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 bmr27498_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 7.76 _LACS_plot.Line_2_terminator_val_y_2 6.04 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 TYR -6.09 0.79 0 10 GLU 1.20 1.18 1 11 ASP 0.86 1.00 1 12 ASP 1.44 1.60 1 13 LEU 3.09 2.19 1 14 SER 3.91 2.83 1 15 VAL 5.15 4.09 1 16 GLU 5.36 4.30 1 17 ALA 3.50 2.38 1 18 GLU 2.48 2.20 1 19 ILE 5.88 4.99 1 20 ALA 3.94 3.16 1 21 HIS 3.94 4.13 1 22 GLN 5.49 5.06 1 23 ILE 6.48 5.10 1 24 ALA 4.48 3.42 1 25 GLU 2.13 2.20 1 26 SER -1.58 -0.96 1 27 PHE 4.05 5.31 1 28 SER -1.46 -1.13 1 29 LYS 1.43 0.90 1 30 LYS 0.55 0.18 1 31 TYR -3.02 -0.42 1 32 LYS -1.44 -0.08 1 33 PHE -3.27 -0.16 1 35 SER -2.96 -1.87 1 36 ARG 3.85 2.90 1 37 SER 0.68 -0.27 1 38 SER 2.42 1.35 1 40 ILE -6.39 -2.29 1 41 PHE -4.09 -1.92 1 42 LEU -4.15 -2.19 1 44 ASN -4.90 -1.98 1 45 PHE 4.87 4.34 1 46 GLU 3.38 2.73 1 47 GLN 1.94 2.22 1 48 LEU 2.04 1.55 1 49 LYS 4.61 0.50 1 50 MET -7.28 -1.19 1 51 ASN 0.05 -0.18 1 52 LEU 4.31 3.73 1 53 ASP 4.46 3.38 1 54 ASP 3.61 3.04 1 55 ILE 5.91 5.22 1 56 VAL 6.34 4.83 1 57 LYS 4.23 3.62 1 58 GLU 1.02 1.35 1 59 ALA 1.98 1.97 1 60 LYS 3.46 2.64 1 61 ASN 0.27 0.21 1 62 VAL 2.59 0.68 1 65 VAL 7.76 5.55 1 66 THR 7.13 4.78 1 67 ARG 4.68 3.22 1 68 LEU 2.23 2.67 1 69 ALA 2.13 2.28 1 70 HIS 4.51 4.36 1 71 ASP 0.41 0.36 1 73 SER -0.59 0.01 1 74 LYS 1.29 0.63 1 75 LEU -1.56 -0.67 1 77 LEU 4.57 3.93 1 78 ARG 7.23 4.49 1 80 VAL 5.90 4.86 1 81 LEU 5.55 2.86 1 83 TRP 4.08 3.53 1 84 VAL 4.84 4.31 1 85 ALA 5.04 2.66 1 86 LEU 3.30 2.76 1 87 ALA 0.41 0.85 1 88 ASN -3.04 2.34 1 89 SER -1.22 -2.33 1 90 LYS 4.20 2.84 1 91 LYS 3.88 3.15 1 92 PHE 3.87 3.83 1 93 GLN 4.77 3.43 1 94 LEU 1.59 1.59 1 95 LEU 0.24 0.84 1 96 VAL -1.34 -1.23 1 97 GLU -0.14 -0.90 1 98 ALA 4.10 3.54 1 99 ASN 4.47 3.54 1 100 LYS 3.28 3.11 1 101 LEU 3.66 2.75 1 102 ASN 4.58 4.10 1 103 LYS 4.02 3.18 1 104 ILE 3.83 3.77 1 105 MET 4.71 5.03 1 106 GLN 4.30 3.43 1 107 ASP 4.09 3.37 1 108 ASP 3.58 3.35 1 109 LEU 4.14 2.73 1 110 ASN 2.97 2.52 1 111 ARG 3.21 2.49 1 112 TYR 1.77 1.41 1 113 ALA 0.17 0.38 1 114 SER -0.28 0.03 1 115 SER 0.73 1.78 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27498_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 5.