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 bmr10057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 -2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.59 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 5.10 _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 40 GLN -7.15 -1.91 0 116 ASP 1.19 3.71 0 11 ARG 0.79 0.55 1 12 ASN 0.65 0.31 1 13 VAL 0.17 -0.12 1 15 SER -1.43 -0.36 1 16 LEU -1.48 -1.03 1 17 ASP 0.03 -0.18 1 18 LYS 2.58 1.74 1 19 THR 0.93 0.68 1 20 SER -0.26 -0.42 1 21 LYS 2.58 2.08 1 22 ASN 0.03 -0.08 1 23 VAL -4.73 -2.22 1 25 THR -0.06 0.54 1 27 LEU -2.46 -0.50 1 28 VAL -6.13 -2.87 1 30 ALA -3.82 -1.91 1 32 ALA 3.73 2.39 1 35 ASP -1.15 0.49 1 36 VAL -2.65 0.41 1 37 MET -3.87 -0.21 1 38 LYS -4.10 -2.01 1 39 LEU -5.93 -1.59 1 41 ILE -5.12 -2.05 1 42 GLN -3.97 -1.48 1 43 VAL -2.72 -1.50 1 44 ASP -1.60 -1.36 1 45 GLU 2.99 1.94 1 46 LYS -0.30 -1.06 1 48 LYS -1.47 -1.05 1 49 ILE 4.01 1.51 1 50 VAL -0.67 -0.79 1 51 ASP -3.74 -0.87 1 52 ALA -4.20 -0.57 1 53 ARG -6.31 -2.17 1 54 PHE -5.69 -2.20 1 55 LYS -1.56 0.59 1 56 THR -3.33 -0.95 1 57 PHE -3.53 -1.79 1 61 SER 4.06 4.05 1 62 ALA 5.89 3.51 1 63 ILE 5.94 4.93 1 64 ALA 3.29 2.76 1 65 SER 4.90 4.32 1 66 SER 4.08 3.16 1 67 SER 3.96 2.81 1 68 LEU 2.77 2.49 1 69 ALA 4.05 3.32 1 70 THR 6.42 5.01 1 71 GLU 2.41 2.04 1 72 TRP 1.07 1.17 1 73 VAL 2.86 1.80 1 74 LYS 3.88 3.07 1 76 LYS -2.30 -1.22 1 77 THR -2.13 -0.85 1 78 VAL 5.88 4.78 1 79 GLU 3.93 3.31 1 80 GLU 1.26 1.94 1 81 ALA 3.02 2.45 1 82 LEU 1.38 1.43 1 83 THR 0.31 0.60 1 84 ILE 2.38 1.30 1 85 LYS -4.92 -2.32 1 86 ASN 4.31 3.93 1 87 THR 4.46 2.67 1 88 ASP 3.33 3.29 1 89 ILE 3.74 3.40 1 90 ALA 3.36 2.90 1 91 LYS 3.37 2.85 1 92 GLU 2.75 2.25 1 93 LEU -0.59 -0.99 1 95 LEU 0.07 -0.08 1 98 VAL 3.00 1.72 1 99 LYS -2.57 -2.07 1 100 LEU 4.65 3.07 1 101 HIS 6.03 4.05 1 103 SER 4.46 2.47 1 104 MET 3.80 3.13 1 105 LEU 2.30 2.42 1 106 ALA 3.19 2.48 1 107 GLU 3.99 3.62 1 108 ASP 4.79 3.24 1 109 ALA 3.64 3.44 1 110 ILE 5.64 5.05 1 111 LYS 5.40 4.63 1 112 ALA 3.13 2.46 1 113 ALA 3.73 2.85 1 114 LEU 3.68 2.62 1 115 ALA 3.86 2.80 1 117 TYR 4.27 3.77 1 118 LYS 4.60 3.92 1 119 LEU 3.18 2.78 1 120 LYS 2.62 2.63 1 121 GLN 1.29 0.01 1 122 GLU -0.02 0.36 1 123 SER 0.33 0.28 1 124 LYS 0.28 0.16 1 125 SER -0.37 0.03 1 128 SER 0.04 0.09 1 129 SER -0.24 0.06 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 4.