 1.65 -0.27 1 76 PHE -1.33 2.93 1 78 ARG -4.71 4.08 1 79 ILE -2.71 2.02 1 80 ARG -1.45 1.29 1 81 SER -4.34 2.95 1 82 LYS 3.68 -0.56 1 83 LYS -1.59 2.23 1 84 ASN -1.01 0.68 1 85 GLU -5.15 3.89 1 86 ILE -3.86 2.61 1 87 MET -4.13 2.70 1 88 VAL -3.32 1.60 1 89 ALA -5.80 3.82 1 91 ASP -1.10 0.31 1 93 ASP 0.88 -0.83 1 94 TYR -4.80 2.13 1 95 PHE -2.34 2.06 1 96 LEU -1.95 1.18 1 97 ILE -1.23 0.68 1 98 VAL -2.84 1.82 1 99 ILE -0.53 0.32 1 100 GLN -6.15 4.35 1 101 ASN 1.23 -1.11 1 103 THR -0.22 0.38 1 104 GLU 0.17 1.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6396_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 0.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.39 _LACS_plot.Line_2_terminator_val_x_2 9.75 _LACS_plot.Line_2_terminator_val_y_2 -0.97 _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 47 THR 7.05 0.29 0 10 ALA 3.32 -0.17 1 11 GLU 3.40 -0.20 1 12 VAL 4.70 -0.37 1 13 GLU 3.94 -0.40 1 14 GLU 3.51 -0.29 1 15 THR 6.74 -0.45 1 16 LEU 4.91 -0.49 1 17 LYS 3.95 -0.29 1 18 ARG 3.99 -0.21 1 19 LEU 1.83 -0.21 1 20 GLN 2.92 -0.34 1 21 SER 0.01 0.05 1 22 GLN 0.19 -0.04 1 23 LYS 2.03 -0.13 1 25 VAL 3.64 -0.25 1 26 GLN -0.03 0.09 1 28 ILE -4.49 1.02 1 29 ILE -4.66 0.53 1 30 VAL -1.15 0.81 1 31 VAL -5.46 1.13 1 32 ASN -1.49 0.48 1 33 THR 5.08 -0.24 1 34 GLU -0.02 0.06 1 36 ILE -0.89 -0.13 1 38 ILE -0.26 0.02 1 39 LYS -3.62 0.21 1 40 SER -3.79 1.04 1 41 THR 1.19 0.33 1 42 MET -3.67 0.34 1 43 ASP -0.26 -0.10 1 44 ASN 9.76 -0.39 1 46 THR 7.55 -0.28 1 48 THR 6.13 -0.55 1 49 GLN 3.95 -0.14 1 50 TYR 5.00 -0.52 1 51 ALA 4.86 -0.40 1 52 ASN 3.51 -0.11 1 53 LEU 2.51 -0.11 1 54 MET 2.34 0.33 1 55 HIS 4.97 -0.48 1 56 ASN 3.63 -0.46 1 57 PHE 3.36 -0.38 1 58 ILE 5.42 -0.89 1 59 LEU 4.38 -0.42 1 60 LYS 2.74 -0.07 1 61 ALA 3.03 -0.72 1 62 ARG 4.92 -0.53 1 63 SER 4.51 -0.32 1 64 THR 7.20 -0.50 1 65 VAL 5.71 -0.58 1 66 ARG 2.48 0.05 1 67 GLU 2.59 -0.37 1 68 ILE 2.93 -0.58 1 69 ASP -3.16 0.01 1 71 GLN 0.35 0.12 1 72 ASN -4.59 0.14 1 73 ASP -4.06 0.13 1 74 LEU -2.29 -0.14 1 75 THR 1.65 0.25 1 76 PHE -1.33 0.43 1 77 LEU -5.78 1.05 1 78 ARG -4.71 1.18 1 79 ILE -2.71 0.51 1 80 ARG -1.45 0.59 1 81 SER -4.34 1.03 1 82 LYS 3.68 -0.16 1 83 LYS -1.59 0.07 1 84 ASN -1.01 -0.06 1 85 GLU -5.15 0.93 1 86 ILE -3.86 0.91 1 87 MET -4.13 0.91 1 88 VAL -3.32 1.26 1 89 ALA -5.80 0.66 1 91 ASP -1.10 -0.01 1 92 LYS 5.43 -0.55 1 93 ASP 0.88 -0.01 1 94 TYR -4.80 0.65 1 95 PHE -2.34 0.40 1 96 LEU -1.95 0.61 1 97 ILE -1.23 0.75 1 98 VAL -2.84 0.56 1 99 ILE -0.53 0.58 1 100 GLN -6.15 0.95 1 101 ASN 1.23 -0.09 1 103 THR -0.22 -0.03 1 104 GLU 0.17 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6396_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 -2.85 _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 -1.01 _LACS_plot.Line_2_terminator_val_x_2 7.55 _LACS_plot.Line_2_terminator_val_y_2 2.73 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 SER -3.79 0.77 0 32 ASN -1.49 1.99 0 64 THR 7.20 0.45 0 10 ALA 3.32 2.13 1 11 GLU 3.40 2.42 1 12 VAL 4.70 1.28 1 13 GLU 3.94 2.65 1 14 GLU 3.51 2.44 1 15 THR 6.74 1.25 1 16 LEU 4.91 0.91 1 17 LYS 3.95 2.82 1 18 ARG 3.99 3.29 1 19 LEU 1.83 1.07 1 20 GLN 2.92 0.44 1 21 SER 0.01 -0.39 1 22 GLN 0.19 0.00 1 23 LYS 2.03 1.22 1 25 VAL 3.64 0.01 1 26 GLN -0.03 0.81 1 28 ILE -4.49 -2.29 1 29 ILE -4.66 -2.29 1 30 VAL -1.15 -0.40 1 31 VAL -5.46 -1.21 1 33 THR 5.08 0.78 1 34 GLU -0.02 -0.58 1 38 ILE -0.26 -0.31 1 39 LYS -3.62 -2.52 1 41 THR 1.19 -0.35 1 42 MET -3.67 -1.08 1 43 ASP -0.26 1.29 1 46 THR 7.55 1.53 1 47 THR 7.05 0.89 1 48 THR 6.13 1.04 1 49 GLN 3.95 2.71 1 50 TYR 5.00 2.84 1 51 ALA 4.86 1.18 1 52 ASN 3.51 3.04 1 53 LEU 2.51 3.20 1 54 MET 2.34 2.04 1 55 HIS 4.97 1.80 1 56 ASN 3.63 2.26 1 57 PHE 3.36 1.21 1 58 ILE 5.42 1.00 1 59 LEU 4.38 2.72 1 60 LYS 2.74 2.74 1 61 ALA 3.03 0.54 1 62 ARG 4.92 1.72 1 63 SER 4.51 2.20 1 65 VAL 5.71 2.25 1 66 ARG 2.48 1.26 1 67 GLU 2.59 1.75 1 68 ILE 2.93 0.01 1 71 GLN 0.35 -0.48 1 72 ASN -4.59 -2.27 1 73 ASP -4.06 -1.63 1 74 LEU -2.29 -1.91 1 75 THR 1.65 0.11 1 76 PHE -1.33 -2.87 1 77 LEU -5.78 -3.59 1 78 ARG -4.71 -1.42 1 79 ILE -2.71 -2.00 1 80 ARG -1.45 -2.37 1 81 SER -4.34 -1.43 1 82 LYS 3.68 1.93 1 83 LYS -1.59 -0.38 1 84 ASN -1.01 -2.46 1 85 GLU -5.15 -2.79 1 86 ILE -3.86 -1.45 1 87 MET -4.13 -1.65 1 88 VAL -3.32 -2.38 1 91 ASP -1.10 -1.92 1 92 LYS 5.43 -0.18 1 93 ASP 0.88 -2.34 1 94 TYR -4.80 -0.64 1 95 PHE -2.34 -2.40 1 96 LEU -1.95 -2.60 1 97 ILE -1.23 -2.11 1 98 VAL -2.84 -1.84 1 99 ILE -0.53 -0.82 1 100 GLN -6.15 -1.81 1 103 THR -0.22 -0.96 1 stop_ save_