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 7.76 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 TYR -6.09 6.88 0 10 GLU 1.20 -0.02 1 11 ASP 0.86 0.14 1 12 ASP 1.44 0.16 1 13 LEU 3.09 -0.90 1 14 SER 3.91 -1.08 1 15 VAL 5.15 -1.06 1 16 GLU 5.36 -1.06 1 17 ALA 3.50 -1.12 1 18 GLU 2.48 -0.28 1 19 ILE 5.88 -0.89 1 20 ALA 3.94 -0.78 1 21 HIS 3.94 0.19 1 22 GLN 5.49 -0.43 1 23 ILE 6.48 -1.38 1 24 ALA 4.48 -1.06 1 25 GLU 2.13 0.07 1 26 SER -1.58 0.62 1 27 PHE 4.05 1.26 1 28 SER -1.46 0.33 1 29 LYS 1.43 -0.53 1 30 LYS 0.55 -0.37 1 31 TYR -3.02 2.60 1 32 LYS -1.44 1.36 1 33 PHE -3.27 3.11 1 35 SER -2.96 1.09 1 36 ARG 3.85 -0.95 1 37 SER 0.68 -0.95 1 38 SER 2.42 -1.07 1 40 ILE -6.39 4.10 1 41 PHE -4.09 2.17 1 42 LEU -4.15 1.96 1 44 ASN -4.90 2.92 1 45 PHE 4.87 -0.53 1 46 GLU 3.38 -0.65 1 47 GLN 1.94 0.28 1 48 LEU 2.04 -0.49 1 49 LYS 4.61 -4.11 1 50 MET -7.28 6.09 1 51 ASN 0.05 -0.23 1 52 LEU 4.31 -0.58 1 53 ASP 4.46 -1.08 1 54 ASP 3.61 -0.57 1 55 ILE 5.91 -0.69 1 56 VAL 6.34 -1.51 1 57 LYS 4.23 -0.61 1 58 GLU 1.02 0.33 1 59 ALA 1.98 -0.01 1 60 LYS 3.46 -0.82 1 61 ASN 0.27 -0.06 1 62 VAL 2.59 -1.91 1 65 VAL 7.76 -2.21 1 66 THR 7.13 -2.35 1 67 ARG 4.68 -1.46 1 68 LEU 2.23 0.44 1 69 ALA 2.13 0.15 1 70 HIS 4.51 -0.15 1 71 ASP 0.41 -0.05 1 73 SER -0.59 0.60 1 74 LYS 1.29 -0.66 1 75 LEU -1.56 0.89 1 77 LEU 4.57 -0.64 1 78 ARG 7.23 -2.74 1 80 VAL 5.90 -1.04 1 81 LEU 5.55 -2.69 1 83 TRP 4.08 -0.55 1 84 VAL 4.84 -0.53 1 85 ALA 5.04 -2.38 1 86 LEU 3.30 -0.54 1 87 ALA 0.41 0.44 1 88 ASN -3.04 5.38 1 89 SER -1.22 -1.11 1 90 LYS 4.20 -1.36 1 91 LYS 3.88 -0.73 1 92 PHE 3.87 -0.04 1 93 GLN 4.77 -1.34 1 94 LEU 1.59 0.00 1 95 LEU 0.24 0.60 1 96 VAL -1.34 0.11 1 97 GLU -0.14 -0.76 1 98 ALA 4.10 -0.56 1 99 ASN 4.47 -0.93 1 100 LYS 3.28 -0.17 1 101 LEU 3.66 -0.91 1 102 ASN 4.58 -0.48 1 103 LYS 4.02 -0.84 1 104 ILE 3.83 -0.06 1 105 MET 4.71 0.32 1 106 GLN 4.30 -0.87 1 107 ASP 4.09 -0.72 1 108 ASP 3.58 -0.23 1 109 LEU 4.14 -1.41 1 110 ASN 2.97 -0.45 1 111 ARG 3.21 -0.72 1 112 TYR 1.77 -0.36 1 113 ALA 0.17 0.21 1 114 SER -0.28 0.31 1 115 SER 0.73 1.