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 bmr18901_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 -2.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 3.93 _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 51 SER -3.90 -5.60 0 119 THR -5.68 -6.20 0 32 THR 5.26 -1.33 0 12 ALA 1.76 0.26 1 13 ILE 2.17 1.24 1 14 LYS -2.84 -0.65 1 15 ILE -2.11 -0.29 1 16 SER -3.59 -1.64 1 17 LYS -0.40 1.07 1 18 SER -1.41 0.28 1 20 ASP -0.96 -0.64 1 22 ALA -3.75 -1.72 1 23 HIS -1.72 -0.73 1 24 LEU -2.13 0.43 1 25 THR -3.22 -1.00 1 26 TRP -1.37 -0.81 1 27 GLU -2.94 -1.31 1 30 SER -2.30 -1.33 1 31 VAL -0.29 -0.42 1 33 SER 3.72 2.13 1 35 LYS -1.68 -0.53 1 36 ILE 1.31 -2.18 1 37 ILE -1.16 -0.16 1 38 GLU -5.20 -0.62 1 39 TYR -5.93 -0.99 1 40 SER -5.37 0.43 1 41 VAL -3.32 -1.53 1 42 TYR -5.74 -2.14 1 43 LEU -7.90 -1.75 1 44 ALA -0.31 -0.76 1 45 ILE -3.97 -0.98 1 46 GLN -0.33 0.11 1 47 SER -0.73 -0.34 1 48 SER -0.03 0.10 1 49 GLN -0.21 0.14 1 50 ALA -0.23 0.12 1 53 GLU -0.79 -0.15 1 55 LYS 0.35 0.50 1 56 SER 2.29 1.79 1 57 SER -0.05 0.03 1 58 THR 0.17 0.14 1 60 ALA -0.36 0.00 1 61 GLN -0.82 -0.18 1 62 LEU -1.42 -0.53 1 63 ALA -3.25 -1.70 1 64 PHE -3.18 0.03 1 65 MET -5.35 -1.42 1 66 ARG 1.79 1.96 1 67 VAL -1.79 -1.28 1 68 TYR -3.86 0.40 1 72 SER 0.52 0.47 1 74 SER -2.44 -1.59 1 76 LEU -3.56 -1.73 1 77 VAL -0.33 -0.55 1 78 GLN 0.22 1.22 1 79 SER 5.16 4.15 1 80 SER 4.33 2.89 1 81 SER 3.80 3.13 1 82 LEU 2.21 1.60 1 83 SER 3.15 2.89 1 84 ASN -1.22 -0.43 1 85 ALA -0.16 0.56 1 86 HIS 0.42 0.62 1 87 ILE -0.31 -1.67 1 88 ASP -3.62 -0.96 1 89 TYR 1.07 0.73 1 90 THR 4.85 3.81 1 91 THR -0.13 -0.51 1 92 LYS 3.41 0.23 1 94 ALA -5.23 -1.49 1 95 ILE -2.53 -0.67 1 96 ILE -1.91 -0.81 1 97 PHE -6.02 -1.93 1 98 ARG -5.76 -1.04 1 99 ILE -2.78 -0.17 1 100 ALA -6.63 -1.14 1 101 ALA -7.45 -1.93 1 102 ARG -4.20 -1.93 1 103 ASN -2.56 -1.80 1 104 GLU 4.05 3.31 1 105 LYS 0.90 0.85 1 107 TYR 0.13 1.90 1 110 ALA -3.24 -2.23 1 111 THR -0.25 -0.08 1 112 GLN -3.25 -0.90 1 113 VAL -5.08 -1.92 1 114 ARG -2.40 -1.25 1 115 TRP -3.43 -2.98 1 116 LEU 1.27 0.60 1 117 GLN -0.53 1.74 1 118 GLU -1.39 -1.92 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18901_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 5.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.71 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _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 51 SER -3.90 -1.70 0 119 THR -5.68 -0.52 0 32 THR 5.26 -6.59 0 12 ALA 1.76 -1.50 1 13 ILE 2.17 -0.93 1 14 LYS -2.84 2.19 1 15 ILE -2.11 1.82 1 16 SER -3.59 1.95 1 17 LYS -0.40 1.47 1 18 SER -1.41 1.69 1 20 ASP -0.96 0.32 1 22 ALA -3.75 2.03 1 23 HIS -1.72 0.99 1 24 LEU -2.13 2.56 1 25 THR -3.22 2.22 1 26 