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 bmr6354_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.53 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.61 _LACS_plot.Line_2_terminator_val_x_2 5.59 _LACS_plot.Line_2_terminator_val_y_2 4.42 _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 37 LYS 2.50 -1.80 0 10 VAL 1.80 0.90 1 11 LEU 0.10 0.40 1 13 VAL -2.10 -0.50 1 14 LYS -5.80 -4.40 1 16 ASP -2.20 0.10 1 17 VAL -2.90 -1.30 1 18 SER -3.00 -0.50 1 19 VAL -3.70 -1.90 1 20 TYR -4.30 -1.60 1 21 ARG 2.00 0.10 1 22 ILE 0.10 -0.20 1 25 ARG 0.30 0.30 1 28 ASN 1.40 0.20 1 29 ARG -0.30 -0.20 1 31 TYR -1.40 1.10 1 32 ARG -2.20 -1.20 1 33 ALA 3.30 0.60 1 34 SER 3.20 2.00 1 35 ASP 1.40 0.90 1 36 TRP -3.20 -3.80 1 38 LEU 3.30 2.30 1 39 ASP 0.70 -0.40 1 40 GLN -1.80 -0.80 1 42 ASP 0.60 2.60 1 43 TRP -0.50 0.60 1 44 THR -3.70 -1.70 1 46 ARG -3.80 -1.70 1 47 LEU -6.00 -1.70 1 48 ARG -5.10 -1.00 1 49 ILE -1.90 -1.60 1 50 THR -3.70 -2.70 1 51 SER -3.70 -1.40 1 52 LYS -1.30 0.10 1 54 LYS 1.90 1.10 1 55 ILE -0.30 -0.10 1 56 ALA -4.20 -3.40 1 57 TYR -2.60 -1.00 1 58 ILE 0.30 -0.10 1 59 LYS -1.30 -0.10 1 60 LEU -0.60 -2.00 1 61 GLU -2.30 -2.80 1 62 ASP -1.70 1.00 1 63 LYS 3.00 2.90 1 64 VAL 3.00 2.40 1 65 SER -1.30 0.30 1 67 GLU -0.30 0.20 1 68 LEU 1.20 1.30 1 69 PHE 1.10 1.20 1 70 ALA -4.40 -1.10 1 71 GLN -6.20 -2.10 1 72 ALA -7.00 -2.40 1 74 VAL -0.10 0.00 1 75 GLU -1.10 0.00 1 76 GLN -3.20 -0.70 1 77 TYR -4.00 -0.10 1 80 ILE 0.80 1.10 1 81 ALA -0.30 2.00 1 82 VAL -3.20 -0.90 1 83 GLU -5.40 -1.60 1 84 THR -0.10 0.00 1 85 VAL -0.90 -1.50 1 86 THR 1.90 1.90 1 87 ASP -0.90 -1.30 1 88 SER -1.30 -0.80 1 89 SER -0.10 0.50 1 90 ARG 0.60 0.80 1 91 TYR -5.60 -2.10 1 92 PHE -5.80 -1.60 1 93 VAL -1.10 -0.30 1 94 ILE -5.60 -3.20 1 95 ARG -2.70 -2.40 1 96 ILE -1.30 -0.90 1 97 GLN -4.60 -1.00 1 98 ASP -1.80 -1.70 1 100 THR -0.40 -0.20 1 102 ARG 0.70 0.30 1 103 SER -3.10 -0.90 1 104 ALA -4.10 -1.40 1 105 PHE -1.40 -0.60 1 106 ILE -4.90 -1.70 1 108 ILE -5.90 -2.50 1 110 PHE -3.80 -1.60 1 111 THR 4.30 3.50 1 112 ASP -4.00 -1.40 1 113 ARG 4.60 3.90 1 115 ASP 3.80 3.30 1 116 ALA 1.50 2.00 1 117 PHE 4.70 3.60 1 118 ASP 3.00 2.80 1 119 PHE 3.90 3.30 1 120 ASN 2.90 3.40 1 121 VAL 5.60 3.90 1 122 SER 5.20 4.20 1 123 LEU 3.30 2.40 1 124 GLN 4.50 3.90 1 125 ASP 4.30 3.00 1 126 HIS 4.20 5.00 1 127 PHE 4.60 3.50 1 128 LYS 3.50 2.30 1 129 TRP 0.80 0.10 1 130 VAL 1.60 0.90 1 131 LYS 0.40 0.00 1 132 GLN 0.50 0.10 1 133 GLU 0.40 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6354_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 4.47 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.39 _LACS_plot.Line_2_terminator_val_x_2 5.59 _LACS_plot.Line_2_terminator_val_y_2 -1.17 _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 37 LYS 2.50 -4.30 0 10 VAL 1.80 -0.90 1 11 LEU 0.10 0.30 1 13 VAL -2.10 1.60 1 14 LYS -5.80 1.40 1 16 ASP -2.20 2.30 1 17 VAL -2.90 1.60 1 18 SER -3.00 2.50 1 19 VAL -3.70 1.80 1 20 TYR -4.30 2.70 1 21 ARG 2.00 -1.90 1 22 ILE 0.10 -0.30 1 25 ARG 0.30 0.00 1 28 ASN 1.40 -1.20 1 29 ARG -0.30 0.10 1 31 TYR -1.40 2.50 1 32 ARG -2.20 1.00 1 33 ALA 3.30 -2.70 1 34 SER 3.20 -1.20 1 35 ASP 1.40 -0.50 1 36 TRP -3.20 -0.60 1 38 LEU 3.30 -1.00 1 39 ASP 0.70 -1.10 1 40 GLN -1.80 1.00 1 42 ASP 0.60 2.00 1 43 TRP -0.50 1.10 1 44 THR -3.70 2.00 1 46 ARG -3.80 2.10 1 47 LEU -6.00 4.30 1 48 ARG -5.10 4.10 1 49 ILE -1.90 0.30 1 50 THR -3.70 1.00 1 51 SER -3.70 2.30 1 52 LYS -1.30 1.40 1 54 LYS 1.90 -0.80 1 55 ILE -0.30 0.20 1 56 ALA -4.20 0.80 1 57 TYR -2.60 1.60 1 58 ILE 0.30 -0.40 1 59 LYS -1.30 1.20 1 60 LEU -0.60 -1.40 1 61 GLU -2.30 -0.50 1 62 ASP -1.70 2.70 1 63 LYS 3.00 -0.10 1 64 VAL 3.00 -0.60 1 65 SER -1.30 1.60 1 67 GLU -0.30 0.50 1 68 LEU 1.20 0.10 1 69 PHE 1.10 0.10 1 70 ALA -4.40 3.30 1 71 GLN -6.20 4.10 1 72 ALA -7.00 4.60 1 74 VAL -0.10 0.10 1 75 GLU -1.10 1.10 1 76 GLN -3.20 2.50 1 77 TYR -4.00 3.90 1 80 ILE 0.80 0.30 1 81 ALA -0.30 2.30 1 82 VAL -3.20 2.30 1 83 GLU -5.40 3.80 1 84 THR -0.10 0.10 1 85 VAL -0.90 -0.60 1 86 THR 1.90 0.00 1 87 ASP -0.90 -0.40 1 88 SER -1.30 0.50 1 89 SER -0.10 0.60 1 90 ARG 0.60 0.20 1 91 TYR -5.60 3.50 1 92 PHE -5.80 4.20 1 93 VAL -1.10 0.80 1 94 ILE -5.60 2.40 1 95 ARG -2.70 0.30 1 96 ILE -1.30 0.40 1 97 GLN -4.60 3.60 1 98 ASP -1.80 0.10 1 100 THR -0.40 0.20 1 102 ARG 0.70 -0.40 1 103 SER -3.10 2.20 1 104 ALA -4.10 2.70 1 105 PHE -1.40 0.80 1 106 ILE -4.90 3.20 1 108 ILE -5.90 3.40 1 110 PHE -3.80 2.20 1 111 THR 4.30 -0.80 1 112 ASP -4.00 2.60 1 113 ARG 4.60 -0.70 1 115 ASP 3.80 -0.50 1 116 ALA 1.50 0.50 1 117 PHE 4.70 -1.10 1 118 ASP 3.00 -0.20 1 119 PHE 3.90 -0.60 1 120 ASN 2.90 0.50 1 121 VAL 5.60 -1.70 1 122 SER 5.20 -1.00 1 123 LEU 3.30 -0.90 1 124 GLN 4.50 -0.60 1 125 ASP 4.30 -1.30 1 126 HIS 4.20 0.80 1 127 PHE 4.60 -1.10 1 128 LYS 3.50 -1.20 1 129 TRP 0.80 -0.70 1 130 VAL 1.60 -0.70 1 131 LYS 0.40 -0.40 1 132 GLN 0.50 -0.40 1 133 GLU 0.40 0.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6354_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 1.01 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.30 _LACS_plot.Line_2_terminator_val_x_2 5.59 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 33 ALA 3.30 -2.79 0 10 VAL 1.80 -0.03 1 11 LEU 0.10 0.04 1 13 VAL -2.10 0.76 1 14 LYS -5.80 0.60 1 16 ASP -2.20 0.29 1 17 VAL -2.90 0.24 1 18 SER -3.00 0.55 1 19 VAL -3.70 0.95 1 20 TYR -4.30 0.27 1 21 ARG 2.00 0.09 1 22 ILE 0.10 -0.09 1 25 ARG 0.30 -0.30 1 28 ASN 1.40 -0.26 1 29 