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.41 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 -1.32 _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 40 GLN -7.15 5.24 0 116 ASP 1.19 2.52 0 11 ARG 0.79 -0.24 1 12 ASN 0.65 -0.34 1 13 VAL 0.17 -0.29 1 15 SER -1.43 1.07 1 16 LEU -1.48 0.45 1 17 ASP 0.03 -0.21 1 18 LYS 2.58 -0.84 1 19 THR 0.93 -0.25 1 20 SER -0.26 -0.16 1 21 LYS 2.58 -0.50 1 22 ASN 0.03 -0.11 1 23 VAL -4.73 2.51 1 25 THR -0.06 0.60 1 27 LEU -2.46 1.96 1 28 VAL -6.13 3.26 1 30 ALA -3.82 1.91 1 32 ALA 3.73 -1.34 1 35 ASP -1.15 1.64 1 36 VAL -2.65 3.06 1 37 MET -3.87 3.66 1 38 LYS -4.10 2.09 1 39 LEU -5.93 4.34 1 41 ILE -5.12 3.07 1 42 GLN -3.97 2.49 1 43 VAL -2.72 1.22 1 44 ASP -1.60 0.24 1 45 GLU 2.99 -1.05 1 46 LYS -0.30 -0.76 1 48 LYS -1.47 0.42 1 49 ILE 4.01 -2.50 1 50 VAL -0.67 -0.12 1 51 ASP -3.74 2.87 1 52 ALA -4.20 3.63 1 53 ARG -6.31 4.14 1 54 PHE -5.69 3.49 1 55 LYS -1.56 2.15 1 56 THR -3.33 2.38 1 57 PHE -3.53 1.74 1 61 SER 4.06 -0.01 1 62 ALA 5.89 -2.38 1 63 ILE 5.94 -1.01 1 64 ALA 3.29 -0.53 1 65 SER 4.90 -0.58 1 66 SER 4.08 -0.92 1 67 SER 3.96 -1.15 1 68 LEU 2.77 -0.28 1 69 ALA 4.05 -0.73 1 70 THR 6.42 -1.41 1 71 GLU 2.41 -0.37 1 72 TRP 1.07 0.10 1 73 VAL 2.86 -1.06 1 74 LYS 3.88 -0.81 1 76 LYS -2.30 1.08 1 77 THR -2.13 1.28 1 78 VAL 5.88 -1.10 1 79 GLU 3.93 -0.62 1 80 GLU 1.26 0.68 1 81 ALA 3.02 -0.57 1 82 LEU 1.38 0.05 1 83 THR 0.31 0.29 1 84 ILE 2.38 -1.08 1 85 LYS -4.92 2.60 1 86 ASN 4.31 -0.38 1 87 THR 4.46 -1.79 1 88 ASP 3.33 -0.04 1 89 ILE 3.74 -0.34 1 90 ALA 3.36 -0.46 1 91 LYS 3.37 -0.52 1 92 GLU 2.75 -0.50 1 93 LEU -0.59 -0.40 1 95 LEU 0.07 -0.15 1 98 VAL 3.00 -1.28 1 99 LYS -2.57 0.50 1 100 LEU 4.65 -1.58 1 101 HIS 6.03 -1.98 1 103 SER 4.46 -1.99 1 104 MET 3.80 -0.67 1 105 LEU 2.30 0.12 1 106 ALA 3.19 -0.71 1 107 GLU 3.99 -0.37 1 108 ASP 4.79 -1.55 1 109 ALA 3.64 -0.20 1 110 ILE 5.64 -0.59 1 111 LYS 5.40 -0.77 1 112 ALA 3.13 -0.67 1 113 ALA 3.73 -0.88 1 114 LEU 3.68 -1.06 1 115 ALA 3.86 -1.06 1 117 TYR 4.27 -0.50 1 118 LYS 4.60 -0.68 1 119 LEU 3.18 -0.40 1 120 LYS 2.62 0.01 1 121 GLN 1.29 -1.28 1 122 GLU -0.02 0.38 1 123 SER 0.33 -0.05 1 124 LYS 0.28 -0.12 1 125 SER -0.37 0.40 1 128 SER 0.04 0.05 1 129 SER -0.24 0.