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 bmr17325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -3.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 6.96 _LACS_plot.Line_2_terminator_val_y_2 5.14 _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 97 LEU -7.08 -2.79 0 10 ASP 0.29 0.20 1 11 SER 0.32 0.34 1 12 ASP 0.23 0.18 1 13 SER 0.59 0.40 1 14 SER 1.00 0.76 1 15 GLN 0.49 0.14 1 16 ALA 0.35 0.30 1 18 SER 0.12 0.09 1 19 ASN 0.22 0.10 1 20 ALA 0.53 0.47 1 22 ASN -0.06 -0.14 1 23 GLN 0.06 0.09 1 25 MET 0.16 -0.02 1 26 LEU -0.26 -0.42 1 27 TRP -1.27 -1.08 1 29 ALA 1.73 1.30 1 30 TRP 1.17 0.19 1 31 VAL 1.76 0.75 1 32 TYR 0.23 0.21 1 34 THR 0.77 0.48 1 35 ARG 0.40 0.23 1 36 TYR -0.01 -0.04 1 37 SER -0.10 -0.03 1 38 ASP 0.04 -0.07 1 39 ARG -0.08 -0.16 1 41 SER 0.01 -0.03 1 42 SER -0.39 -0.20 1 45 ARG 0.67 0.16 1 46 SER -0.24 -0.17 1 47 ARG 0.01 -0.16 1 48 LYS 0.17 -0.10 1 50 LYS -0.05 -0.07 1 51 LYS -0.25 -0.15 1 52 LYS -0.20 -0.15 1 53 ASN -0.24 -0.19 1 55 ASN 0.19 0.12 1 56 LYS 0.47 0.25 1 57 GLU -0.45 -0.16 1 58 ASP 0.10 0.08 1 59 LYS 0.16 -0.35 1 60 ARG 0.32 0.02 1 62 ARG 0.19 0.04 1 63 THR -0.39 -0.46 1 64 ALA -0.96 -0.63 1 65 PHE -2.69 -1.70 1 66 THR -2.41 -1.29 1 67 ALA 4.42 3.10 1 68 GLU 4.19 3.30 1 69 GLN 4.94 3.16 1 70 LEU 3.46 2.76 1 71 GLN 4.59 3.28 1 72 ARG 3.49 1.45 1 73 LEU 6.96 3.17 1 74 LYS 5.07 4.39 1 75 ALA 3.59 2.53 1 76 GLU 3.64 2.28 1 77 PHE 3.39 3.11 1 78 GLN 3.06 2.17 1 79 THR 3.71 3.16 1 80 ASN -0.58 0.33 1 81 ARG 2.06 1.25 1 82 TYR -2.37 -1.04 1 83 LEU -2.89 -1.52 1 84 THR -2.76 -1.49 1 85 GLU 4.39 3.62 1 86 GLN 5.06 3.57 1 87 ARG 2.96 2.08 1 88 ARG 5.29 4.47 1 89 GLN 4.70 3.48 1 90 SER 4.60 3.28 1 91 LEU 2.38 2.45 1 92 ALA 4.99 3.72 1 93 GLN 3.85 2.76 1 94 GLU 2.40 2.50 1 95 LEU -0.98 -0.31 1 98 ASN -1.50 -0.59 1 99 GLU 4.54 4.32 1 100 SER 5.77 3.90 1 101 GLN 2.71 3.00 1 102 ILE 5.02 3.71 1 103 LYS 4.09 3.93 1 104 ILE 4.04 3.23 1 105 TRP 6.17 5.64 1 106 PHE 5.14 5.18 1 107 GLN 4.44 3.63 1 108 ASN 3.33 2.15 1 109 LYS 3.32 0.89 1 110 ARG 3.23 3.48 1 111 ALA 1.62 1.11 1 112 LYS 0.93 0.38 1 113 ILE 0.83 0.29 1 114 LYS 0.39 0.19 1 115 LYS 0.05 0.03 1 116 ALA -0.15 0.03 1 117 THR 0.26 1.17 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 3.