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 bmr6866_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.63 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.38 _LACS_plot.Line_2_terminator_val_x_2 6.11 _LACS_plot.Line_2_terminator_val_y_2 4.54 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 HIS 3.07 5.14 0 46 HIS -3.13 1.48 0 50 ARG -8.63 -2.98 0 10 LEU -3.38 -0.59 1 11 GLU -5.41 -1.55 1 12 VAL -4.69 -1.90 1 13 HIS -4.59 -0.09 1 14 ILE -0.21 -0.31 1 16 SER -3.32 -1.17 1 17 VAL -5.00 -3.48 1 20 GLU -0.47 0.55 1 21 ALA -1.14 -0.33 1 22 GLU -1.09 -0.28 1 25 ARG 0.67 0.24 1 26 GLN -0.22 0.09 1 27 SER -0.75 -0.24 1 29 GLU 0.93 0.66 1 30 LYS 0.43 0.05 1 31 SER -0.06 0.18 1 32 HIS -1.11 1.01 1 33 MET -0.84 -0.87 1 34 VAL -2.92 -1.50 1 35 PHE 0.69 0.05 1 36 ARG 2.84 0.90 1 37 VAL 2.33 0.53 1 38 GLU -3.26 -0.95 1 39 VAL -1.57 -0.94 1 40 LEU -2.99 -1.40 1 42 SER 2.27 0.76 1 44 ARG -2.23 -0.99 1 45 ARG -4.17 -1.32 1 47 THR -1.95 -0.71 1 48 VAL -4.02 -1.63 1 51 ARG -1.68 -0.04 1 52 TYR 5.66 5.64 1 54 GLU 2.09 2.90 1 55 PHE 4.90 4.15 1 56 HIS 2.37 3.77 1 57 ALA 3.37 2.50 1 58 LEU 4.79 3.24 1 60 LYS 4.18 3.43 1 61 ARG 2.07 2.39 1 62 ILE 1.40 2.30 1 63 LYS 4.83 2.55 1 64 LYS 1.64 1.04 1 65 LEU -2.65 0.44 1 66 TYR -3.47 -1.89 1 67 LYS 0.76 0.40 1 68 VAL -3.83 -2.41 1 70 ASP 1.17 0.95 1 71 PHE 0.01 0.07 1 73 SER -2.36 -2.17 1 74 LYS 2.01 -0.54 1 75 ARG -0.16 0.12 1 76 LEU -0.56 -0.34 1 78 ASN 1.56 0.49 1 79 TRP 1.84 1.33 1 80 ARG 3.04 2.29 1 82 ARG 1.46 0.85 1 84 LEU 3.70 3.14 1 85 GLU 3.00 1.78 1 86 GLN 4.46 3.25 1 87 ARG 3.53 3.01 1 88 ARG 5.50 4.75 1 89 GLN 4.84 3.90 1 91 LEU 4.29 2.25 1 92 GLU 3.11 4.05 1 93 ALA 3.40 2.33 1 94 TYR 4.07 4.01 1 95 ILE 4.54 2.36 1 96 GLN 5.27 3.57 1 98 ILE 6.06 5.30 1 99 LEU 3.32 2.03 1 100 TYR 1.56 1.55 1 101 LEU -0.85 1.06 1 102 ASN -3.92 -0.40 1 103 GLN 3.25 2.75 1 104 GLU -3.91 -2.54 1 105 VAL 1.38 0.91 1 107 LYS 5.36 3.89 1 108 GLU 4.46 3.74 1 109 LEU 2.02 1.52 1 110 LEU 6.12 3.95 1 111 GLU 2.96 2.64 1 112 PHE 3.14 3.71 1 113 LEU -0.13 -1.01 1 114 ARG 4.34 1.23 1 115 LEU -2.81 -1.13 1 116 ARG -0.52 -0.04 1 117 HIS -0.94 0.94 1 118 PHE -0.04 0.12 1 120 THR 0.15 0.09 1 121 ASP -0.72 -0.07 1 123 LYS 0.89 0.16 1 124 ALA -0.16 0.12 1 125 SER 0.14 0.09 1 126 ASN 0.29 0.19 1 127 TRP -0.62 -0.