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 bmr19625_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.36 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 7.68 _LACS_plot.Y_axis_chem_shift_offset -1.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 PHE 9.34 4.01 0 10 LEU -0.40 -1.30 1 11 TYR -3.50 -0.80 1 12 GLU -1.40 -0.90 1 13 ARG -4.66 -0.20 1 14 LEU -4.10 1.30 1 15 SER -1.50 0.00 1 16 ARG 4.00 3.50 1 17 ASP 1.40 0.40 1 18 ASP 0.46 2.10 1 19 ASP 1.87 1.83 1 20 LEU -1.08 0.00 1 21 THR -1.23 0.17 1 23 GLU 1.60 2.30 1 24 SER 3.51 3.31 1 25 ASN -1.90 0.00 1 26 SER -1.00 0.20 1 27 ILE 4.74 2.34 1 28 THR 6.06 5.50 1 29 ASN 4.20 4.00 1 30 GLN 3.15 5.81 1 31 LYS 4.62 5.10 1 32 LYS 3.60 4.00 1 33 TYR 2.55 4.00 1 34 LEU 3.30 3.90 1 35 GLU 4.40 4.90 1 36 ASP 3.90 4.20 1 37 TYR 4.24 5.10 1 38 ALA 3.80 3.60 1 39 ARG 4.50 4.20 1 40 ARG 3.70 3.50 1 41 ASN -0.50 1.30 1 43 PHE 1.40 1.30 1 44 GLU -4.89 -1.09 1 45 ASN 2.30 1.10 1 46 ILE 0.10 1.20 1 47 ARG -4.30 -0.10 1 48 HIS -1.00 2.50 1 49 PHE -2.20 0.70 1 50 THR -1.10 1.40 1 51 ASP -2.40 0.80 1 52 ASP -0.35 0.65 1 54 PHE -2.80 0.50 1 55 SER 0.90 0.70 1 57 VAL 2.64 2.35 1 58 ASN -3.58 -0.58 1 59 PHE 2.60 1.60 1 60 ASN 1.70 -0.10 1 61 ARG -5.27 -3.41 1 64 PHE 4.60 5.60 1 65 GLN 5.40 4.40 1 66 SER 4.55 4.63 1 67 LEU 4.60 3.30 1 68 ILE 4.70 1.00 1 69 LYS 5.10 4.60 1 70 GLU 3.10 2.90 1 71 VAL 4.60 3.90 1 72 GLU 3.66 4.20 1 73 ALA 0.00 0.90 1 75 ASN -0.40 1.30 1 76 VAL -0.80 0.50 1 77 GLU -0.20 2.00 1 78 THR -2.60 -0.30 1 79 LEU -4.80 -0.90 1 80 ILE -2.40 -0.60 1 81 VAL -7.80 -3.10 1 82 LYS 4.10 5.30 1 83 ASP -3.70 -0.40 1 84 MET 4.04 3.60 1 85 SER 3.30 3.40 1 86 ARG 0.68 3.36 1 87 LEU 2.70 4.00 1 89 ARG -0.71 1.00 1 90 ASN -0.31 0.25 1 91 TYR 4.58 4.07 1 92 LEU 3.60 3.40 1 93 GLN 2.40 3.10 1 94 VAL 5.40 5.30 1 96 PHE 4.70 4.40 1 97 TYR 5.80 4.80 1 98 THR 4.40 3.40 1 99 GLU -0.20 0.60 1 100 VAL 3.00 2.80 1 101 LEU 3.89 4.60 1 104 GLN 4.00 4.00 1 105 LYS -1.00 -2.40 1 106 ASN 3.20 2.10 1 107 VAL -1.40 -0.10 1 108 ARG 0.49 0.69 1 109 PHE -3.86 -0.57 1 110 LEU -4.79 -0.49 1 111 ALA -3.60 -2.70 1 112 ILE 4.96 5.20 1 113 ASN -0.25 0.51 1 114 ASN -0.46 1.24 1 115 SER 0.56 0.96 1 116 ILE -0.01 1.09 1 117 ASP -0.81 0.58 1 118 SER 0.77 1.47 1 119 ASN 0.30 1.10 1 120 ASN 0.25 2.67 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19625_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 5.