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 bmr19757_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.10 _LACS_plot.Line_1_terminator_val_y_1 -1.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 6.11 _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 55 LYS 0.39 -2.24 0 21 LYS 0.04 -2.43 0 73 TYR 0.63 -2.30 0 54 GLN 6.19 1.65 0 10 LYS 6.65 4.13 1 11 ASP 4.50 3.48 1 12 ARG 3.72 3.45 1 14 ASN 4.32 2.48 1 16 PHE 4.70 3.05 1 17 PHE 4.88 5.13 1 18 LYS 3.98 3.27 1 19 GLU -1.32 -0.49 1 22 TYR 5.40 4.39 1 23 GLU 5.98 4.22 1 24 ARG 4.69 1.93 1 25 ALA 5.08 3.43 1 26 ILE 6.65 5.90 1 27 GLU 3.69 3.28 1 29 TYR 2.59 1.38 1 30 THR 7.06 5.86 1 31 ARG 4.49 4.17 1 33 ILE 3.38 3.67 1 34 ALA 3.18 1.89 1 35 ALA 0.24 0.52 1 36 ASP -0.74 -0.88 1 38 ALA -1.46 -1.30 1 39 ASN -0.95 -0.66 1 40 ALA 1.20 2.14 1 41 LEU 2.68 2.17 1 42 LEU 7.83 6.41 1 44 ALA 4.51 3.32 1 45 ASN 5.17 1.68 1 46 ARG 6.84 5.51 1 47 ALA 1.48 3.25 1 48 MET 2.15 2.63 1 49 ALA 3.58 3.27 1 50 TYR 4.57 2.61 1 51 LEU 4.14 3.69 1 52 LYS 2.59 0.08 1 53 ILE 1.12 -0.54 1 56 TYR 4.85 3.58 1 57 GLU 4.57 3.74 1 58 GLU 7.82 3.88 1 59 ALA 3.23 3.08 1 60 GLU 4.88 4.30 1 61 LYS 4.46 3.75 1 62 ASP 3.99 2.97 1 64 THR 6.64 5.11 1 65 GLN 4.63 2.88 1 66 ALA 3.85 3.36 1 67 ILE 2.06 2.45 1 68 LEU 3.18 2.41 1 69 LEU 0.66 1.32 1 70 ASP -0.37 -0.41 1 72 SER -1.54 -1.18 1 74 SER 5.63 4.52 1 75 LYS 3.66 2.80 1 76 ALA 2.89 2.58 1 77 PHE 5.50 5.30 1 78 ALA 3.64 2.85 1 79 ARG 3.02 3.37 1 80 ARG 6.87 5.44 1 82 THR 7.06 5.89 1 83 ALA 5.14 3.90 1 84 ARG 5.68 4.53 1 85 THR 7.19 5.54 1 86 PHE 5.64 3.84 1 87 LEU -1.03 -0.13 1 89 LYS 0.67 -1.79 1 90 LEU 5.00 3.45 1 91 ASN 4.82 3.49 1 92 GLU 4.59 3.50 1 93 ALA 3.15 2.75 1 94 LYS 4.78 3.78 1 95 GLN 4.25 3.07 1 96 ASP 6.37 4.43 1 97 PHE 5.66 4.20 1 98 GLU 4.47 3.30 1 99 THR 7.18 5.54 1 100 VAL 8.14 5.76 1 101 LEU 2.41 1.57 1 102 LEU 2.43 2.07 1 103 LEU 0.58 1.40 1 104 GLU -2.10 -0.58 1 107 ASN 1.74 2.50 1 108 LYS 3.53 2.95 1 109 GLN 4.83 3.15 1 110 ALA 3.74 2.86 1 111 VAL 5.22 4.40 1 112 THR 5.70 4.57 1 113 GLU 4.01 2.07 1 114 LEU 3.63 2.66 1 115 SER 3.56 2.68 1 116 LYS 2.39 2.05 1 117 ILE 1.99 1.86 1 118 LYS 0.98 0.75 1 119 LYS 0.68 0.34 1 120 LYS 1.41 1.