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6866_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.63 _LACS_plot.Line_1_terminator_val_y_1 5.50 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.62 _LACS_plot.Line_2_terminator_val_x_2 6.11 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 HIS 3.07 2.07 0 46 HIS -3.13 4.61 0 50 ARG -8.63 5.65 0 10 LEU -3.38 2.79 1 11 GLU -5.41 3.86 1 12 VAL -4.69 2.79 1 13 HIS -4.59 4.50 1 14 ILE -0.21 -0.10 1 16 SER -3.32 2.15 1 17 VAL -5.00 1.52 1 20 GLU -0.47 1.02 1 21 ALA -1.14 0.81 1 22 GLU -1.09 0.81 1 25 ARG 0.67 -0.43 1 26 GLN -0.22 0.31 1 27 SER -0.75 0.51 1 29 GLU 0.93 -0.27 1 30 LYS 0.43 -0.38 1 31 SER -0.06 0.24 1 32 HIS -1.11 2.12 1 33 MET -0.84 -0.03 1 34 VAL -2.92 1.42 1 35 PHE 0.69 -0.64 1 36 ARG 2.84 -1.94 1 37 VAL 2.33 -1.80 1 38 GLU -3.26 2.31 1 39 VAL -1.57 0.63 1 40 LEU -2.99 1.59 1 42 SER 2.27 -1.51 1 44 ARG -2.23 1.24 1 45 ARG -4.17 2.85 1 47 THR -1.95 1.24 1 48 VAL -4.02 2.39 1 51 ARG -1.68 1.64 1 52 TYR 5.66 -0.02 1 54 GLU 2.09 0.81 1 55 PHE 4.90 -0.75 1 56 HIS 2.37 1.40 1 57 ALA 3.37 -0.87 1 58 LEU 4.79 -1.55 1 60 LYS 4.18 -0.75 1 61 ARG 2.07 0.32 1 62 ILE 1.40 0.90 1 63 LYS 4.83 -2.28 1 64 LYS 1.64 -0.60 1 65 LEU -2.65 3.09 1 66 TYR -3.47 1.58 1 67 LYS 0.76 -0.36 1 68 VAL -3.83 1.42 1 70 ASP 1.17 -0.22 1 71 PHE 0.01 0.06 1 73 SER -2.36 0.19 1 74 LYS 2.01 -2.55 1 75 ARG -0.16 0.28 1 76 LEU -0.56 0.22 1 78 ASN 1.56 -1.07 1 79 TRP 1.84 -0.51 1 80 ARG 3.04 -0.75 1 82 ARG 1.46 -0.61 1 84 LEU 3.70 -0.56 1 85 GLU 3.00 -1.22 1 86 GLN 4.46 -1.21 1 87 ARG 3.53 -0.52 1 88 ARG 5.50 -0.75 1 89 GLN 4.84 -0.94 1 91 LEU 4.29 -2.04 1 92 GLU 3.11 0.94 1 93 ALA 3.40 -1.07 1 94 TYR 4.07 -0.06 1 95 ILE 4.54 -2.18 1 96 GLN 5.27 -1.70 1 98 ILE 6.06 -0.76 1 99 LEU 3.32 -1.29 1 100 TYR 1.56 -0.01 1 101 LEU -0.85 1.91 1 102 ASN -3.92 3.52 1 103 GLN 3.25 -0.50 1 104 GLU -3.91 1.37 1 105 VAL 1.38 -0.47 1 107 LYS 5.36 -1.47 1 108 GLU 4.46 -0.72 1 109 LEU 2.02 -0.50 1 110 LEU 6.12 -2.17 1 111 GLU 2.96 -0.32 1 112 PHE 3.14 0.57 1 113 LEU -0.13 -0.88 1 114 ARG 4.34 -3.11 1 115 LEU -2.81 1.68 1 116 ARG -0.52 0.48 1 117 HIS -0.94 1.88 1 118 PHE -0.04 0.16 1 120 THR 0.15 -0.06 1 121 ASP -0.72 0.65 1 123 LYS 0.89 -0.73 1 124 ALA -0.16 0.28 1 125 SER 0.14 -0.05 1 126 ASN 0.29 -0.10 1 127 TRP -0.62 0.