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 bmr11399_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.52 _LACS_plot.Line_2_terminator_val_x_2 7.25 _LACS_plot.Line_2_terminator_val_y_2 5.76 _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 19 HIS -7.47 -1.65 0 22 LYS 4.29 0.46 0 53 GLN -8.50 -2.15 0 10 MET 0.11 -0.08 1 11 ASP 0.15 0.35 1 13 ALA -0.74 -0.41 1 15 SER -4.48 -2.95 1 16 ARG 1.93 1.41 1 17 VAL 0.80 -0.79 1 18 LEU -2.86 -1.98 1 20 ILE -0.89 -1.38 1 21 ARG -5.17 -1.63 1 23 LEU 0.45 0.45 1 26 GLU 1.08 0.13 1 27 VAL 0.22 -0.18 1 28 THR -4.27 -1.70 1 29 GLU 4.07 4.01 1 30 THR 5.54 4.67 1 31 GLU 1.20 2.50 1 32 VAL 5.52 3.93 1 33 ILE 5.08 5.04 1 34 ALA 3.02 2.18 1 35 LEU 1.05 1.83 1 37 LEU 6.24 4.80 1 39 PHE 0.32 0.74 1 41 LYS 0.19 0.19 1 42 VAL 0.31 -0.12 1 43 THR 2.38 0.82 1 44 ASN -3.82 -0.05 1 45 ILE -4.63 -2.22 1 46 LEU -4.39 -0.94 1 47 MET -0.79 -1.06 1 48 LEU 0.20 -1.55 1 49 LYS 3.97 2.97 1 51 LYS -2.22 -1.44 1 52 ASN 3.91 1.42 1 54 ALA -6.43 -1.35 1 55 PHE -4.30 -1.70 1 56 LEU -6.58 -1.53 1 57 GLU -6.07 -1.85 1 58 LEU -3.90 -1.96 1 59 ALA 1.43 2.53 1 60 THR -6.52 -3.70 1 61 GLU 3.30 3.37 1 62 GLU 4.73 3.90 1 63 ALA 2.04 2.61 1 64 ALA 2.35 3.28 1 65 ILE 2.38 2.89 1 66 THR 6.34 5.10 1 67 MET 5.07 4.07 1 68 VAL 7.25 5.28 1 69 ASN 4.53 3.07 1 70 TYR 4.52 4.39 1 71 TYR 3.40 1.62 1 72 SER 2.61 2.09 1 73 ALA -1.03 0.24 1 74 VAL -1.55 -1.32 1 75 THR 1.07 1.54 1 77 HIS -5.34 -0.20 1 78 LEU -5.43 -0.84 1 79 ARG 4.42 0.83 1 80 ASN 2.70 1.68 1 81 GLN -3.07 -1.21 1 83 ILE -3.51 -2.11 1 84 TYR -3.86 -1.18 1 85 ILE -2.01 -0.22 1 86 GLN -6.51 -2.31 1 87 TYR 1.51 1.66 1 88 SER -2.52 -1.17 1 89 ASN 1.24 0.72 1 90 HIS -0.67 1.40 1 91 LYS 0.69 0.53 1 92 GLU -3.33 -1.50 1 93 LEU -0.91 -0.86 1 94 LYS -0.23 -0.28 1 95 THR 0.01 -0.08 1 96 SER -0.13 0.17 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11399_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 5.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.48 _LACS_plot.Line_2_terminator_val_x_2 7.25 _LACS_plot.Line_2_terminator_val_y_2 -1.49 _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 19 HIS -7.47 5.82 0 22 LYS 4.29 -3.83 0 53 GLN -8.50 6.35 0 10 MET 0.11 -0.19 1 11 ASP 0.15 0.20 1 13 ALA -0.74 0.33 1 15 SER -4.48 1.53 1 16 ARG 1.93 -0.52 1 17 VAL 0.80 -1.59 1 18 LEU -2.86 0.88 1 20 ILE -0.89 -0.49 1 21 ARG -5.17 3.54 1 23 LEU 0.45 0.00 1 26 GLU 1.08 -0.95 1 27 VAL 0.22 -0.40 