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19757_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.10 _LACS_plot.Line_1_terminator_val_y_1 1.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 -2.02 _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 55 LYS 0.39 -2.63 0 21 LYS 0.04 -2.47 0 73 TYR 0.63 -2.93 0 54 GLN 6.19 -4.54 0 10 LYS 6.65 -2.52 1 11 ASP 4.50 -1.02 1 12 ARG 3.72 -0.27 1 14 ASN 4.32 -1.84 1 16 PHE 4.70 -1.65 1 17 PHE 4.88 0.25 1 18 LYS 3.98 -0.71 1 19 GLU -1.32 0.83 1 22 TYR 5.40 -1.01 1 23 GLU 5.98 -1.76 1 24 ARG 4.69 -2.76 1 25 ALA 5.08 -1.65 1 26 ILE 6.65 -0.75 1 27 GLU 3.69 -0.41 1 29 TYR 2.59 -1.21 1 30 THR 7.06 -1.20 1 31 ARG 4.49 -0.32 1 33 ILE 3.38 0.29 1 34 ALA 3.18 -1.29 1 35 ALA 0.24 0.28 1 36 ASP -0.74 -0.14 1 38 ALA -1.46 0.16 1 39 ASN -0.95 0.29 1 40 ALA 1.20 0.94 1 41 LEU 2.68 -0.51 1 42 LEU 7.83 -1.42 1 44 ALA 4.51 -1.19 1 45 ASN 5.17 -3.49 1 46 ARG 6.84 -1.33 1 47 ALA 1.48 1.77 1 48 MET 2.15 0.48 1 49 ALA 3.58 -0.31 1 50 TYR 4.57 -1.96 1 51 LEU 4.14 -0.45 1 52 LYS 2.59 -2.51 1 53 ILE 1.12 -1.66 1 56 TYR 4.85 -1.27 1 57 GLU 4.57 -0.83 1 58 GLU 7.82 -3.94 1 59 ALA 3.23 -0.15 1 60 GLU 4.88 -0.58 1 61 LYS 4.46 -0.71 1 62 ASP 3.99 -1.02 1 64 THR 6.64 -1.53 1 65 GLN 4.63 -1.75 1 66 ALA 3.85 -0.49 1 67 ILE 2.06 0.39 1 68 LEU 3.18 -0.77 1 69 LEU 0.66 0.66 1 70 ASP -0.37 -0.04 1 72 SER -1.54 0.36 1 74 SER 5.63 -1.11 1 75 LYS 3.66 -0.86 1 76 ALA 2.89 -0.31 1 77 PHE 5.50 -0.20 1 78 ALA 3.64 -0.79 1 79 ARG 3.02 0.35 1 80 ARG 6.87 -1.43 1 82 THR 7.06 -1.17 1 83 ALA 5.14 -1.24 1 84 ARG 5.68 -1.15 1 85 THR 7.19 -1.65 1 86 PHE 5.64 -1.80 1 87 LEU -1.03 0.90 1 89 LYS 0.67 -2.46 1 90 LEU 5.00 -1.55 1 91 ASN 4.82 -1.33 1 92 GLU 4.59 -1.09 1 93 ALA 3.15 -0.40 1 94 LYS 4.78 -1.00 1 95 GLN 4.25 -1.18 1 96 ASP 6.37 -1.94 1 97 PHE 5.66 -1.46 1 98 GLU 4.47 -1.17 1 99 THR 7.18 -1.64 1 100 VAL 8.14 -2.38 1 101 LEU 2.41 -0.84 1 102 LEU 2.43 -0.36 1 103 LEU 0.58 0.82 1 104 GLU -2.10 1.52 1 107 ASN 1.74 0.76 1 108 LYS 3.53 -0.58 1 109 GLN 4.83 -1.68 1 110 ALA 3.74 -0.88 1 111 VAL 5.22 -0.82 1 112 THR 5.70 -1.13 1 113 GLU 4.01 -1.94 1 114 LEU 3.63 -0.97 1 115 SER 3.56 -0.88 1 116 LYS 2.39 -0.34 1 117 ILE 1.99 -0.13 1 118 LYS 0.98 -0.23 1 119 LYS 0.68 -0.34 1 120 LYS 1.41 0.32 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19757_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.10 _LACS_plot.Line_1_terminator_val_y_1 0.