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6866_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.63 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.11 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 ARG -4.17 1.43 0 56 HIS 2.37 -1.41 0 10 LEU -3.38 0.88 1 11 GLU -5.41 0.41 1 12 VAL -4.69 1.05 1 13 HIS -4.59 0.09 1 14 ILE -0.21 1.01 1 16 SER -3.32 0.35 1 17 VAL -5.00 0.81 1 20 GLU -0.47 -0.20 1 21 ALA -1.14 0.07 1 22 GLU -1.09 -0.02 1 25 ARG 0.67 -0.04 1 26 GLN -0.22 0.00 1 29 GLU 0.93 -0.13 1 30 LYS 0.43 0.01 1 31 SER -0.06 -0.01 1 32 HIS -1.11 -0.28 1 33 MET -0.84 0.12 1 34 VAL -2.92 0.31 1 35 PHE 0.69 -0.18 1 36 ARG 2.84 -0.21 1 37 VAL 2.33 0.17 1 38 GLU -3.26 0.54 1 39 VAL -1.57 0.33 1 40 LEU -2.99 0.79 1 42 SER 2.27 -0.32 1 44 ARG -2.23 0.34 1 46 HIS -3.13 0.20 1 47 THR -1.95 1.12 1 48 VAL -4.02 0.24 1 50 ARG -8.63 0.63 1 51 ARG -1.68 0.86 1 52 TYR 5.66 -0.19 1 54 GLU 2.09 0.04 1 55 PHE 4.90 -0.61 1 57 ALA 3.37 -0.45 1 58 LEU 4.79 -0.35 1 59 HIS 3.07 -0.44 1 60 LYS 4.18 -0.86 1 61 ARG 2.07 -0.14 1 62 ILE 1.40 0.32 1 63 LYS 4.83 -0.18 1 64 LYS 1.64 -0.02 1 65 LEU -2.65 -0.12 1 66 TYR -3.47 0.21 1 67 LYS 0.76 0.12 1 68 VAL -3.83 0.43 1 70 ASP 1.17 -0.11 1 71 PHE 0.01 -0.81 1 74 LYS 2.01 0.25 1 75 ARG -0.16 -0.18 1 76 LEU -0.56 -0.06 1 78 ASN 1.56 -0.15 1 79 TRP 1.84 -0.33 1 80 ARG 3.04 -0.43 1 82 ARG 1.46 0.00 1 84 LEU 3.70 -0.32 1 85 GLU 3.00 0.02 1 86 GLN 4.46 -0.24 1 87 ARG 3.53 -0.36 1 88 ARG 5.50 -0.61 1 89 GLN 4.84 -0.45 1 91 LEU 4.29 -0.56 1 92 GLU 3.11 -0.62 1 93 ALA 3.40 -0.16 1 94 TYR 4.07 -0.41 1 95 ILE 4.54 -0.56 1 96 GLN 5.27 -0.58 1 98 ILE 6.06 -0.77 1 99 LEU 3.32 -0.21 1 100 TYR 1.56 0.00 1 101 LEU -0.85 -0.18 1 102 ASN -3.92 0.32 1 103 GLN 3.25 -0.47 1 104 GLU -3.91 0.24 1 105 VAL 1.38 -0.62 1 107 LYS 5.36 -0.51 1 108 GLU 4.46 -0.36 1 109 LEU 2.02 -0.12 1 110 LEU 6.12 -0.54 1 111 GLU 2.96 -0.27 1 112 PHE 3.14 -0.40 1 113 LEU -0.13 -0.19 1 114 ARG 4.34 -0.52 1 