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 bmr15823_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 -3.02 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.23 _LACS_plot.Line_2_terminator_val_x_2 8.62 _LACS_plot.Line_2_terminator_val_y_2 6.28 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 LYS -7.42 -0.50 0 57 PHE 1.10 -2.67 0 10 GLN 4.32 2.25 1 11 LYS 4.65 1.22 1 13 LEU 4.23 3.00 1 14 GLU 3.33 2.83 1 15 ALA 3.01 2.63 1 16 TYR 2.70 2.53 1 17 ASN 2.75 1.37 1 18 ALA -0.55 -0.69 1 20 ASP -3.67 -2.28 1 21 ILE -0.18 -0.01 1 22 ASP 4.12 3.47 1 23 ALA 2.19 1.57 1 24 PHE 3.59 5.05 1 25 MET 1.92 -1.34 1 26 ALA 2.91 1.28 1 27 TRP -2.81 -1.84 1 28 TRP -2.30 -1.81 1 29 ALA -0.18 -0.05 1 30 ASP 3.83 3.49 1 31 ASP -0.90 -2.55 1 33 GLN -5.03 -2.13 1 34 TYR -4.63 -0.98 1 35 TYR -3.62 -0.13 1 36 ALA -2.08 -1.53 1 37 PHE -1.51 1.02 1 39 ALA 0.44 0.15 1 40 THR 0.41 0.47 1 41 LEU 2.12 1.80 1 42 LEU -1.29 0.07 1 43 ALA -4.15 -1.25 1 45 ASN -1.53 -0.81 1 46 ALA 3.44 2.93 1 47 ALA 5.06 3.20 1 48 GLU 1.56 2.29 1 49 ILE 5.46 4.98 1 50 ARG 6.03 4.78 1 51 VAL 5.58 4.58 1 52 ARG 3.70 2.52 1 53 HIS 8.63 6.73 1 54 ILE 5.80 4.59 1 55 GLU 3.02 2.04 1 56 ARG 3.78 1.26 1 58 LYS 1.66 1.65 1 61 ASP -0.67 -0.14 1 62 LEU -0.21 1.06 1 63 TYR -0.56 1.48 1 65 GLU -3.17 -2.03 1 66 LEU 0.38 0.48 1 67 LEU 2.16 1.32 1 68 THR -1.93 0.57 1 69 ARG -4.24 -1.34 1 70 VAL -3.88 -1.51 1 71 ILE -2.01 -0.53 1 72 VAL -1.53 -0.26 1 74 ASN 1.39 -0.72 1 75 VAL -1.89 -1.53 1 76 VAL -4.05 -2.43 1 77 ILE -3.57 -1.55 1 78 ASP -3.51 -1.56 1 79 HIS -8.20 -2.62 1 80 GLU -7.61 -3.15 1 81 THR 0.52 1.00 1 82 VAL -2.50 -1.43 1 83 THR 1.89 1.41 1 84 ARG -5.62 -4.20 1 85 ASN 0.32 1.34 1 86 PHE 3.78 1.49 1 88 GLU 1.89 1.20 1 90 LYS 1.07 0.78 1 92 GLU -7.02 -2.73 1 93 VAL -5.07 -1.95 1 94 ASP -1.61 -0.45 1 95 VAL -5.76 -1.79 1 96 ALA -2.07 -2.40 1 98 ILE -1.47 -0.51 1 99 TYR -4.64 -1.85 1 100 GLU -4.64 -0.96 1 101 VAL -0.57 0.14 1 102 GLU -5.24 -1.37 1 103 ASN 2.48 1.08 1 105 ARG -7.15 -2.77 1 106 ILE 2.90 2.16 1 107 ALA -1.26 1.09 1 109 ALA -7.28 -1.60 1 110 TRP -5.71 -0.70 1 111 PHE -3.49 -0.79 1 112 LYS -2.88 -2.68 1 113 ILE -0.92 -0.21 1 115 GLU -1.15 -0.22 1 117 ARG -1.76 -1.09 1 118 ILE 0.37 -1.17 1 119 VAL 1.04 