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.64 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 -1.66 _LACS_plot.Y_axis_chem_shift_offset -1.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 PHE 9.34 -5.33 0 10 LEU -0.40 -0.90 1 11 TYR -3.50 2.70 1 12 GLU -1.40 0.50 1 13 ARG -4.66 4.46 1 14 LEU -4.10 5.40 1 15 SER -1.50 1.50 1 16 ARG 4.00 -0.50 1 17 ASP 1.40 -1.00 1 18 ASP 0.46 1.64 1 19 ASP 1.87 -0.04 1 20 LEU -1.08 1.08 1 21 THR -1.23 1.40 1 23 GLU 1.60 0.70 1 24 SER 3.51 -0.20 1 25 ASN -1.90 1.90 1 26 SER -1.00 1.20 1 27 ILE 4.74 -2.40 1 28 THR 6.06 -0.56 1 29 ASN 4.20 -0.20 1 30 GLN 3.15 2.66 1 31 LYS 4.62 0.48 1 32 LYS 3.60 0.40 1 33 TYR 2.55 1.45 1 34 LEU 3.30 0.60 1 35 GLU 4.40 0.50 1 36 ASP 3.90 0.30 1 37 TYR 4.24 0.86 1 38 ALA 3.80 -0.20 1 39 ARG 4.50 -0.30 1 40 ARG 3.70 -0.20 1 41 ASN -0.50 1.80 1 43 PHE 1.40 -0.10 1 44 GLU -4.89 3.80 1 45 ASN 2.30 -1.20 1 46 ILE 0.10 1.10 1 47 ARG -4.30 4.20 1 48 HIS -1.00 3.50 1 49 PHE -2.20 2.90 1 50 THR -1.10 2.50 1 51 ASP -2.40 3.20 1 52 ASP -0.35 1.00 1 54 PHE -2.80 3.30 1 55 SER 0.90 -0.20 1 57 VAL 2.64 -0.29 1 58 ASN -3.58 3.00 1 59 PHE 2.60 -1.00 1 60 ASN 1.70 -1.80 1 61 ARG -5.27 1.86 1 64 PHE 4.60 1.00 1 65 GLN 5.40 -1.00 1 66 SER 4.55 0.08 1 67 LEU 4.60 -1.30 1 68 ILE 4.70 -3.70 1 69 LYS 5.10 -0.50 1 70 GLU 3.10 -0.20 1 71 VAL 4.60 -0.70 1 72 GLU 3.66 0.54 1 73 ALA 0.00 0.90 1 75 ASN -0.40 1.70 1 76 VAL -0.80 1.30 1 77 GLU -0.20 2.20 1 78 THR -2.60 2.30 1 79 LEU -4.80 3.90 1 80 ILE -2.40 1.80 1 81 VAL -7.80 4.70 1 82 LYS 4.10 1.20 1 83 ASP -3.70 3.30 1 84 MET 4.04 -0.44 1 85 SER 3.30 0.10 1 86 ARG 0.68 2.68 1 87 LEU 2.70 1.30 1 89 ARG -0.71 1.71 1 90 ASN -0.31 0.56 1 91 TYR 4.58 -0.51 1 92 LEU 3.60 -0.20 1 93 GLN 2.40 0.70 1 94 VAL 5.40 -0.10 1 96 PHE 4.70 -0.30 1 97 TYR 5.80 -1.00 1 98 THR 4.40 -1.00 1 99 GLU -0.20 0.80 1 100 VAL 3.00 -0.20 1 101 LEU 3.89 0.71 1 104 GLN 4.00 0.00 1 105 LYS -1.00 -1.40 1 106 ASN 3.20 -1.10 1 107 VAL -1.40 1.30 1 108 ARG 0.49 0.20 1 109 PHE -3.86 3.29 1 110 LEU -4.79 4.30 1 111 ALA -3.60 0.90 1 112 ILE 4.96 0.24 1 113 ASN -0.25 0.76 1 114 ASN -0.46 1.70 1 115 SER 0.56 0.40 1 116 ILE -0.01 1.10 1 117 ASP -0.81 1.39 1 118 SER 0.77 0.70 1 119 ASN 0.30 0.80 1 120 ASN 0.25 2.42 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19625_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 0.