1 28 THR -4.27 2.57 1 29 GLU 4.07 -0.06 1 30 THR 5.54 -0.87 1 31 GLU 1.20 1.30 1 32 VAL 5.52 -1.59 1 33 ILE 5.08 -0.04 1 34 ALA 3.02 -0.84 1 35 LEU 1.05 0.78 1 37 LEU 6.24 -1.44 1 39 PHE 0.32 0.42 1 41 LYS 0.19 0.00 1 42 VAL 0.31 -0.43 1 43 THR 2.38 -1.56 1 44 ASN -3.82 3.77 1 45 ILE -4.63 2.41 1 46 LEU -4.39 3.45 1 47 MET -0.79 -0.27 1 48 LEU 0.20 -1.75 1 49 LYS 3.97 -1.00 1 51 LYS -2.22 0.78 1 52 ASN 3.91 -2.49 1 54 ALA -6.43 5.08 1 55 PHE -4.30 2.60 1 56 LEU -6.58 5.05 1 57 GLU -6.07 4.22 1 58 LEU -3.90 1.94 1 59 ALA 1.43 1.10 1 60 THR -6.52 2.82 1 61 GLU 3.30 0.07 1 62 GLU 4.73 -0.83 1 63 ALA 2.04 0.57 1 64 ALA 2.35 0.93 1 65 ILE 2.38 0.51 1 66 THR 6.34 -1.24 1 67 MET 5.07 -1.00 1 68 VAL 7.25 -1.97 1 69 ASN 4.53 -1.46 1 70 TYR 4.52 -0.13 1 71 TYR 3.40 -1.78 1 72 SER 2.61 -0.52 1 73 ALA -1.03 1.27 1 74 VAL -1.55 0.23 1 75 THR 1.07 0.47 1 77 HIS -5.34 5.14 1 78 LEU -5.43 4.59 1 79 ARG 4.42 -3.59 1 80 ASN 2.70 -1.02 1 81 GLN -3.07 1.86 1 83 ILE -3.51 1.40 1 84 TYR -3.86 2.68 1 85 ILE -2.01 1.79 1 86 GLN -6.51 4.20 1 87 TYR 1.51 0.15 1 88 SER -2.52 1.35 1 89 ASN 1.24 -0.52 1 90 HIS -0.67 2.07 1 91 LYS 0.69 -0.16 1 92 GLU -3.33 1.83 1 93 LEU -0.91 0.05 1 94 LYS -0.23 -0.05 1 95 THR 0.01 -0.09 1 96 SER -0.13 0.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11399_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 7.25 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _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 67 MET 5.07 -2.22 0 10 MET 0.11 0.01 1 11 ASP 0.15 -0.04 1 13 ALA -0.74 -0.15 1 15 SER -4.48 0.08 1 16 ARG 1.93 -0.07 1 17 VAL 0.80 0.51 1 18 LEU -2.86 0.61 1 19 HIS -7.47 0.32 1 20 ILE -0.89 0.58 1 21 ARG -5.17 0.46 1 22 LYS 4.29 -0.56 1 23 LEU 0.45 -0.65 1 26 GLU 1.08 -0.16 1 27 VAL 0.22 0.01 1 28 THR -4.27 0.32 1 29 GLU 4.07 -0.41 1 30 THR 5.54 -0.54 1 31 GLU 1.20 -0.38 1 32 VAL 5.52 -0.59 1 33 ILE 5.08 -0.65 1 34 ALA 3.02 -0.32 1 35 LEU 1.05 -0.09 1 37 LEU 6.24 0.01 1 39 PHE 0.32 -0.27 1 41 LYS 0.19 -0.14 1 42 VAL 0.31 0.42 1 43 THR 2.38 -0.09 1 44 ASN -3.82 0.12 1 45 ILE -4.63 0.85 1 46 LEU -4.39 0.36 1 47 MET -0.79 0.18 1 48 LEU 0.20 0.31 1 49 LYS 3.97 -0.27 1 51 LYS -2.22 0.29 1 52 ASN 3.91 -0.32 1 53 GLN -8.50 0.94 1 54 ALA -6.43 0.73 1 55 PHE -4.30 1.14 1 56 LEU -6.58 0.46 1 57 GLU -6.07 0.86 1 58 LEU -3.90 0.94 1 59 ALA 1.43 -0.33 1 60 THR -6.52 0.37 1 61 GLU 3.30 -0.61 1 62 GLU 4.73 -0.40 1 63 ALA 2.04 -0.15 1 64 ALA 2.35 -0.38 1 65 ILE 2.38 0.36 1 66 THR 6.34 -0.49 1 68 VAL 7.25 -0.84 1 69 ASN 4.53 -0.38 1 70 TYR 4.52 -0.47 1 71 TYR 3.40 0.70 1 72 SER 2.61 0.01 1 73 ALA -1.03 0.15 1 74 VAL -1.55 -0.04 1 75 THR 1.07 -0.10 1 77 HIS -5.34 0.53 1 78 LEU -5.43 0.18 1 79 ARG 4.42 -0.47 1 80 ASN 2.70 -0.66 1 81 GLN -3.07 0.32 1 83 ILE -3.51 0.43 1 84 TYR -3.86 0.26 1 85 ILE -2.01 0.36 1 86 GLN -6.51 0.19 1 87 TYR 1.51 0.14 1 88 SER -2.52 0.35 1 89 ASN 1.24 -0.12 1 90 HIS -0.67 -0.27 1 91 LYS 0.69 0.01 1 92 GLU -3.33 -0.11 1 93 LEU -0.91 -0.14 1 94 LYS -0.23 0.02 1 95 THR 0.01 -0.02 1 96 SER -0.13 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11399_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.32 _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 7.25 _LACS_plot.Line_2_terminator_val_y_2 2.22 _LACS_plot.Y_axis_chem_shift_offset 0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 GLN -8.50 -1.81 0 77 HIS -5.34 0.58 0 19 HIS -7.47 -0.61 0 45 ILE -4.63 -4.58 0 56 LEU -6.58 -4.82 0 10 MET 0.11 -0.31 1 11 ASP 0.15 0.32 1 16 ARG 1.93 -2.00 1 17 VAL 0.80 -1.41 1 18 LEU -2.86 -2.29 1 20 ILE -0.89 -1.78 1 21 ARG -5.17 -2.18 1 22 LYS 4.29 -1.27 1 23 LEU 0.45 0.02 1 26 GLU 1.08 -0.90 1 27 VAL 0.22 -1.98 1 28 THR -4.27 0.99 1 29 GLU 4.07 2.08 1 30 THR 5.54 1.67 1 31 GLU 1.20 0.85 1 32 VAL 5.52 1.48 1 33 ILE 5.08 2.15 1 34 ALA 3.02 1.80 1 35 LEU 1.05 2.13 1 37 LEU 6.24 -0.08 1 39 PHE 0.32 -0.28 1 41 LYS 0.19 -0.65 1 42 VAL 0.31 0.74 1 43 THR 2.38 0.80 1 44 ASN -3.82 -2.93 1 46 LEU -4.39 -2.48 1 47 MET -0.79 -0.80 1 48 LEU 0.20 -0.81 1 49 LYS 3.97 2.31 1 51 LYS -2.22 -0.53 1 52 ASN 3.91 -1.15 1 54 ALA -6.43 -3.02 1 55 PHE -4.30 -1.87 1 57 GLU -6.07 -2.06 1 58 LEU -3.90 1.16 1 59 ALA 1.43 -0.04 1 60 THR -6.52 -0.92 1 61 GLU 3.30 0.99 1 62 GLU 4.73 2.41 1 63 ALA 2.04 0.74 1 64 ALA 2.35 0.94 1 65 ILE 2.38 2.65 1 66 THR 6.34 1.83 1 67 MET 5.07 0.54 1 68 VAL 7.25 3.26 1 69 ASN 4.53 3.62 1 70 TYR 4.52 2.17 1 71 TYR 3.40 -0.21 1 72 SER 2.61 -0.19 1 73 ALA -1.03 -0.74 1 74 VAL -1.55 -1.99 1 75 THR 1.07 0.20 1 78 LEU -5.43 -1.57 1 79 ARG 4.42 -0.26 1 80 ASN 2.70 -1.27 1 81 GLN -3.07 -1.86 1 83 ILE -3.51 -2.78 1 84 TYR -3.86 -1.83 1 85 ILE -2.01 -2.85 1 86 GLN -6.51 -1.28 1 87 TYR 1.51 0.99 1 88 SER -2.52 -0.72 1 89 ASN 1.24 0.50 1 90 HIS -0.67 1.51 1 91 LYS 0.69 -0.52 1 92 GLU -3.33 -1.77 1 93 LEU -0.91 -1.42 1 94 LYS -0.23 -0.03 1 95 THR 0.01 -0.17 1 96 SER -0.13 -0.23 1 stop_ save_