0.58 1 120 SER -0.53 -0.20 1 121 GLN -0.17 0.07 1 122 LYS 0.21 0.25 1 123 SER 0.66 1.67 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15823_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 5.18 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.05 _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 8.62 _LACS_plot.Line_2_terminator_val_y_2 -2.34 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 LYS -7.42 6.92 0 57 PHE 1.10 -3.77 0 10 GLN 4.32 -2.07 1 11 LYS 4.65 -3.43 1 13 LEU 4.23 -1.23 1 14 GLU 3.33 -0.50 1 15 ALA 3.01 -0.38 1 16 TYR 2.70 -0.17 1 17 ASN 2.75 -1.38 1 18 ALA -0.55 -0.14 1 20 ASP -3.67 1.39 1 21 ILE -0.18 0.17 1 22 ASP 4.12 -0.65 1 23 ALA 2.19 -0.62 1 24 PHE 3.59 1.46 1 25 MET 1.92 -3.26 1 26 ALA 2.91 -1.63 1 27 TRP -2.81 0.97 1 28 TRP -2.30 0.49 1 29 ALA -0.18 0.13 1 30 ASP 3.83 -0.34 1 31 ASP -0.90 -1.65 1 33 GLN -5.03 2.90 1 34 TYR -4.63 3.65 1 35 TYR -3.62 3.49 1 36 ALA -2.08 0.55 1 37 PHE -1.51 2.53 1 39 ALA 0.44 -0.29 1 40 THR 0.41 0.06 1 41 LEU 2.12 -0.32 1 42 LEU -1.29 1.36 1 43 ALA -4.15 2.90 1 45 ASN -1.53 0.72 1 46 ALA 3.44 -0.51 1 47 ALA 5.06 -1.86 1 48 GLU 1.56 0.73 1 49 ILE 5.46 -0.48 1 50 ARG 6.03 -1.25 1 51 VAL 5.58 -1.00 1 52 ARG 3.70 -1.18 1 53 HIS 8.63 -1.90 1 54 ILE 5.80 -1.21 1 55 GLU 3.02 -0.98 1 56 ARG 3.78 -2.52 1 58 LYS 1.66 -0.01 1 61 ASP -0.67 0.53 1 62 LEU -0.21 1.27 1 63 TYR -0.56 2.04 1 65 GLU -3.17 1.14 1 66 LEU 0.38 0.10 1 67 LEU 2.16 -0.84 1 68 THR -1.93 2.50 1 69 ARG -4.24 2.90 1 70 VAL -3.88 2.37 1 71 ILE -2.01 1.48 1 72 VAL -1.53 1.27 1 74 ASN 1.39 -2.11 1 75 VAL -1.89 0.36 1 76 VAL -4.05 1.62 1 77 ILE -3.57 2.02 1 78 ASP -3.51 1.95 1 79 HIS -8.20 5.58 1 80 GLU -7.61 4.46 1 81 THR 0.52 0.48 1 82 VAL -2.50 1.07 1 83 THR 1.89 -0.48 1 84 ARG -5.62 1.42 1 85 ASN 0.32 1.02 1 86 PHE 3.78 -2.29 1 88 GLU 1.89 -0.69 1 90 LYS 1.07 -0.29 1 92 GLU -7.02 4.29 1 93 VAL -5.07 3.12 1 94 ASP -1.61 1.16 1 95 VAL -5.76 3.97 1 96 ALA -2.07 -0.33 1 98 ILE -1.47 0.96 1 99 TYR -4.64 2.79 1 100 GLU -4.64 3.68 1 101 VAL -0.57 0.71 1 102 GLU -5.24 3.87 1 103 ASN 2.48 -1.40 1 105 ARG -7.15 4.38 1 106 ILE 2.90 -0.74 1 107 ALA -1.26 2.35 1 109 ALA -7.28 5.68 1 110 TRP -5.71 5.01 1 111 PHE -3.49 2.70 1 112 LYS -2.88 0.20 1 113 ILE -0.92 0.71 1 115 GLU -1.15 0.93 1 117 ARG -1.76 0.67 1 118 ILE 0.37 -1.54 1 119 VAL 1.04 -0.46 1 120 SER -0.53 0.33 1 121 GLN -0.17 0.24 1 122 LYS 0.21 0.04 1 123 SER 0.66 1.01 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15823_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 0.98 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 8.62 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 HIS 8.63 -1.36 0 37 PHE -1.51 -0.85 0 10 GLN 4.32 -0.50 1 11 LYS 4.65 -0.70 1 13 LEU 4.23 -0.27 1 14 GLU 3.33 -0.41 1 15 ALA 3.01 0.00 1 16 TYR 2.70 -0.63 1 17 ASN 2.75 -0.07 1 18 ALA -0.55 -0.04 1 20 ASP -3.67 0.08 1 21 ILE -0.18 0.21 1 22 ASP 4.12 -0.17 1 23 ALA 2.19 -0.16 1 24 PHE 3.59 -0.47 1 25 MET 1.92 0.21 1 26 ALA 2.91 -0.48 1 27 TRP -2.81 -0.23 1 28 TRP -2.30 -0.14 1 29 ALA -0.18 -0.23 1 30 ASP 3.83 -0.35 1 31 ASP -0.90 0.11 1 33 GLN -5.03 0.07 1 34 TYR -4.63 0.45 1 35 TYR -3.62 0.69 1 36 ALA -2.08 0.74 1 39 ALA 0.44 -0.06 1 40 THR 0.41 0.21 1 41 LEU 2.12 -0.60 1 42 LEU -1.29 0.16 1 43 ALA -4.15 0.25 1 45 ASN -1.53 -0.13 1 46 ALA 3.44 -0.49 1 47 ALA 5.06 -0.32 1 48 GLU 1.56 -0.39 1 49 ILE 5.46 -1.30 1 50 ARG 6.03 -0.30 1 51 VAL 5.58 -0.68 1 52 ARG 3.70 -0.50 1 54 ILE 5.80 -0.82 1 55 GLU 3.02 -0.45 1 56 ARG 3.78 -0.33 1 57 PHE 1.10 -0.26 1 58 LYS 1.66 -0.20 1 61 ASP -0.67 0.06 1 62 LEU -0.21 0.07 1 63 TYR -0.56 0.00 1 65 GLU -3.17 -0.09 1 66 LEU 0.38 -0.23 1 67 LEU 2.16 0.02 1 68 THR -1.93 0.03 1 69 ARG -4.24 1.32 1 70 VAL -3.88 -0.19 1 71 ILE -2.01 0.72 1 72 VAL -1.53 -0.11 1 74 ASN 1.39 -0.09 1 75 VAL -1.89 0.92 1 76 VAL -4.05 0.52 1 77 ILE -3.57 0.88 1 78 ASP -3.51 0.87 1 79 HIS -8.20 0.85 1 80 GLU -7.61 1.12 1 81 THR 0.52 0.59 1 82 VAL -2.50 1.10 1 83 THR 1.89 0.61 1 84 ARG -5.62 -0.04 1 85 ASN 0.32 0.00 1 86 PHE 3.78 -0.27 1 88 GLU 1.89 -0.22 1 90 LYS 1.07 0.49 1 92 GLU -7.02 1.46 1 93 VAL -5.07 0.34 1 94 ASP -1.61 0.89 1 95 VAL -5.76 1.04 1 96 ALA -2.07 0.97 1 98 ILE -1.47 0.29 1 99 TYR -4.64 0.76 1 100 GLU -4.64 0.73 1 101 VAL -0.57 0.43 1 102 GLU -5.24 0.29 1 103 ASN 2.48 -0.40 1 105 ARG -7.15 0.36 1 106 ILE 2.90 -0.43 1 107 ALA -1.26 0.09 1 108 LYS -7.42 0.68 1 109 ALA -7.28 1.05 1 110 TRP -5.71 0.58 1 111 PHE -3.49 0.64 1 112 LYS -2.88 0.59 1 113 ILE -0.92 