TRP -1.37 0.56 1 27 GLU -2.94 1.63 1 30 SER -2.30 0.97 1 31 VAL -0.29 -0.13 1 33 SER 3.72 -1.59 1 35 LYS -1.68 1.15 1 36 ILE 1.31 -3.49 1 37 ILE -1.16 1.00 1 38 GLU -5.20 4.58 1 39 TYR -5.93 4.94 1 40 SER -5.37 5.80 1 41 VAL -3.32 1.79 1 42 TYR -5.74 3.60 1 43 LEU -7.90 6.15 1 44 ALA -0.31 -0.45 1 45 ILE -3.97 2.99 1 46 GLN -0.33 0.44 1 47 SER -0.73 0.39 1 48 SER -0.03 0.13 1 49 GLN -0.21 0.35 1 50 ALA -0.23 0.35 1 53 GLU -0.79 0.64 1 55 LYS 0.35 0.15 1 56 SER 2.29 -0.50 1 57 SER -0.05 0.08 1 58 THR 0.17 -0.03 1 60 ALA -0.36 0.36 1 61 GLN -0.82 0.64 1 62 LEU -1.42 0.89 1 63 ALA -3.25 1.55 1 64 PHE -3.18 3.21 1 65 MET -5.35 3.93 1 66 ARG 1.79 0.17 1 67 VAL -1.79 0.51 1 68 TYR -3.86 4.26 1 72 SER 0.52 -0.05 1 74 SER -2.44 0.85 1 76 LEU -3.56 1.83 1 77 VAL -0.33 -0.22 1 78 GLN 0.22 1.00 1 79 SER 5.16 -1.01 1 80 SER 4.33 -1.44 1 81 SER 3.80 -0.67 1 82 LEU 2.21 -0.61 1 83 SER 3.15 -0.26 1 84 ASN -1.22 0.79 1 85 ALA -0.16 0.72 1 86 HIS 0.42 0.20 1 87 ILE -0.31 -1.36 1 88 ASP -3.62 2.66 1 89 TYR 1.07 -0.34 1 90 THR 4.85 -1.04 1 91 THR -0.13 -0.38 1 92 LYS 3.41 -3.18 1 94 ALA -5.23 3.74 1 95 ILE -2.53 1.86 1 96 ILE -1.91 1.10 1 97 PHE -6.02 4.09 1 98 ARG -5.76 4.72 1 99 ILE -2.78 2.61 1 100 ALA -6.63 5.49 1 101 ALA -7.45 5.52 1 102 ARG -4.20 2.27 1 103 ASN -2.56 0.76 1 104 GLU 4.05 -0.74 1 105 LYS 0.90 -0.05 1 107 TYR 0.13 1.77 1 110 ALA -3.24 1.01 1 111 THR -0.25 0.17 1 112 GLN -3.25 2.35 1 113 VAL -5.08 3.16 1 114 ARG -2.40 1.15 1 115 TRP -3.43 0.45 1 116 LEU 1.27 -0.67 1 117 GLN -0.53 2.27 1 118 GLU -1.39 -0.53 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18901_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _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 118 GLU -1.39 -0.95 0 12 ALA 1.76 -0.39 1 13 ILE 2.17 0.28 1 14 LYS -2.84 0.28 1 15 ILE -2.11 0.41 1 16 SER -3.59 0.46 1 17 LYS -0.40 0.34 1 18 SER -1.41 0.30 1 20 ASP -0.96 0.04 1 22 ALA -3.75 0.47 1 23 HIS -1.72 0.25 1 24 LEU -2.13 0.84 1 25 THR -3.22 -0.16 1 26 TRP -1.37 0.37 1 27 GLU -2.94 0.19 1 30 SER -2.30 -0.56 1 31 VAL -0.29 0.09 1 32 THR 5.26 -0.17 1 33 SER 3.72 -0.29 1 35 LYS -1.68 -0.01 1 36 ILE 1.31 -0.05 1 37 ILE -1.16 0.05 1 38 GLU -5.20 -0.18 1 39 TYR -5.93 1.15 1 40 SER -5.37 1.03 1 41 VAL -3.32 0.72 1 42 TYR -5.74 0.95 1 43 LEU -7.90 0.91 1 44 ALA -0.31 0.00 1 45 ILE -3.97 0.57 1 46 GLN -0.33 0.07 1 47 SER -0.73 -0.02 1 48 SER -0.03 -0.02 1 49 GLN -0.21 -0.03 1 50 ALA -0.23 -0.01 1 51 SER -3.90 -0.16 1 53 GLU -0.79 -0.08 1 55 LYS 0.35 -0.06 1 56 SER 2.29 0.09 1 57 SER -0.05 -0.01 1 58 THR 0.17 -0.01 1 60 ALA -0.36 -0.10 1 61 GLN -0.82 -0.06 1 62 LEU -1.42 -0.21 1 63 ALA -3.25 0.18 1 64 PHE -3.18 0.46 1 65 MET -5.35 0.42 1 66 ARG 1.79 -0.20 1 67 VAL -1.79 