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 54 GLN 6.19 -1.64 0 10 LYS 6.65 -0.41 1 11 ASP 4.50 -0.16 1 12 ARG 3.72 -0.45 1 14 ASN 4.32 -0.15 1 16 PHE 4.70 -0.06 1 17 PHE 4.88 -0.92 1 18 LYS 3.98 -0.24 1 19 GLU -1.32 0.03 1 21 LYS 0.04 0.10 1 22 TYR 5.40 -0.59 1 23 GLU 5.98 -0.36 1 24 ARG 4.69 -0.50 1 25 ALA 5.08 -0.42 1 26 ILE 6.65 -0.81 1 27 GLU 3.69 -0.30 1 29 TYR 2.59 -0.17 1 30 THR 7.06 -0.45 1 31 ARG 4.49 -0.15 1 33 ILE 3.38 -0.50 1 34 ALA 3.18 -0.22 1 35 ALA 0.24 0.06 1 36 ASP -0.74 0.10 1 38 ALA -1.46 0.37 1 39 ASN -0.95 -0.05 1 40 ALA 1.20 -0.42 1 41 LEU 2.68 -0.26 1 42 LEU 7.83 -0.79 1 44 ALA 4.51 -0.45 1 45 ASN 5.17 -0.56 1 46 ARG 6.84 -0.63 1 47 ALA 1.48 -0.06 1 48 MET 2.15 -0.34 1 49 ALA 3.58 -0.07 1 50 TYR 4.57 -0.14 1 51 LEU 4.14 -0.63 1 52 LYS 2.59 -0.40 1 53 ILE 1.12 0.41 1 55 LYS 0.39 0.13 1 56 TYR 4.85 -0.52 1 57 GLU 4.57 -0.34 1 58 GLU 7.82 -0.78 1 59 ALA 3.23 -0.15 1 60 GLU 4.88 -0.72 1 61 LYS 4.46 -0.35 1 62 ASP 3.99 -0.02 1 64 THR 6.64 -0.68 1 65 GLN 4.63 -0.19 1 66 ALA 3.85 -0.35 1 67 ILE 2.06 -0.54 1 68 LEU 3.18 -0.32 1 69 LEU 0.66 -0.15 1 70 ASP -0.37 -0.02 1 72 SER -1.54 0.39 1 73 TYR 0.63 0.35 1 74 SER 5.63 -0.39 1 75 LYS 3.66 -0.26 1 76 ALA 2.89 -0.45 1 77 PHE 5.50 -0.77 1 78 ALA 3.64 -0.47 1 79 ARG 3.02 -0.27 1 80 ARG 6.87 -0.63 1 82 THR 7.06 -0.24 1 83 ALA 5.14 -0.29 1 84 ARG 5.68 -0.57 1 85 THR 7.19 -0.65 1 86 PHE 5.64 -0.55 1 87 LEU -1.03 0.04 1 89 LYS 0.67 0.33 1 90 LEU 5.00 -0.46 1 91 ASN 4.82 -0.32 1 92 GLU 4.59 -0.36 1 93 ALA 3.15 -0.44 1 94 LYS 4.78 -0.36 1 95 GLN 4.25 -0.23 1 96 ASP 6.37 -0.06 1 97 PHE 5.66 -0.16 1 98 GLU 4.47 -0.41 1 99 THR 7.18 -0.64 1 100 VAL 8.14 -0.85 1 101 LEU 2.41 -0.22 1 102 LEU 2.43 -0.20 1 103 LEU 0.58 -0.13 1 104 GLU -2.10 -0.02 1 107 ASN 1.74 -0.36 1 108 LYS 3.53 -0.38 1 109 GLN 4.83 -0.29 1 110 ALA 3.74 -0.58 1 111 VAL 5.22 -0.54 1 112 THR 5.70 -0.50 1 113 GLU 4.01 -0.50 1 114 LEU 3.63 -0.32 1 115 SER 3.56 -0.24 1 116 LYS 2.39 -0.18 1 117 ILE 1.99 -0.21 1 118 LYS 0.98 -0.07 1 119 LYS 0.68 -0.03 1 120 LYS 1.41 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19757_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.54 _LACS_plot.Line_1_terminator_val_y_1 -0.