0.44 1 115 GLU -1.15 0.04 1 117 ARG -1.76 0.25 1 118 ILE 0.37 0.20 1 119 VAL 1.04 0.02 1 120 SER -0.53 0.00 1 121 GLN -0.17 0.02 1 122 LYS 0.21 0.01 1 123 SER 0.66 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15823_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 -3.28 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 6.03 _LACS_plot.Line_2_terminator_val_y_2 2.26 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 HIS -8.20 0.51 0 11 LYS 4.65 4.50 1 13 LEU 4.23 0.57 1 14 GLU 3.33 3.64 1 15 ALA 3.01 0.61 1 16 TYR 2.70 1.59 1 17 ASN 2.75 2.96 1 18 ALA -0.55 -2.11 1 20 ASP -3.67 -0.25 1 22 ASP 4.12 2.76 1 23 ALA 2.19 1.12 1 24 PHE 3.59 1.40 1 25 MET 1.92 1.96 1 26 ALA 2.91 0.04 1 27 TRP -2.81 -2.79 1 28 TRP -2.30 -0.54 1 29 ALA -0.18 0.20 1 30 ASP 3.83 0.93 1 31 ASP -0.90 -1.19 1 33 GLN -5.03 -3.65 1 34 TYR -4.63 -1.30 1 35 TYR -3.62 0.95 1 39 ALA 0.44 -1.60 1 40 THR 0.41 -1.14 1 41 LEU 2.12 -1.44 1 42 LEU -1.29 -0.45 1 43 ALA -4.15 -2.67 1 45 ASN -1.53 0.03 1 46 ALA 3.44 0.68 1 47 ALA 5.06 3.39 1 48 GLU 1.56 3.27 1 49 ILE 5.46 2.45 1 50 ARG 6.03 1.57 1 51 VAL 5.58 2.29 1 52 ARG 3.70 2.48 1 54 ILE 5.80 2.07 1 55 GLU 3.02 3.20 1 56 ARG 3.78 0.74 1 57 PHE 1.10 0.43 1 58 LYS 1.66 0.62 1 61 ASP -0.67 -1.86 1 62 LEU -0.21 -0.06 1 63 TYR -0.56 -2.32 1 65 GLU -3.17 -1.81 1 66 LEU 0.38 -1.82 1 67 LEU 2.16 0.60 1 68 THR -1.93 -4.49 1 69 ARG -4.24 -1.05 1 70 VAL -3.88 -2.85 1 71 ILE -2.01 -0.34 1 72 VAL -1.53 -1.31 1 74 ASN 1.39 -2.78 1 75 VAL -1.89 -2.91 1 76 VAL -4.05 -1.95 1 77 ILE -3.57 -2.52 1 78 ASP -3.51 -0.71 1 80 GLU -7.61 -1.75 1 81 THR 0.52 -0.21 1 82 VAL -2.50 -0.23 1 83 THR 1.89 -2.01 1 84 ARG -5.62 -1.47 1 85 ASN 0.32 -0.98 1 88 GLU 1.89 -0.68 1 90 LYS 1.07 0.24 1 92 GLU -7.02 -1.48 1 93 VAL -5.07 -4.17 1 94 ASP -1.61 -0.94 1 95 VAL -5.76 -1.15 1 96 ALA -2.07 -2.96 1 98 ILE -1.47 -2.70 1 99 TYR -4.64 -1.21 1 100 GLU -4.64 -1.01 1 101 VAL -0.57 -0.17 1 102 GLU -5.24 -0.50 1 103 ASN 2.48 0.33 1 107 ALA -1.26 0.48 1 108 LYS -7.42 -2.88 1 109 ALA -7.28 -3.73 1 111 PHE -3.49 0.33 1 112 LYS -2.88 -4.08 1 113 ILE -0.92 0.47 1 117 ARG -1.76 -1.00 1 118 ILE 0.37 0.46 1 119 VAL 1.04 -0.15 1 120 SER -0.53 -0.32 1 121 GLN -0.17 -0.17 1 122 LYS 0.21 -0.29 1 stop_ save_