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27498_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 7.76 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 VAL 2.59 -1.73 0 10 GLU 1.20 -0.18 1 11 ASP 0.86 -0.02 1 12 ASP 1.44 -0.08 1 13 LEU 3.09 -0.15 1 14 SER 3.91 -0.17 1 15 VAL 5.15 -0.47 1 16 GLU 5.36 -0.77 1 17 ALA 3.50 -0.23 1 18 GLU 2.48 -0.10 1 19 ILE 5.88 -0.79 1 20 ALA 3.94 -0.72 1 21 HIS 3.94 -0.42 1 22 GLN 5.49 -0.38 1 23 ILE 6.48 -0.91 1 24 ALA 4.48 -0.46 1 25 GLU 2.13 -0.23 1 26 SER -1.58 0.55 1 27 PHE 4.05 -0.27 1 28 SER -1.46 0.24 1 29 LYS 1.43 -0.39 1 30 LYS 0.55 -0.07 1 31 TYR -3.02 -0.02 1 32 LYS -1.44 0.11 1 33 PHE -3.27 -0.29 1 35 SER -2.96 0.59 1 37 SER 0.68 0.11 1 38 SER 2.42 -0.09 1 40 ILE -6.39 1.22 1 41 PHE -4.09 0.46 1 42 LEU -4.15 1.31 1 43 TYR -6.09 0.37 1 44 ASN -4.90 0.32 1 45 PHE 4.87 -0.69 1 46 GLU 3.38 -0.85 1 47 GLN 1.94 -0.48 1 48 LEU 2.04 -0.25 1 49 LYS 4.61 -0.34 1 50 MET -7.28 0.17 1 51 ASN 0.05 -0.08 1 52 LEU 4.31 -0.34 1 53 ASP 4.46 -0.44 1 54 ASP 3.61 -0.12 1 55 ILE 5.91 -0.68 1 56 VAL 6.34 -0.92 1 57 LYS 4.23 -0.53 1 58 GLU 1.02 -0.15 1 59 ALA 1.98 -0.53 1 60 LYS 3.46 -0.69 1 61 ASN 0.27 -0.15 1 65 VAL 7.76 -0.69 1 66 THR 7.13 -0.61 1 67 ARG 4.68 -0.38 1 68 LEU 2.23 -0.27 1 69 ALA 2.13 -0.31 1 70 HIS 4.51 -0.63 1 71 ASP 0.41 -0.06 1 73 SER -0.59 -0.04 1 74 LYS 1.29 -0.09 1 75 LEU -1.56 -0.30 1 77 LEU 4.57 -0.59 1 78 ARG 7.23 -1.27 1 80 VAL 5.90 -0.52 1 81 LEU 5.55 -0.75 1 83 TRP 4.08 -0.82 1 84 VAL 4.84 -0.49 1 85 ALA 5.04 -0.74 1 86 LEU 3.30 -0.46 1 87 ALA 0.41 -0.15 1 88 ASN -3.04 0.18 1 89 SER -1.22 0.50 1 90 LYS 4.20 -0.32 1 91 LYS 3.88 -0.40 1 92 PHE 3.87 -1.20 1 93 GLN 4.77 -0.67 1 94 LEU 1.59 -0.25 1 95 LEU 0.24 -0.49 1 96 VAL -1.34 0.35 1 97 GLU -0.14 0.06 1 98 ALA 4.10 -0.46 1 99 ASN 4.47 -0.19 1 100 LYS 3.28 -0.19 1 101 LEU 3.66 -0.18 1 102 ASN 4.58 -0.29 1 103 LYS 4.02 -0.18 1 104 ILE 3.83 -0.25 1 105 MET 4.71 -0.30 1 106 GLN 4.30 -0.27 1 107 ASP 4.09 -0.15 1 108 ASP 3.58 -0.12 1 109 LEU 4.14 -0.16 1 110 ASN 2.97 -0.16 1 111 ARG 3.21 -0.19 1 112 TYR 1.77 -0.13 1 113 ALA 0.17 0.12 1 114 SER -0.28 0.07 1 115 SER 0.73 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27498_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.33 _LACS_plot.Line_2_terminator_val_x_2 7.76 _LACS_plot.Line_2_terminator_val_y_2 2.03 _LACS_plot.Y_axis_chem_shift_offset -0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 TYR -3.02 5.65 0 24 ALA 4.48 -4.03 0 33 PHE -3.27 5.87 0 43 TYR -6.09 4.85 0 10 GLU 1.20 0.60 1 11 ASP 0.86 0.38 1 12 ASP 1.44 1.18 1 13 LEU 3.09 1.94 1 14 SER 3.91 2.59 1 15 VAL 5.15 1.16 1 16 GLU 5.36 1.41 1 17 ALA 3.50 2.34 1 18 GLU 2.48 1.73 1 19 ILE 5.88 1.01 1 20 ALA 3.94 1.38 1 21 HIS 3.94 3.31 1 22 GLN 5.49 3.65 1 23 ILE 6.48 0.85 1 25 GLU 2.13 0.92 1 26 SER -1.58 1.78 1 27 PHE 4.05 -0.54 1 28 SER -1.46 0.94 1 29 LYS 1.43 -1.81 1 30 LYS 0.55 -0.98 1 32 LYS -1.44 -1.41 1 35 SER -2.96 1.71 1 36 ARG 3.85 0.02 1 37 SER 0.68 -0.33 1 38 SER 2.42 -0.65 1 40 ILE -6.39 -0.26 1 41 PHE -4.09 4.00 1 42 LEU -4.15 -0.41 1 44 ASN -4.90 -1.36 1 45 PHE 4.87 3.81 1 46 GLU 3.38 1.63 1 47 GLN 1.94 1.09 1 48 LEU 2.04 -0.69 1 49 LYS 4.61 -1.10 1 50 MET -7.28 -0.30 1 51 ASN 0.05 1.44 1 52 LEU 4.31 0.13 1 53 ASP 4.46 2.44 1 54 ASP 3.61 2.58 1 55 ILE 5.91 1.11 1 56 VAL 6.34 0.31 1 57 LYS 4.23 2.61 1 58 GLU 1.02 2.44 1 59 ALA 1.98 0.49 1 60 LYS 3.46 0.36 1 61 ASN 0.27 -0.25 1 62 VAL 2.59 -0.58 1 65 VAL 7.76 1.04 1 66 THR 7.13 1.61 1 67 ARG 4.68 2.15 1 68 LEU 2.23 1.52 1 69 ALA 2.13 2.67 1 70 HIS 4.51 1.84 1 71 ASP 0.41 0.34 1 73 SER -0.59 -1.65 1 74 LYS 1.29 0.65 1 75 LEU -1.56 0.22 1 77 LEU 4.57 -0.50 1 78 ARG 7.23 1.89 1 80 VAL 5.90 0.17 1 81 LEU 5.55 -0.23 1 83 TRP 4.08 3.42 1 84 VAL 4.84 2.67 1 85 ALA 5.04 1.40 1 86 LEU 3.30 0.79 1 87 ALA 0.41 1.45 1 88 ASN -3.04 -0.59 1 89 SER -1.22 -0.17 1 90 LYS 4.20 2.02 1 91 LYS 3.88 1.54 1 92 PHE 3.87 0.91 1 93 GLN 4.77 2.01 1 94 LEU 1.59 0.76 1 95 LEU 0.24 0.33 1 96 VAL -1.34 4.34 1 97 GLU -0.14 -0.07 1 98 ALA 4.10 1.64 1 99 ASN 4.47 3.68 1 100 LYS 3.28 3.13 1 101 LEU 3.66 -0.07 1 102 ASN 4.58 2.19 1 103 LYS 4.02 1.70 1 104 ILE 3.83 1.84 1 105 MET 4.71 1.59 1 106 GLN 4.30 2.56 1 107 ASP 4.09 2.93 1 108 ASP 3.58 2.64 1 109 LEU 4.14 2.28 1 110 ASN 2.97 2.22 1 111 ARG 3.21 1.47 1 112 TYR 1.77 0.06 1 113 ALA 0.17 -0.32 1 114 SER -0.28 -0.86 1 115 SER 0.73 4.04 1 stop_ save_