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 bmr18850_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.65 _LACS_plot.Line_1_terminator_val_y_1 -3.55 _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 -1.32 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 4.70 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 LEU 1.04 -1.47 0 25 PHE 1.61 -1.35 0 11 ASP 0.05 0.11 1 12 LYS 0.41 0.37 1 14 THR -4.76 -1.61 1 15 MET -3.81 -1.12 1 16 GLU -3.98 -1.12 1 17 LEU -6.52 -2.41 1 18 GLU -3.71 -2.13 1 19 LEU -2.98 -2.71 1 20 ARG -4.19 -2.04 1 21 PHE -3.35 -0.51 1 22 PHE -4.39 -0.49 1 23 ALA 2.14 0.90 1 24 THR 4.60 3.60 1 26 ARG 4.24 2.63 1 27 GLU 3.01 2.14 1 28 VAL 3.73 3.14 1 29 VAL 3.06 2.12 1 31 GLN -5.51 -1.82 1 32 LYS 2.93 2.65 1 33 SER -3.18 -1.70 1 34 ILE -4.81 -1.60 1 35 TYR -1.54 -0.64 1 36 TRP -8.65 -3.03 1 37 ARG -0.67 -0.74 1 38 VAL -6.99 -3.75 1 39 ASP 0.24 1.06 1 40 ASP 2.40 1.32 1 41 ASP -0.81 -1.84 1 42 ALA 0.63 0.90 1 43 THR -6.28 -2.62 1 44 VAL 6.25 5.42 1 46 ASP 3.39 3.49 1 47 VAL 5.87 4.59 1 48 LEU 4.78 3.28 1 49 ARG 4.36 4.26 1 50 SER 4.93 4.18 1 51 LEU 3.14 3.35 1 52 GLU 4.59 4.42 1 53 ALA 1.17 0.90 1 54 GLU -0.30 0.80 1 55 TYR -1.16 -1.48 1 56 ASP 4.02 3.17 1 58 LEU -0.48 -1.21 1 59 ALA 3.06 1.92 1 61 ARG -0.66 0.06 1 62 LEU 0.09 0.95 1 63 ILE -4.56 -1.89 1 64 GLU -4.58 -0.43 1 65 ASP 2.77 1.28 1 67 GLU -6.61 -3.08 1 68 VAL 3.80 2.24 1 69 LYS 0.24 0.98 1 71 HIS 4.44 3.32 1 72 VAL 2.20 1.18 1 73 ASN -3.10 -1.22 1 74 VAL -2.17 -1.50 1 75 LEU -4.25 -2.19 1 76 LYS -3.03 -1.48 1 77 ASN 3.07 1.40 1 79 ARG -3.06 -1.79 1 80 GLU 1.27 1.35 1 81 VAL 4.81 2.96 1 82 VAL 3.90 1.87 1 83 HIS -0.91 0.73 1 85 ASP -2.79 -1.15 1 87 MET 1.55 1.75 1 88 ALA 0.08 -0.59 1 89 THR 3.94 3.79 1 90 ALA -1.22 -0.37 1 91 LEU -5.99 -1.70 1 92 ASP -5.64 -1.22 1 93 ASP 1.05 2.26 1 95 ASP 0.34 1.53 1 96 ALA -4.65 -3.15 1 97 VAL -2.79 -2.12 1 98 SER -2.61 -1.33 1 99 VAL -0.83 -0.30 1 100 PHE -3.05 -1.44 1 103 VAL 0.70 0.34 1 104 ALA -0.15 0.01 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18850_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.65 _LACS_plot.Line_1_terminator_val_y_1 5.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 -1.55 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 LEU 1.04 -2.51 0 25 PHE 1.61 -2.96 0 11 ASP 0.05 0.06 1 12 LYS 0.41 -0.04 1 14 THR -4.76 3.15 1 15 MET -3.81 2.69 1 16 GLU -3.98 2.86 1 17 LEU -6.52 4.11 1 18 GLU -3.71 1.58 1 19 LEU -2.98 0.27 1 20 ARG -4.19 2.15 1 21 PHE -3.35 2.84 1 22 PHE -4.39 3.90 1 23 ALA 2.14 -1.24 1 24 THR 4.60 -1.00 1 26 ARG 4.24 -1.61 1 27 GLU 3.01 -0.87 1 28 VAL 3.73 -0.59 1 29 VAL 3.06 -0.94 1 31 GLN -5.51 3.69 1 32 LYS 2.93 -0.28 1 33 SER -3.18 1.48 1 34 ILE -4.81 3.21 1 35 TYR -1.54 0.90 1 36 TRP -8.65 5.62 1 37 ARG -0.67 -0.07 1 38 VAL -6.99 3.24 1 39 ASP 0.24 0.82 1 40 ASP 2.40 -1.08 1 41 ASP -0.81 -1.03 1 42 ALA 0.63 0.27 1 43 THR -6.28 3.66 1 44 VAL 6.25 -0.83 1 46 ASP 3.39 0.10 1 47 VAL 5.87 -1.28 1 48 LEU 4.78 -1.50 1 49 ARG 4.36 -0.10 1 50 SER 4.93 -0.75 1 51 LEU 3.14 0.21 1 52 GLU 4.59 -0.17 1 53 ALA 1.17 -0.27 1 54 GLU -0.30 1.10 1 55 TYR -1.16 -0.32 1 56 ASP 4.02 -0.85 1 58 LEU -0.48 -0.73 1 59 ALA 3.06 -1.14 1 61 ARG -0.66 0.72 1 62 LEU 0.09 0.86 1 63 ILE -4.56 2.67 1 64 GLU -4.58 4.15 1 65 ASP 2.77 -1.49 1 67 GLU -6.61 3.53 1 68 VAL 3.80 -1.56 1 69 LYS 0.24 0.74 1 71 HIS 4.44 -1.12 1 72 VAL 2.20 -1.02 1 73 ASN -3.10 1.88 1 74 VAL -2.17 0.67 1 75 LEU -4.25 2.06 1 76 LYS -3.03 1.55 1 77 ASN 3.07 -1.67 1 79 ARG -3.06 1.27 1 80 GLU 1.27 0.08 1 81 VAL 4.81 -1.85 1 82 VAL 3.90 -2.03 1 83 HIS -0.91 1.64 1 85 ASP -2.79 1.64 1 87 MET 1.55 0.20 1 88 ALA 0.08 -0.67 1 89 THR 3.94 -0.15 1 90 ALA -1.22 0.85 1 91 LEU -5.99 4.29 1 92 ASP -5.64 4.42 1 93 ASP 1.05 1.21 1 95 ASP 0.34 1.19 1 96 ALA -4.65 1.50 1 97 VAL -2.79 0.67 1 98 SER -2.61 1.28 1 99 VAL -0.83 0.53 1 100 PHE -3.05 1.61 1 103 VAL 0.70 -0.36 1 104 ALA -0.15 0.16 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18850_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.65 _LACS_plot.Line_1_terminator_val_y_1 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 36 TRP -8.65 0.59 0 37 ARG -0.67 1.07 0 96 ALA -4.65 1.44 0 11 ASP 0.05 -0.40 1 12 LYS 0.41 -0.04 1 14 THR -4.76 0.79 1 15 MET -3.81 0.33 1 16 GLU -3.98 0.91 1 17 LEU -6.52 0.77 1 18 GLU -3.71 0.11 1 19 LEU -2.98 0.66 1 20 ARG -4.19 0.57 1 21 PHE -3.35 0.31 1 22 PHE -4.39 -0.11 1 23 ALA 2.14 -0.27 1 24 THR 4.60 -0.30 1 25 PHE 1.61 0.06 1 26 ARG 4.24 -0.69 1 27 GLU 3.01 -0.44 1 28 VAL 3.73 -0.45 1 29 VAL 3.06 -0.88 1 31 GLN -5.51 0.20 1 32 LYS 2.93 -0.33 1 33 SER -3.18 1.19 1 34 ILE -4.81 0.36 1 35 TYR -1.54 0.97 1 38 VAL -6.99 0.60 1 39 ASP 0.24 0.07 1 40 ASP 2.40 -0.26 1 41 ASP -0.81 0.10 1 42 ALA 0.63 0.10 1 43 THR -6.28 0.58 1 44 VAL 6.25 -0.68 1 46 ASP 3.39 -0.23 1 47 VAL 5.87 -0.35 1 48 LEU 4.78 -0.35 1 49 ARG 4.36 -0.48 1 50 SER 4.93 -0.08 1 51 LEU 3.14 -0.11 1 52 GLU 4.59 -0.63 1 53 ALA 1.17 -0.10 1 54 GLU -0.30 -0.23 1 55 TYR -1.16 0.09 1 56 ASP 4.02 -0.22 1 58 LEU -0.48 -0.02 1 59 ALA 3.06 -0.39 1 61 ARG -0.66 0.13 1 62 LEU 0.09 0.35 1 63 ILE -4.56 0.52 1 64 GLU -4.58 0.15 1 65 ASP 2.77 -0.35 1 67 GLU -6.61 0.44 1 68 VAL 3.80 -0.29 1 69 LYS 0.24 -0.50 1 71 HIS 4.44 -0.59 1 72 VAL 2.20 0.01 1 73 ASN -3.10 0.45 1 74 VAL -2.17 1.13 1 75 LEU -4.25 0.91 1 76 LYS -3.03 0.56 1 77 ASN 3.07 -0.25 1 79 ARG -3.06 0.35 1 80 GLU 1.27 0.06 1 81 VAL 4.81 -0.03 1 82 VAL 3.90 -0.11 1 83 HIS -0.91 0.17 1 84 LEU 1.04 0.40 1 85 ASP -2.79 0.59 1 87 MET 1.55 -0.54 1 88 ALA 0.08 0.11 1 89 THR 3.94 -0.43 1 90 ALA -1.22 -0.09 1 91 LEU -5.99 0.28 1 92 ASP -5.64 0.40 1 93 ASP 1.05 -0.32 1 95 ASP 0.34 0.20 1 97 VAL -2.79 1.06 1 98 SER -2.61 0.90 1 99 VAL -0.83 0.72 1 100 PHE -3.05 0.34 1 103 VAL 0.70 -0.12 1 104 ALA -0.15 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18850_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.65 _LACS_plot.Line_1_terminator_val_y_1 -3.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 6.25 _LACS_plot.Line_2_terminator_val_y_2 1.91 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 THR -6.28 2.37 0 11 ASP 0.05 -0.04 1 12 LYS 0.41 0.54 1 14 THR -4.76 -1.35 1 15 MET -3.81 -4.01 1 16 GLU -3.98 -1.78 1 17 LEU -6.52 -2.17 1 18 GLU -3.71 -2.65 1 19 LEU -2.98 -2.73 1 20 ARG -4.19 -2.21 1 21 PHE -3.35 -0.62 1 22 PHE -4.39 -1.53 1 24 THR 4.60 2.12 1 25 PHE 1.61 1.55 1 26 ARG 4.24 1.81 1 27 GLU 3.01 1.76 1 28 VAL 3.73 0.95 1 29 VAL 3.06 0.77 1 31 GLN -5.51 -2.56 1 32 LYS 2.93 -0.72 1 33 SER -3.18 -1.31 1 34 ILE -4.81 -3.01 1 35 TYR -1.54 0.03 1 36 TRP -8.65 -1.31 1 37 ARG -0.67 -0.37 1 38 VAL -6.99 -1.89 1 39 ASP 0.24 0.61 1 40 ASP 2.40 -1.02 1 41 ASP -0.81 0.61 1 42 ALA 0.63 -0.43 1 44 VAL 6.25 0.89 1 46 ASP 3.39 3.00 1 47 VAL 5.87 1.77 1 48 LEU 4.78 1.28 1 49 ARG 4.36 3.98 1 50 SER 4.93 2.41 1 51 LEU 3.14 1.04 1 52 GLU 4.59 0.35 1 53 ALA 1.17 1.10 1 54 GLU -0.30 -0.21 1 55 TYR -1.16 -0.44 1 56 ASP 4.02 2.95 1 58 LEU -0.48 -1.14 1 59 ALA 3.06 1.24 1 61 ARG -0.66 -0.90 1 62 LEU 0.09 -1.11 1 63 ILE -4.56 -0.31 1 64 GLU -4.58 -1.48 1 65 ASP 2.77 -0.31 1 67 GLU -6.61 -1.97 1 68 VAL 3.80 0.87 1 69 LYS 0.24 -0.97 1 71 HIS 4.44 0.26 1 72 VAL 2.20 -0.95 1 73 ASN -3.10 -1.61 1 74 VAL -2.17 -1.41 1 75 LEU -4.25 -1.73 1 76 LYS -3.03 -0.46 1 77 ASN 3.07 0.29 1 79 ARG -3.06 -0.97 1 80 GLU 1.27 2.71 1 81 VAL 4.81 2.72 1 82 VAL 3.90 -0.20 1 83 HIS -0.91 0.93 1 84 LEU 1.04 -2.48 1 85 ASP -2.79 0.51 1 87 MET 1.55 0.24 1 88 ALA 0.08 -1.60 1 89 THR 3.94 -1.91 1 90 ALA -1.22 -1.58 1 91 LEU -5.99 -4.16 1 92 ASP -5.64 -1.67 1 93 ASP 1.05 1.36 1 95 ASP 0.34 -2.22 1 96 ALA -4.65 0.09 1 97 VAL -2.79 -1.31 1 98 SER -2.61 -1.44 1 99 VAL -0.83 -2.35 1 100 PHE -3.05 -0.90 1 103 VAL 0.70 -0.10 1 104 ALA -0.15 0.08 1 stop_ save_