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.96 _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 6.96 _LACS_plot.Line_2_terminator_val_y_2 -1.82 _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 97 LEU -7.08 4.29 0 10 ASP 0.29 -0.09 1 11 SER 0.32 0.02 1 12 ASP 0.23 -0.05 1 13 SER 0.59 -0.19 1 14 SER 1.00 -0.24 1 15 GLN 0.49 -0.35 1 16 ALA 0.35 -0.05 1 18 SER 0.12 -0.03 1 19 ASN 0.22 -0.12 1 20 ALA 0.53 -0.06 1 22 ASN -0.06 -0.08 1 23 GLN 0.06 0.03 1 25 MET 0.16 -0.18 1 26 LEU -0.26 -0.16 1 27 TRP -1.27 0.19 1 29 ALA 1.73 -0.43 1 30 TRP 1.17 -0.98 1 31 VAL 1.76 -1.01 1 32 TYR 0.23 -0.02 1 34 THR 0.77 -0.29 1 35 ARG 0.40 -0.17 1 36 TYR -0.01 -0.03 1 37 SER -0.10 0.07 1 38 ASP 0.04 -0.11 1 39 ARG -0.08 -0.08 1 41 SER 0.01 -0.04 1 42 SER -0.39 0.19 1 45 ARG 0.67 -0.51 1 46 SER -0.24 0.07 1 47 ARG 0.01 -0.17 1 48 LYS 0.17 -0.27 1 50 LYS -0.05 -0.02 1 51 LYS -0.25 0.10 1 52 LYS -0.20 0.05 1 53 ASN -0.24 0.05 1 55 ASN 0.19 -0.07 1 56 LYS 0.47 -0.22 1 57 GLU -0.45 0.29 1 58 ASP 0.10 -0.02 1 59 LYS 0.16 -0.51 1 60 ARG 0.32 -0.30 1 62 ARG 0.19 -0.15 1 63 THR -0.39 -0.07 1 64 ALA -0.96 0.33 1 65 PHE -2.69 0.99 1 66 THR -2.41 1.12 1 67 ALA 4.42 -1.32 1 68 GLU 4.19 -0.89 1 69 GLN 4.94 -1.78 1 70 LEU 3.46 -0.70 1 71 GLN 4.59 -1.31 1 72 ARG 3.49 -2.04 1 73 LEU 6.96 -3.79 1 74 LYS 5.07 -0.68 1 75 ALA 3.59 -1.06 1 76 GLU 3.64 -1.36 1 77 PHE 3.39 -0.28 1 78 GLN 3.06 -0.89 1 79 THR 3.71 -0.55 1 80 ASN -0.58 0.91 1 81 ARG 2.06 -0.81 1 82 TYR -2.37 1.33 1 83 LEU -2.89 1.37 1 84 THR -2.76 1.27 1 85 GLU 4.39 -0.77 1 86 GLN 5.06 -1.49 1 87 ARG 2.96 -0.88 1 88 ARG 5.29 -0.82 1 89 GLN 4.70 -1.22 1 90 SER 4.60 -1.32 1 91 LEU 2.38 0.07 1 92 ALA 4.99 -1.27 1 93 GLN 3.85 -1.09 1 94 GLU 2.40 0.10 1 95 LEU -0.98 0.67 1 98 ASN -1.50 0.91 1 99 GLU 4.54 -0.22 1 100 SER 5.77 -1.87 1 101 GLN 2.71 0.29 1 102 ILE 5.02 -1.31 1 103 LYS 4.09 -0.16 1 104 ILE 4.04 -0.81 1 105 TRP 6.17 -0.53 1 106 PHE 5.14 0.04 1 107 GLN 4.44 -0.81 1 108 ASN 3.33 -1.18 1 109 LYS 3.32 -2.43 1 110 ARG 3.23 0.25 1 111 ALA 1.62 -0.51 1 112 LYS 0.93 -0.55 1 113 ILE 0.83 -0.54 1 114 LYS 0.39 -0.20 1 115 LYS 0.05 -0.02 1 116 ALA -0.15 0.18 1 117 THR 