115 LEU -2.81 0.12 1 116 ARG -0.52 -0.17 1 117 HIS -0.94 -0.17 1 118 PHE -0.04 -0.16 1 120 THR 0.15 -0.08 1 121 ASP -0.72 -0.05 1 123 LYS 0.89 -0.08 1 124 ALA -0.16 -0.07 1 125 SER 0.14 -0.13 1 126 ASN 0.29 -0.08 1 127 TRP -0.62 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6866_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.63 _LACS_plot.Line_1_terminator_val_y_1 -3.83 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 6.11 _LACS_plot.Line_2_terminator_val_y_2 2.21 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ARG -8.63 -0.11 0 10 LEU -3.38 -2.96 1 11 GLU -5.41 -2.04 1 12 VAL -4.69 -2.73 1 13 HIS -4.59 -0.86 1 16 SER -3.32 -3.35 1 17 VAL -5.00 -2.61 1 20 GLU -0.47 -0.74 1 21 ALA -1.14 -2.89 1 22 GLU -1.09 -0.21 1 25 ARG 0.67 -0.08 1 26 GLN -0.22 -0.43 1 30 LYS 0.43 -0.38 1 31 SER -0.06 -0.47 1 33 MET -0.84 -0.46 1 34 VAL -2.92 -2.15 1 35 PHE 0.69 -0.97 1 36 ARG 2.84 -3.43 1 37 VAL 2.33 -1.71 1 38 GLU -3.26 -2.09 1 39 VAL -1.57 -2.64 1 40 LEU -2.99 -2.02 1 42 SER 2.27 0.41 1 44 ARG -2.23 -1.04 1 45 ARG -4.17 -0.24 1 46 HIS -3.13 -1.47 1 47 THR -1.95 -0.26 1 51 ARG -1.68 2.57 1 52 TYR 5.66 2.24 1 54 GLU 2.09 3.76 1 55 PHE 4.90 0.73 1 56 HIS 2.37 2.65 1 57 ALA 3.37 2.27 1 58 LEU 4.79 -0.17 1 59 HIS 3.07 2.90 1 60 LYS 4.18 1.86 1 61 ARG 2.07 2.70 1 62 ILE 1.40 1.44 1 63 LYS 4.83 -0.24 1 64 LYS 1.64 0.48 1 65 LEU -2.65 -1.71 1 66 TYR -3.47 -1.70 1 67 LYS 0.76 -0.87 1 70 ASP 1.17 -0.64 1 78 ASN 1.56 0.45 1 80 ARG 3.04 0.72 1 82 ARG 1.46 0.96 1 84 LEU 3.70 0.95 1 85 GLU 3.00 1.96 1 86 GLN 4.46 3.56 1 87 ARG 3.53 0.75 1 88 ARG 5.50 1.22 1 89 GLN 4.84 3.50 1 91 LEU 4.29 0.40 1 92 GLU 3.11 0.67 1 93 ALA 3.40 3.02 1 94 TYR 4.07 0.00 1 95 ILE 4.54 -1.72 1 96 GLN 5.27 3.04 1 98 ILE 6.06 2.28 1 99 LEU 3.32 0.53 1 100 TYR 1.56 2.31 1 101 LEU -0.85 -0.79 1 103 GLN 3.25 0.11 1 104 GLU -3.91 -1.20 1 107 LYS 5.36 1.96 1 108 GLU 4.46 3.77 1 109 LEU 2.02 -0.22 1 110 LEU 6.12 1.50 1 111 GLU 2.96 3.37 1 112 PHE 3.14 1.38 1 113 LEU -0.13 -3.88 1 114 ARG 4.34 -1.73 1 115 LEU -2.81 -1.23 1 120 THR 0.15 -0.55 1 123 LYS 0.89 0.04 1 124 ALA -0.16 -0.15 1 125 SER 0.14 -0.43 1 126 ASN 0.29 -0.58 1 127 TRP -0.62 -0.62 1 stop_ save_