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.02 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 -1.01 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 TYR -3.50 1.28 0 10 LEU -0.40 0.49 1 12 GLU -1.40 -0.15 1 13 ARG -4.66 0.53 1 14 LEU -4.10 0.05 1 15 SER -1.50 0.05 1 16 ARG 4.00 -0.38 1 17 ASP 1.40 -0.34 1 18 ASP 0.46 -0.34 1 19 ASP 1.87 -0.41 1 20 LEU -1.08 0.04 1 21 THR -1.23 -0.06 1 23 GLU 1.60 -0.35 1 24 SER 3.51 -0.48 1 25 ASN -1.90 -0.01 1 26 SER -1.00 -0.33 1 27 ILE 4.74 -0.71 1 28 THR 6.06 -0.84 1 29 ASN 4.20 -0.34 1 30 GLN 3.15 -0.49 1 31 LYS 4.62 -0.49 1 32 LYS 3.60 -0.47 1 33 TYR 2.55 -0.41 1 34 LEU 3.30 -0.56 1 35 GLU 4.40 -0.75 1 36 ASP 3.90 -0.44 1 37 TYR 4.24 -0.97 1 38 ALA 3.80 -0.40 1 39 ARG 4.50 -0.40 1 40 ARG 3.70 -0.49 1 41 ASN -0.50 -0.42 1 43 PHE 1.40 -0.28 1 44 GLU -4.89 0.02 1 45 ASN 2.30 -0.58 1 46 ILE 0.10 0.21 1 47 ARG -4.30 -0.09 1 48 HIS -1.00 0.45 1 49 PHE -2.20 -0.14 1 50 THR -1.10 0.37 1 51 ASP -2.40 0.63 1 52 ASP -0.35 -0.13 1 54 PHE -2.80 -0.14 1 55 SER 0.90 -0.28 1 57 VAL 2.64 -0.50 1 58 ASN -3.58 -0.26 1 59 PHE 2.60 -0.68 1 60 ASN 1.70 -0.01 1 61 ARG -5.27 -0.25 1 64 PHE 4.60 -1.06 1 65 GLN 5.40 -0.65 1 66 SER 4.55 -0.39 1 67 LEU 4.60 -1.52 1 68 ILE 4.70 -0.93 1 69 LYS 5.10 -0.42 1 70 GLU 3.10 -0.29 1 71 VAL 4.60 -0.64 1 72 GLU 3.66 -0.79 1 73 ALA 0.00 -0.20 1 75 ASN -0.40 -0.04 1 76 VAL -0.80 -0.17 1 77 GLU -0.20 -0.03 1 78 THR -2.60 0.66 1 79 LEU -4.80 0.77 1 80 ILE -2.40 0.72 1 81 VAL -7.80 0.79 1 82 LYS 4.10 -0.67 1 83 ASP -3.70 -0.08 1 84 MET 4.04 -0.29 1 85 SER 3.30 -0.16 1 86 ARG 0.68 -0.62 1 87 LEU 2.70 -0.43 1 89 ARG -0.71 -0.30 1 90 ASN -0.31 -0.12 1 91 TYR 4.58 -0.56 1 92 LEU 3.60 -0.50 1 93 GLN 2.40 -0.40 1 94 VAL 5.40 -0.60 1 96 PHE 4.70 -0.83 1 97 TYR 5.80 -1.62 1 98 THR 4.40 -0.96 1 99 GLU -0.20 -0.14 1 100 VAL 3.00 -0.30 1 101 LEU 3.89 -0.72 1 102 PHE 9.34 -0.54 1 104 GLN 4.00 -0.46 1 105 LYS -1.00 0.00 1 106 ASN 3.20 -0.60 1 107 VAL -1.40 -0.39 1 108 ARG 0.49 -0.17 1 109 PHE -3.86 0.49 1 110 LEU -4.79 -0.25 1 111 ALA -3.60 0.26 1 112 ILE 4.96 -1.03 1 113 ASN -0.25 0.00 1 114 ASN -0.46 -0.14 1 115 SER 0.56 -0.15 1 116 ILE -0.01 -0.15 1 117 ASP -0.81 -0.05 1 118 SER 0.77 -0.22 1 119 ASN 0.30 -0.16 1 120 ASN 0.25 -0.45 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19625_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -3.