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 1.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _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 6.42 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 THR -0.06 0.84 0 27 LEU -2.46 1.12 0 40 GLN -7.15 1.55 0 11 ARG 0.79 -0.06 1 12 ASN 0.65 -0.03 1 13 VAL 0.17 0.00 1 15 SER -1.43 0.05 1 16 LEU -1.48 0.11 1 17 ASP 0.03 -0.13 1 18 LYS 2.58 -0.31 1 19 THR 0.93 -0.02 1 20 SER -0.26 -0.01 1 21 LYS 2.58 -0.11 1 22 ASN 0.03 0.32 1 23 VAL -4.73 1.28 1 28 VAL -6.13 0.74 1 30 ALA -3.82 0.63 1 32 ALA 3.73 -0.21 1 35 ASP -1.15 0.82 1 36 VAL -2.65 0.59 1 37 MET -3.87 0.64 1 38 LYS -4.10 1.18 1 39 LEU -5.93 0.87 1 41 ILE -5.12 0.76 1 42 GLN -3.97 0.89 1 43 VAL -2.72 0.61 1 44 ASP -1.60 0.15 1 45 GLU 2.99 -0.08 1 46 LYS -0.30 0.20 1 48 LYS -1.47 0.03 1 49 ILE 4.01 0.11 1 50 VAL -0.67 0.33 1 51 ASP -3.74 0.13 1 52 ALA -4.20 0.98 1 53 ARG -6.31 0.69 1 54 PHE -5.69 1.36 1 55 LYS -1.56 -0.03 1 56 THR -3.33 1.11 1 57 PHE -3.53 0.29 1 61 SER 4.06 -0.03 1 62 ALA 5.89 -0.45 1 63 ILE 5.94 -0.82 1 64 ALA 3.29 -0.27 1 65 SER 4.90 -0.65 1 66 SER 4.08 -0.84 1 67 SER 3.96 -0.71 1 68 LEU 2.77 -0.45 1 69 ALA 4.05 -0.63 1 70 THR 6.42 -0.66 1 71 GLU 2.41 -0.17 1 72 TRP 1.07 -0.09 1 73 VAL 2.86 -0.16 1 74 LYS 3.88 -0.68 1 76 LYS -2.30 0.31 1 77 THR -2.13 0.76 1 78 VAL 5.88 -0.56 1 79 GLU 3.93 -0.31 1 80 GLU 1.26 -0.29 1 81 ALA 3.02 -0.27 1 82 LEU 1.38 -0.29 1 83 THR 0.31 0.02 1 84 ILE 2.38 -0.29 1 85 LYS -4.92 0.51 1 86 ASN 4.31 -0.63 1 87 THR 4.46 -0.37 1 88 ASP 3.33 0.00 1 89 ILE 3.74 -0.66 1 90 ALA 3.36 -0.56 1 91 LYS 3.37 -0.18 1 92 GLU 2.75 -0.17 1 93 LEU -0.59 -0.04 1 95 LEU 0.07 -0.30 1 98 VAL 3.00 0.23 1 99 LYS -2.57 0.23 1 100 LEU 4.65 -0.25 1 101 HIS 6.03 -0.31 1 103 SER 4.46 -0.55 1 104 MET 3.80 -0.27 1 105 LEU 2.30 -0.12 1 106 ALA 3.19 -0.33 1 107 GLU 3.99 -0.58 1 108 ASP 4.79 -0.23 1 109 ALA 3.64 -0.48 