0.26 0.91 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 0.39 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.08 _LACS_plot.Line_2_terminator_val_x_2 6.96 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 LEU -7.08 0.38 0 109 LYS 3.32 -0.83 0 10 ASP 0.29 -0.02 1 11 SER 0.32 -0.04 1 12 ASP 0.23 -0.01 1 13 SER 0.59 -0.05 1 14 SER 1.00 -0.07 1 15 GLN 0.49 -0.03 1 16 ALA 0.35 -0.07 1 18 SER 0.12 0.00 1 19 ASN 0.22 -0.04 1 20 ALA 0.53 -0.08 1 22 ASN -0.06 -0.05 1 23 GLN 0.06 -0.04 1 25 MET 0.16 -0.20 1 26 LEU -0.26 -0.09 1 27 TRP -1.27 -0.11 1 29 ALA 1.73 -0.20 1 30 TRP 1.17 -0.05 1 32 TYR 0.23 -0.14 1 34 THR 0.77 -0.18 1 35 ARG 0.40 -0.06 1 36 TYR -0.01 -0.02 1 37 SER -0.10 -0.11 1 38 ASP 0.04 -0.06 1 39 ARG -0.08 -0.05 1 41 SER 0.01 -0.04 1 42 SER -0.39 0.04 1 45 ARG 0.67 -0.05 1 46 SER -0.24 -0.09 1 47 ARG 0.01 0.01 1 48 LYS 0.17 -0.03 1 50 LYS -0.05 -0.12 1 51 LYS -0.25 -0.07 1 52 LYS -0.20 -0.08 1 53 ASN -0.24 -0.08 1 55 ASN 0.19 -0.09 1 56 LYS 0.47 -0.07 1 57 GLU -0.45 -0.06 1 58 ASP 0.10 -0.09 1 59 LYS 0.16 0.01 1 60 ARG 0.32 -0.07 1 62 ARG 0.19 -0.01 1 63 THR -0.39 -0.14 1 64 ALA -0.96 -0.05 1 65 PHE -2.69 0.37 1 66 THR -2.41 0.07 1 67 ALA 4.42 -0.28 1 68 GLU 4.19 -0.37 1 69 GLN 4.94 -0.57 1 70 LEU 3.46 -0.78 1 71 GLN 4.59 -0.44 1 72 ARG 3.49 -0.17 1 73 LEU 6.96 -0.75 1 74 LYS 5.07 -0.37 1 75 ALA 3.59 -0.15 1 76 GLU 3.64 -0.28 1 77 PHE 3.39 -0.33 1 78 GLN 3.06 -0.39 1 79 THR 3.71 -0.29 1 80 ASN -0.58 -0.07 1 81 ARG 2.06 -0.62 1 82 TYR -2.37 0.02 1 83 LEU -2.89 0.07 1 84 THR -2.76 0.04 1 85 GLU 4.39 -0.56 1 86 GLN 5.06 -0.33 1 87 ARG 2.96 -0.22 1 88 ARG 5.29 -0.69 1 89 GLN 4.70 -0.41 1 90 SER 4.60 -0.25 1 91 LEU 2.38 -0.31 1 92 ALA 4.99 -0.59 1 93 GLN 3.85 -0.29 1 94 GLU 2.40 -0.38 1 95 LEU -0.98 0.01 1 98 ASN -1.50 0.13 1 99 GLU 4.54 -0.67 1 100 SER 5.77 -0.30 1 101 GLN 2.71 -0.17 1 102 ILE 5.02 -0.37 1 103 LYS 4.09 -0.19 1 104 ILE 4.04 -0.34 1 105 TRP 6.17 -0.58 1 106 PHE 5.14 -0.85 1 107 GLN 4.44 -0.41 1 108 ASN 3.33 -0.41 1 110 ARG 3.23 -0.27 1 111 ALA 1.62 -0.15 1 112 LYS 0.93 -0.16 1 113 ILE 0.83 -0.11 1 114 LYS 0.39 -0.04 1 115 LYS 0.05 -0.05 1 116 ALA -0.15 0.05 1 117 THR 0.26 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17325_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -3.