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 bmr10025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 4.47 _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 51 HIS -2.29 1.93 0 101 LYS 1.68 -0.89 0 10 THR -1.41 -0.44 1 13 MET 0.32 0.45 1 14 LYS 0.01 0.50 1 15 THR -0.28 -0.13 1 16 THR -3.38 -1.48 1 17 SER -1.84 -0.47 1 18 SER -0.21 -0.11 1 19 MET -0.49 1.12 1 20 ASP -0.96 0.66 1 22 SER 5.81 4.43 1 23 ASP 3.87 3.19 1 24 MET 4.72 4.54 1 25 MET 4.01 1.55 1 26 ARG 5.03 4.14 1 27 GLU 3.04 1.96 1 28 ILE 5.37 4.91 1 29 ARG 5.62 5.15 1 30 LYS 4.48 3.75 1 31 VAL 5.00 4.35 1 32 LEU 4.20 3.72 1 34 ALA 2.21 1.76 1 35 ASN -1.18 1.02 1 36 ASN 3.54 1.95 1 38 ASP -2.07 -0.42 1 39 TYR -5.26 -2.30 1 40 GLU -6.07 -2.13 1 41 GLN 1.80 0.44 1 42 ARG 0.11 1.25 1 43 GLU -6.11 -2.17 1 44 ARG 5.11 4.39 1 45 PHE -2.27 -2.32 1 46 LEU -4.92 0.04 1 47 LEU -5.62 -2.02 1 48 PHE -2.06 -0.15 1 50 VAL -4.81 -1.72 1 53 ASP -2.10 -1.07 1 55 HIS 0.83 0.33 1 56 ALA 3.12 2.69 1 57 GLU 2.67 1.43 1 58 ASN -0.42 -0.61 1 59 LEU 1.35 1.25 1 60 VAL -4.21 -1.42 1 61 GLN -4.92 -1.99 1 62 TRP -4.11 -0.11 1 63 GLU -6.67 -2.82 1 64 MET -4.88 -0.72 1 65 GLU -8.53 -3.10 1 66 VAL -0.18 -0.46 1 68 LYS 0.17 0.14 1 69 LEU 0.46 -0.44 1 71 ARG 3.37 2.04 1 72 LEU -2.79 -0.75 1 73 SER 1.88 0.11 1 74 LEU -6.18 -1.67 1 75 ASN -4.20 -0.76 1 77 VAL -1.94 -1.21 1 78 ARG -4.86 -1.66 1 79 PHE -4.88 -1.07 1 80 LYS -3.57 -0.80 1 81 ARG 3.57 2.59 1 82 ILE 0.33 -0.29 1 83 SER -1.82 -0.13 1 85 THR -0.59 0.00 1 87 ILE 3.01 2.44 1 88 ALA 3.42 2.81 1 89 PHE 3.29 2.62 1 90 LYS 4.72 3.45 1 91 ASN 4.03 2.99 1 92 ILE -0.38 -1.31 1 93 ALA 4.60 2.30 1 94 SER 4.28 3.13 1 95 LYS 3.23 3.50 1 96 ILE 4.09 2.11 1 97 ALA 4.02 3.20 1 98 ASN 2.12 2.14 1 99 GLU -0.66 0.16 1 100 LEU 0.27 0.37 1 102 LEU -1.80 -0.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 5.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _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 51 HIS -2.29 4.22 0 101 LYS 1.68 -2.57 0 10 THR -1.41 0.97 1 13 MET 0.32 0.13 1 14 LYS 0.01 0.49 1 15 THR -0.28 0.15 1 16 THR -3.38 1.90 1 17 SER -1.84 1.37 1 18 SER -0.21 0.10 1 19 MET -0.49 1.61 1 20 ASP -0.96 1.62 1 22 SER 5.81 -1.38 1 23 ASP 3.87 -0.68 1 24 MET 4.72 -0.18 1 25 MET 4.01 -2.46 1 26 ARG 5.03 -0.89 1 27 GLU 3.04 -1.08 1 28 ILE 5.37 -0.46 1 29 ARG 5.62 -0.47 1 30 LYS 4.48 -0.73 1 31 VAL 5.00 -0.65 1 32 LEU 4.20 -0.48 1 34 ALA 2.21 -0.45 1 35 ASN -1.18 2.20 1 36 ASN 3.54 -1.59 1 38 ASP -2.07 1.65 1 39 TYR -5.26 2.96 1 40 GLU -6.07 3.94 1 41 GLN 1.80 -1.36 1 42 ARG 0.11 1.14 1 43 GLU -6.11 3.94 1 44 ARG 5.11 -0.72 1 45 PHE -2.27 -0.05 1 46 LEU -4.92 4.96 1 47 LEU -5.62 3.60 1 48 PHE -2.06 1.91 1 50 VAL -4.81 3.09 1 53 ASP -2.10 1.03 1 55 HIS 0.83 -0.50 1 56 ALA 3.12 -0.43 1 57 GLU 2.67 -1.24 1 58 ASN -0.42 -0.19 1 59 LEU 1.35 -0.10 1 60 VAL -4.21 2.79 1 61 GLN -4.92 2.93 1 62 TRP -4.11 4.00 1 63 GLU -6.67 3.85 1 64 MET -4.88 4.16 1 65 GLU -8.53 5.43 1 66 VAL -0.18 -0.28 1 68 LYS 0.17 -0.03 1 69 LEU 0.46 -0.90 1 71 ARG 3.37 -1.33 1 72 LEU -2.79 2.04 1 73 SER 1.88 -1.77 1 74 LEU -6.18 4.51 1 75 ASN -4.20 3.44 1 77 VAL -1.94 0.73 1 78 ARG -4.86 3.20 1 79 PHE -4.88 3.81 1 80 LYS -3.57 2.77 1 81 ARG 3.57 -0.98 1 82 ILE 0.33 -0.62 1 83 SER -1.82 1.69 1 85 THR -0.59 0.59 1 87 ILE 3.01 -0.57 1 88 ALA 3.42 -0.61 1 89 PHE 3.29 -0.67 1 90 LYS 4.72 -1.27 1 91 ASN 4.03 -1.04 1 92 ILE -0.38 -0.93 1 93 ALA 4.60 -2.30 1 94 SER 4.28 -1.15 1 95 LYS 3.23 0.27 1 96 ILE 4.09 -1.98 1 97 ALA 4.02 -0.82 1 98 ASN 2.12 0.02 1 99 GLU -0.66 0.82 1 100 LEU 0.27 0.10 1 102 LEU -1.80 1.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 1.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 40 GLU -6.07 0.28 0 74 LEU -6.18 0.28 0 43 GLU -6.11 0.18 0 10 THR -1.41 0.31 1 13 MET 0.32 0.08 1 14 LYS 0.01 0.23 1 15 THR -0.28 0.24 1 16 THR -3.38 0.75 1 17 SER -1.84 0.26 1 18 SER -0.21 0.25 1 19 MET -0.49 -0.37 1 20 ASP -0.96 -0.27 1 22 SER 5.81 -0.09 1 23 ASP 3.87 -0.03 1 24 MET 4.72 -0.58 1 25 MET 4.01 -0.13 1 26 ARG 5.03 -0.36 1 27 GLU 3.04 -0.09 1 28 ILE 5.37 -0.72 1 29 ARG 5.62 -0.99 1 30 LYS 4.48 -0.23 1 31 VAL 5.00 -0.29 1 32 LEU 4.20 -0.22 1 34 ALA 2.21 0.05 1 35 ASN -1.18 0.07 1 36 ASN 3.54 -0.11 1 38 ASP -2.07 0.19 1 39 TYR -5.26 1.27 1 41 GLN 1.80 0.36 1 42 ARG 0.11 0.07 1 44 ARG 5.11 -0.69 1 45 PHE -2.27 0.75 1 46 LEU -4.92 1.05 1 47 LEU -5.62 0.88 1 48 PHE -2.06 0.28 1 50 VAL -4.81 1.00 1 51 HIS -2.29 0.43 1 53 ASP -2.10 0.07 1 55 HIS 0.83 0.08 1 56 ALA 3.12 -0.15 1 57 GLU 2.67 -0.02 1 58 ASN -0.42 0.16 1 59 LEU 1.35 0.53 1 60 VAL -4.21 0.80 1 61 GLN -4.92 1.49 1 62 TRP -4.11 0.71 1 63 GLU -6.67 1.15 1 64 MET -4.88 1.10 1 65 GLU -8.53 1.32 1 66 VAL -0.18 0.81 1 68 LYS 0.17 0.38 1 69 LEU 0.46 0.04 1 71 ARG 3.37 -0.23 1 72 LEU -2.79 0.17 1 73 SER 1.88 -0.23 1 75 ASN -4.20 0.72 1 77 VAL -1.94 0.77 1 78 ARG -4.86 1.08 1 79 