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 6.06 _LACS_plot.Line_2_terminator_val_y_2 1.96 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 VAL -7.80 -0.99 0 10 LEU -0.40 -3.20 1 11 TYR -3.50 -1.78 1 12 GLU -1.40 -3.88 1 13 ARG -4.66 -1.62 1 14 LEU -4.10 -4.67 1 15 SER -1.50 0.78 1 16 ARG 4.00 1.11 1 17 ASP 1.40 -0.21 1 18 ASP 0.46 -0.55 1 19 ASP 1.87 -1.00 1 20 LEU -1.08 -0.77 1 21 THR -1.23 0.20 1 23 GLU 1.60 1.60 1 24 SER 3.51 -0.60 1 25 ASN -1.90 -0.82 1 26 SER -1.00 0.06 1 27 ILE 4.74 1.14 1 28 THR 6.06 1.51 1 29 ASN 4.20 -0.09 1 31 LYS 4.62 1.77 1 32 LYS 3.60 1.24 1 33 TYR 2.55 3.09 1 34 LEU 3.30 0.77 1 35 GLU 4.40 1.88 1 37 TYR 4.24 2.37 1 38 ALA 3.80 0.97 1 39 ARG 4.50 4.25 1 40 ARG 3.70 0.71 1 41 ASN -0.50 -1.65 1 43 PHE 1.40 -0.90 1 44 GLU -4.89 -0.73 1 45 ASN 2.30 -0.47 1 46 ILE 0.10 0.97 1 47 ARG -4.30 -2.40 1 48 HIS -1.00 1.27 1 49 PHE -2.20 -2.04 1 50 THR -1.10 -2.06 1 51 ASP -2.40 -2.77 1 52 ASP -0.35 -1.21 1 54 PHE -2.80 -1.56 1 55 SER 0.90 0.89 1 57 VAL 2.64 -2.50 1 58 ASN -3.58 -0.89 1 59 PHE 2.60 -0.49 1 60 ASN 1.70 -2.34 1 64 PHE 4.60 0.53 1 65 GLN 5.40 3.24 1 66 SER 4.55 1.32 1 67 LEU 4.60 0.19 1 68 ILE 4.70 1.33 1 69 LYS 5.10 3.45 1 70 GLU 3.10 2.26 1 71 VAL 4.60 4.08 1 72 GLU 3.66 0.87 1 73 ALA 0.00 -0.45 1 75 ASN -0.40 -1.10 1 76 VAL -0.80 -3.11 1 77 GLU -0.20 -0.75 1 78 THR -2.60 -4.36 1 79 LEU -4.80 -4.96 1 80 ILE -2.40 -2.14 1 82 LYS 4.10 -2.13 1 83 ASP -3.70 -0.99 1 84 MET 4.04 1.61 1 85 SER 3.30 2.41 1 86 ARG 0.68 3.21 1 87 LEU 2.70 -0.52 1 89 ARG -0.71 1.24 1 90 ASN -0.31 0.22 1 91 TYR 4.58 1.57 1 92 LEU 3.60 1.98 1 93 GLN 2.40 2.63 1 94 VAL 5.40 1.12 1 96 PHE 4.70 0.98 1 97 TYR 5.80 -0.40 1 98 THR 4.40 2.13 1 99 GLU -0.20 0.22 1 100 VAL 3.00 -0.10 1 101 LEU 3.89 -0.09 1 104 GLN 4.00 1.70 1 105 LYS -1.00 -1.72 1 106 ASN 3.20 -1.80 1 107 VAL -1.40 -1.02 1 108 ARG 0.49 -3.28 1 110 LEU -4.79 -5.24 1 111 ALA -3.60 -0.33 1 112 ILE 4.96 0.95 1 113 ASN -0.25 -0.09 1 114 ASN -0.46 -0.33 1 115 SER 0.56 -0.48 1 116 ILE -0.01 -0.81 1 117 ASP -0.81 -1.43 1 118 SER 0.77 -0.34 1 119 ASN 0.30 -1.08 1 stop_ save_