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.16 _LACS_plot.Line_2_terminator_val_x_2 6.96 _LACS_plot.Line_2_terminator_val_y_2 3.56 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 THR 0.26 4.58 0 10 ASP 0.29 0.23 1 11 SER 0.32 -0.03 1 12 ASP 0.23 0.50 1 13 SER 0.59 0.61 1 14 SER 1.00 0.36 1 15 GLN 0.49 -0.03 1 16 ALA 0.35 0.60 1 18 SER 0.12 0.04 1 19 ASN 0.22 -0.05 1 20 ALA 0.53 0.45 1 22 ASN -0.06 -0.26 1 23 GLN 0.06 -0.52 1 25 MET 0.16 -0.58 1 26 LEU -0.26 -1.16 1 27 TRP -1.27 -0.69 1 29 ALA 1.73 0.48 1 30 TRP 1.17 0.62 1 31 VAL 1.76 -0.31 1 32 TYR 0.23 0.02 1 34 THR 0.77 -0.17 1 35 ARG 0.40 -0.25 1 36 TYR -0.01 0.13 1 37 SER -0.10 -0.58 1 38 ASP 0.04 -0.54 1 39 ARG -0.08 -0.30 1 41 SER 0.01 0.07 1 42 SER -0.39 -0.07 1 45 ARG 0.67 0.23 1 46 SER -0.24 -0.16 1 47 ARG 0.01 -0.32 1 48 LYS 0.17 -0.36 1 50 LYS -0.05 0.03 1 51 LYS -0.25 -0.26 1 52 LYS -0.20 -0.57 1 53 ASN -0.24 0.07 1 55 ASN 0.19 0.14 1 56 LYS 0.47 -0.08 1 57 GLU -0.45 -0.44 1 58 ASP 0.10 -0.07 1 59 LYS 0.16 -0.15 1 60 ARG 0.32 -0.20 1 62 ARG 0.19 0.24 1 63 THR -0.39 -1.01 1 64 ALA -0.96 -0.65 1 65 PHE -2.69 1.34 1 66 THR -2.41 0.58 1 67 ALA 4.42 2.96 1 68 GLU 4.19 3.21 1 69 GLN 4.94 1.90 1 70 LEU 3.46 1.11 1 71 GLN 4.59 3.13 1 72 ARG 3.49 2.32 1 73 LEU 6.96 0.65 1 74 LYS 5.07 2.78 1 75 ALA 3.59 3.32 1 76 GLU 3.64 2.32 1 77 PHE 3.39 0.40 1 78 GLN 3.06 1.85 1 79 THR 3.71 -0.02 1 80 ASN -0.58 -1.57 1 81 ARG 2.06 -1.62 1 82 TYR -2.37 -0.85 1 83 LEU -2.89 -0.14 1 84 THR -2.76 0.45 1 85 GLU 4.39 1.88 1 86 GLN 5.06 2.81 1 87 ARG 2.96 1.76 1 88 ARG 5.29 1.34 1 89 GLN 4.70 2.84 1 90 SER 4.60 2.80 1 91 LEU 2.38 0.74 1 92 ALA 4.99 2.13 1 93 GLN 3.85 2.97 1 94 GLU 2.40 2.11 1 95 LEU -0.98 -0.12 1 97 LEU -7.08 -2.19 1 98 ASN -1.50 2.08 1 99 GLU 4.54 1.79 1 100 SER 5.77 1.94 1 101 GLN 2.71 3.38 1 102 ILE 5.02 0.75 1 103 LYS 4.09 2.92 1 104 ILE 4.04 1.00 1 105 TRP 6.17 3.39 1 106 PHE 5.14 2.30 1 107 GLN 4.44 3.01 1 108 ASN 3.33 2.29 1 109 LYS 3.32 2.43 1 110 ARG 3.23 1.67 1 111 ALA 1.62 0.68 1 112 LYS 0.93 0.55 1 113 ILE 0.83 -0.14 1 114 LYS 0.39 -0.19 1 115 LYS 0.05 -0.57 1 116 ALA -0.15 -0.76 1 stop_ save_