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.63 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 3.31 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 GLN 6.19 -1.69 0 10 LYS 6.65 0.92 1 11 ASP 4.50 3.65 1 12 ARG 3.72 3.43 1 14 ASN 4.32 3.26 1 16 PHE 4.70 2.77 1 17 PHE 4.88 3.18 1 18 LYS 3.98 1.06 1 19 GLU -1.32 -0.32 1 21 LYS 0.04 0.53 1 22 TYR 5.40 1.73 1 23 GLU 5.98 3.22 1 24 ARG 4.69 2.95 1 25 ALA 5.08 0.18 1 26 ILE 6.65 2.55 1 27 GLU 3.69 2.68 1 29 TYR 2.59 2.23 1 30 THR 7.06 1.74 1 31 ARG 4.49 4.01 1 33 ILE 3.38 1.16 1 34 ALA 3.18 1.23 1 35 ALA 0.24 -0.45 1 36 ASP -0.74 -0.71 1 38 ALA -1.46 -1.59 1 39 ASN -0.95 1.01 1 40 ALA 1.20 -0.96 1 41 LEU 2.68 1.22 1 44 ALA 4.51 2.36 1 45 ASN 5.17 2.01 1 46 ARG 6.84 1.75 1 47 ALA 1.48 1.41 1 48 MET 2.15 1.56 1 49 ALA 3.58 0.65 1 50 TYR 4.57 4.13 1 51 LEU 4.14 2.93 1 52 LYS 2.59 1.42 1 53 ILE 1.12 -2.31 1 55 LYS 0.39 -0.04 1 56 TYR 4.85 2.13 1 57 GLU 4.57 2.70 1 58 GLU 7.82 2.86 1 59 ALA 3.23 1.44 1 60 GLU 4.88 1.46 1 61 LYS 4.46 3.16 1 62 ASP 3.99 3.29 1 64 THR 6.64 0.35 1 65 GLN 4.63 1.54 1 66 ALA 3.85 0.54 1 67 ILE 2.06 1.52 1 68 LEU 3.18 2.13 1 69 LEU 0.66 0.29 1 70 ASP -0.37 -1.24 1 72 SER -1.54 -0.26 1 73 TYR 0.63 -0.14 1 74 SER 5.63 2.16 1 75 LYS 3.66 1.97 1 76 ALA 2.89 1.48 1 77 PHE 5.50 1.89 1 78 ALA 3.64 2.35 1 79 ARG 3.02 1.10 1 80 ARG 6.87 2.81 1 82 THR 7.06 1.92 1 83 ALA 5.14 1.25 1 84 ARG 5.68 1.92 1 85 THR 7.19 3.01 1 86 PHE 5.64 2.21 1 87 LEU -1.03 -0.77 1 89 LYS 0.67 0.16 1 90 LEU 5.00 1.77 1 91 ASN 4.82 2.97 1 92 GLU 4.59 1.89 1 93 ALA 3.15 0.52 1 94 LYS 4.78 1.21 1 95 GLN 4.25 3.19 1 96 ASP 6.37 2.73 1 97 PHE 5.66 2.77 1 98 GLU 4.47 3.72 1 99 THR 7.18 1.40 1 100 VAL 8.14 0.50 1 101 LEU 2.41 1.48 1 102 LEU 2.43 1.69 1 103 LEU 0.58 0.46 1 107 ASN 1.74 0.02 1 108 LYS 3.53 2.27 1 109 GLN 4.83 1.71 1 110 ALA 3.74 0.98 1 111 VAL 5.22 3.02 1 112 THR 5.70 2.56 1 113 GLU 4.01 3.21 1 114 LEU 3.63 1.70 1 115 SER 3.56 1.08 1 116 LYS 2.39 1.59 1 117 ILE 1.99 0.07 1 118 LYS 0.98 -0.28 1 119 LYS 0.68 -0.94 1 stop_ save_