0.59 1 68 TYR -3.86 0.23 1 72 SER 0.52 0.07 1 74 SER -2.44 -0.56 1 76 LEU -3.56 0.48 1 77 VAL -0.33 0.13 1 78 GLN 0.22 0.17 1 79 SER 5.16 -0.38 1 80 SER 4.33 -0.26 1 81 SER 3.80 -0.01 1 82 LEU 2.21 -0.31 1 83 SER 3.15 -0.26 1 84 ASN -1.22 0.18 1 85 ALA -0.16 -0.07 1 86 HIS 0.42 -0.32 1 87 ILE -0.31 -0.12 1 88 ASP -3.62 -0.13 1 89 TYR 1.07 -0.17 1 90 THR 4.85 -0.38 1 91 THR -0.13 -0.06 1 92 LYS 3.41 -0.15 1 94 ALA -5.23 0.55 1 95 ILE -2.53 0.12 1 96 ILE -1.91 0.78 1 97 PHE -6.02 1.40 1 98 ARG -5.76 1.10 1 99 ILE -2.78 0.85 1 100 ALA -6.63 0.57 1 101 ALA -7.45 0.80 1 102 ARG -4.20 0.25 1 103 ASN -2.56 0.71 1 104 GLU 4.05 -0.50 1 105 LYS 0.90 -0.06 1 107 TYR 0.13 0.20 1 110 ALA -3.24 0.55 1 111 THR -0.25 0.05 1 112 GLN -3.25 1.00 1 113 VAL -5.08 0.45 1 114 ARG -2.40 0.59 1 115 TRP -3.43 0.60 1 116 LEU 1.27 -0.08 1 117 GLN -0.53 -0.29 1 119 THR -5.68 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18901_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 -2.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.37 _LACS_plot.Line_2_terminator_val_x_2 5.16 _LACS_plot.Line_2_terminator_val_y_2 1.82 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 PHE -6.02 1.24 0 38 GLU -5.20 -4.74 0 12 ALA 1.76 -1.80 1 13 ILE 2.17 1.11 1 14 LYS -2.84 -1.09 1 15 ILE -2.11 -0.42 1 16 SER -3.59 -0.88 1 17 LYS -0.40 -0.79 1 20 ASP -0.96 0.37 1 22 ALA -3.75 -2.00 1 23 HIS -1.72 0.10 1 24 LEU -2.13 -1.17 1 25 THR -3.22 -1.98 1 26 TRP -1.37 -2.67 1 33 SER 3.72 -0.27 1 35 LYS -1.68 -0.34 1 36 ILE 1.31 1.35 1 37 ILE -1.16 -0.31 1 39 TYR -5.93 0.29 1 40 SER -5.37 -1.71 1 41 VAL -3.32 -1.19 1 42 TYR -5.74 -1.24 1 43 LEU -7.90 -1.30 1 44 ALA -0.31 0.52 1 45 ILE -3.97 -0.46 1 46 GLN -0.33 0.35 1 47 SER -0.73 0.50 1 49 GLN -0.21 0.42 1 50 ALA -0.23 0.58 1 51 SER -3.90 1.14 1 55 LYS 0.35 0.75 1 56 SER 2.29 0.68 1 57 SER -0.05 0.39 1 60 ALA -0.36 0.48 1 61 GLN -0.82 0.15 1 62 LEU -1.42 -1.40 1 63 ALA -3.25 -1.55 1 64 PHE -3.18 0.60 1 66 ARG 1.79 0.62 1 67 VAL -1.79 -0.52 1 68 TYR -3.86 -2.19 1 76 LEU -3.56 -0.81 1 77 VAL -0.33 -0.77 1 78 GLN 0.22 2.81 1 79 SER 5.16 2.58 1 80 SER 4.33 3.25 1 81 SER 3.80 1.10 1 82 LEU 2.21 1.84 1 83 SER 3.15 0.66 1 84 ASN -1.22 -0.14 1 85 ALA -0.16 0.31 1 86 HIS 0.42 1.23 1 87 ILE -0.31 -1.68 1 88 ASP -3.62 0.21 1 89 TYR 1.07 0.73 1 90 THR 4.85 1.60 1 91 THR -0.13 -0.06 1 94 ALA -5.23 -2.01 1 95 ILE -2.53 -1.34 1 96 ILE -1.91 -0.79 1 98 ARG -5.76 -0.18 1 99 ILE -2.78 -1.91 1 100 ALA -6.63 -2.76 1 101 ALA -7.45 -3.49 1 102 ARG -4.20 0.35 1 103 ASN -2.56 1.13 1 104 GLU 4.05 1.12 1 105 LYS 0.90 1.07 1 107 TYR 0.13 2.87 1 110 ALA -3.24 1.60 1 111 THR -0.25 -1.25 1 112 GLN -3.25 -0.56 1 113 VAL -5.08 -2.41 1 114 ARG -2.40 -0.62 1 stop_ save_