1 110 ILE 5.64 -0.75 1 111 LYS 5.40 -0.46 1 112 ALA 3.13 0.00 1 113 ALA 3.73 -0.40 1 114 LEU 3.68 -0.17 1 115 ALA 3.86 -0.12 1 116 ASP 1.19 -0.13 1 117 TYR 4.27 -0.47 1 118 LYS 4.60 -0.73 1 119 LEU 3.18 -0.20 1 120 LYS 2.62 -0.22 1 121 GLN 1.29 -0.32 1 122 GLU -0.02 -0.09 1 123 SER 0.33 0.00 1 124 LYS 0.28 0.12 1 125 SER -0.37 0.06 1 128 SER 0.04 0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 6.42 _LACS_plot.Line_2_terminator_val_y_2 2.56 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 MET -3.87 -4.32 0 80 GLU 1.26 4.20 0 12 ASN 0.65 -0.43 1 13 VAL 0.17 0.51 1 15 SER -1.43 -0.55 1 16 LEU -1.48 -1.11 1 17 ASP 0.03 0.35 1 18 LYS 2.58 0.34 1 19 THR 0.93 0.77 1 20 SER -0.26 1.88 1 21 LYS 2.58 -1.88 1 22 ASN 0.03 -2.08 1 23 VAL -4.73 0.00 1 25 THR -0.06 -1.42 1 27 LEU -2.46 -1.96 1 28 VAL -6.13 -2.12 1 30 ALA -3.82 -0.53 1 35 ASP -1.15 0.45 1 36 VAL -2.65 -2.37 1 41 ILE -5.12 -3.44 1 42 GLN -3.97 -1.89 1 43 VAL -2.72 0.36 1 44 ASP -1.60 2.00 1 45 GLU 2.99 0.70 1 46 LYS -0.30 0.41 1 48 LYS -1.47 -1.23 1 49 ILE 4.01 0.26 1 50 VAL -0.67 -0.41 1 51 ASP -3.74 -3.17 1 52 ALA -4.20 -2.95 1 53 ARG -6.31 -2.14 1 56 THR -3.33 -2.61 1 57 PHE -3.53 -1.70 1 61 SER 4.06 1.45 1 62 ALA 5.89 1.91 1 63 ILE 5.94 1.70 1 67 SER 3.96 2.08 1 68 LEU 2.77 0.24 1 69 ALA 4.05 0.37 1 70 THR 6.42 0.51 1 71 GLU 2.41 3.14 1 72 TRP 1.07 2.15 1 73 VAL 2.86 -0.74 1 74 LYS 3.88 0.80 1 76 LYS -2.30 0.35 1 77 THR -2.13 1.64 1 78 VAL 5.88 0.96 1 79 GLU 3.93 3.22 1 81 ALA 3.02 0.53 1 82 LEU 1.38 -0.28 1 83 THR 0.31 0.00 1 84 ILE 2.38 -1.58 1 90 ALA 3.36 2.01 1 91 LYS 3.37 3.08 1 92 GLU 2.75 1.39 1 93 LEU -0.59 -2.19 1 95 LEU 0.07 -0.70 1 101 HIS 6.03 2.65 1 103 SER 4.46 2.10 1 104 MET 3.80 0.55 1 105 LEU 2.30 -0.36 1 106 ALA 3.19 0.66 1 107 GLU 3.99 1.31 1 108 ASP 4.79 3.37 1 109 ALA 3.64 1.35 1 110 ILE 5.64 1.63 1 111 LYS 5.40 3.21 1 112 ALA 3.13 2.60 1 113 ALA 3.73 2.24 1 114 LEU 3.68 1.73 1 115 ALA 3.86 2.45 1 116 ASP 1.19 1.24 1 117 TYR 4.27 1.40 1 118 LYS 4.60 3.16 1 119 LEU 3.18 2.46 1 120 LYS 2.62 1.95 1 121 GLN 1.29 1.30 1 122 GLU -0.02 0.25 1 123 SER 0.33 0.17 1 124 LYS 0.28 0.05 1 125 SER -0.37 -0.07 1 128 SER 0.04 0.08 1 stop_ save_