PHE -4.88 1.24 1 80 LYS -3.57 0.46 1 81 ARG 3.57 -0.80 1 82 ILE 0.33 0.17 1 83 SER -1.82 0.29 1 85 THR -0.59 0.05 1 87 ILE 3.01 -0.24 1 88 ALA 3.42 -0.19 1 89 PHE 3.29 -0.52 1 90 LYS 4.72 -1.08 1 91 ASN 4.03 -0.48 1 92 ILE -0.38 -0.01 1 93 ALA 4.60 -1.18 1 94 SER 4.28 -0.72 1 95 LYS 3.23 -0.38 1 96 ILE 4.09 -0.70 1 97 ALA 4.02 -0.34 1 98 ASN 2.12 -0.23 1 99 GLU -0.66 -0.14 1 100 LEU 0.27 -0.11 1 101 LYS 1.68 0.17 1 102 LEU -1.80 0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10025_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.53 _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 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.00 _LACS_plot.Line_2_terminator_val_x_2 5.80 _LACS_plot.Line_2_terminator_val_y_2 2.17 _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 102 LEU -1.80 4.24 0 10 THR -1.41 -0.62 1 14 LYS 0.01 -0.23 1 15 THR -0.28 -1.56 1 16 THR -3.38 -0.84 1 17 SER -1.84 -0.25 1 18 SER -0.21 0.09 1 19 MET -0.49 -2.08 1 20 ASP -0.96 1.62 1 22 SER 5.81 3.09 1 23 ASP 3.87 2.96 1 24 MET 4.72 1.93 1 25 MET 4.01 1.79 1 26 ARG 5.03 2.81 1 27 GLU 3.04 1.81 1 28 ILE 5.37 1.23 1 29 ARG 5.62 3.01 1 30 LYS 4.48 2.84 1 31 VAL 5.00 3.44 1 32 LEU 4.20 2.99 1 34 ALA 2.21 0.56 1 35 ASN -1.18 -1.88 1 36 ASN 3.54 -0.26 1 38 ASP -2.07 -1.19 1 39 TYR -5.26 -1.82 1 40 GLU -6.07 -1.10 1 41 GLN 1.80 -0.64 1 42 ARG 0.11 -0.26 1 43 GLU -6.11 -0.19 1 44 ARG 5.11 0.15 1 45 PHE -2.27 -2.29 1 46 LEU -4.92 -2.49 1 47 LEU -5.62 -2.62 1 48 PHE -2.06 -1.28 1 50 VAL -4.81 -1.63 1 51 HIS -2.29 -1.60 1 53 ASP -2.10 0.73 1 55 HIS 0.83 1.96 1 56 ALA 3.12 0.99 1 57 GLU 2.67 0.79 1 58 ASN -0.42 -1.23 1 59 LEU 1.35 0.15 1 60 VAL -4.21 -2.36 1 61 GLN -4.92 0.37 1 62 TRP -4.11 -4.60 1 63 GLU -6.67 0.90 1 64 MET -4.88 -3.17 1 65 GLU -8.53 -1.08 1 66 VAL -0.18 -1.16 1 68 LYS 0.17 0.20 1 69 LEU 0.46 -0.25 1 71 ARG 3.37 0.05 1 72 LEU -2.79 -1.12 1 73 SER 1.88 -0.84 1 74 LEU -6.18 -2.86 1 75 ASN -4.20 -0.66 1 77 VAL -1.94 -1.67 1 78 ARG -4.86 -1.16 1 79 PHE -4.88 0.24 1 80 LYS -3.57 -1.80 1 81 ARG 3.57 -1.74 1 82 ILE 0.33 -0.46 1 83 SER -1.82 -1.80 1 85 THR -0.59 0.87 1 87 ILE 3.01 0.32 1 88 ALA 3.42 4.06 1 89 PHE 3.29 -1.18 1 90 LYS 4.72 2.86 1 91 ASN 4.03 2.30 1 92 ILE -0.38 -1.22 1 93 ALA 4.60 1.17 1 94 SER 4.28 1.02 1 95 LYS 3.23 1.34 1 96 ILE 4.09 1.65 1 97 ALA 4.02 1.83 1 98 ASN 2.12 1.59 1 99 GLU -0.66 -0.06 1 100 LEU 0.27 -1.54 1 101 LYS 1.68 -1.84 1 stop_ save_