ARG -0.30 -0.07 1 31 TYR -1.40 -0.05 1 32 ARG -2.20 0.00 1 34 SER 3.20 -0.68 1 35 ASP 1.40 -0.03 1 36 TRP -3.20 0.18 1 37 LYS 2.50 0.25 1 38 LEU 3.30 -0.39 1 39 ASP 0.70 -0.07 1 40 GLN -1.80 0.17 1 42 ASP 0.60 -0.19 1 43 TRP -0.50 -0.37 1 44 THR -3.70 0.31 1 46 ARG -3.80 0.46 1 47 LEU -6.00 1.28 1 48 ARG -5.10 1.09 1 49 ILE -1.90 1.35 1 50 THR -3.70 1.02 1 51 SER -3.70 0.69 1 52 LYS -1.30 0.30 1 54 LYS 1.90 -0.14 1 55 ILE -0.30 0.12 1 56 ALA -4.20 0.64 1 57 TYR -2.60 0.29 1 58 ILE 0.30 0.21 1 59 LYS -1.30 0.36 1 60 LEU -0.60 1.02 1 61 GLU -2.30 0.79 1 62 ASP -1.70 0.13 1 63 LYS 3.00 -0.48 1 64 VAL 3.00 -0.17 1 65 SER -1.30 -0.04 1 67 GLU -0.30 -0.33 1 68 LEU 1.20 -0.20 1 69 PHE 1.10 -0.32 1 70 ALA -4.40 -0.19 1 71 GLN -6.20 1.28 1 72 ALA -7.00 0.77 1 74 VAL -0.10 -0.14 1 75 GLU -1.10 0.27 1 76 GLN -3.20 -0.48 1 77 TYR -4.00 -0.64 1 80 ILE 0.80 -0.01 1 81 ALA -0.30 -0.05 1 82 VAL -3.20 0.86 1 83 GLU -5.40 0.83 1 84 THR -0.10 0.15 1 85 VAL -0.90 0.59 1 86 THR 1.90 -0.17 1 87 ASP -0.90 -0.03 1 88 SER -1.30 0.17 1 89 SER -0.10 0.14 1 90 ARG 0.60 -0.05 1 91 TYR -5.60 1.25 1 92 PHE -5.80 0.68 1 93 VAL -1.10 0.90 1 94 ILE -5.60 1.61 1 95 ARG -2.70 0.37 1 96 ILE -1.30 0.40 1 97 GLN -4.60 0.80 1 98 ASP -1.80 0.09 1 100 THR -0.40 0.13 1 102 ARG 0.70 0.04 1 103 SER -3.10 0.88 1 104 ALA -4.10 0.09 1 105 PHE -1.40 0.88 1 106 ILE -4.90 0.42 1 108 ILE -5.90 1.86 1 110 PHE -3.80 0.34 1 111 THR 4.30 -0.45 1 112 ASP -4.00 0.27 1 113 ARG 4.60 -1.18 1 115 ASP 3.80 -0.46 1 116 ALA 1.50 -0.99 1 117 PHE 4.70 -0.28 1 118 ASP 3.00 -0.34 1 119 PHE 3.90 -0.69 1 120 ASN 2.90 -0.86 1 121 VAL 5.60 -0.65 1 122 SER 5.20 -0.38 1 123 LEU 3.30 -0.64 1 124 GLN 4.50 -0.43 1 125 ASP 4.30 -0.28 1 126 HIS 4.20 -0.53 1 127 PHE 4.60 -0.58 1 128 LYS 3.50 -0.23 1 129 TRP 0.80 -0.11 1 130 VAL 1.60 -0.46 1 131 LYS 0.40 -0.12 1 132 GLN 0.50 -0.05 1 133 GLU 0.40 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6354_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.77 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.25 _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 5.59 _LACS_plot.Line_2_terminator_val_y_2 1.49 _LACS_plot.Y_axis_chem_shift_offset 0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 GLU 0.40 4.30 0 10 VAL 1.80 -0.50 1 11 LEU 0.10 -0.40 1 13 VAL -2.10 -1.10 1 14 LYS -5.80 -0.70 1 16 ASP -2.20 -2.10 1 17 VAL -2.90 -3.30 1 18 SER -3.00 -2.60 1 19 VAL -3.70 -3.10 1 20 TYR -4.30 -0.60 1 21 ARG 2.00 0.10 1 22 ILE 0.10 -1.30 1 25 ARG 0.30 -0.30 1 28 ASN 1.40 -0.50 1 29 ARG -0.30 -0.40 1 31 TYR -1.40 -0.90 1 32 ARG -2.20 -1.00 1 33 ALA 3.30 1.30 1 34 SER 3.20 0.70 1 35 ASP 1.40 -0.10 1 36 TRP -3.20 -0.20 1 37 LYS 2.50 0.80 1 38 LEU 3.30 1.00 1 39 ASP 0.70 -0.80 1 40 GLN -1.80 -2.60 1 42 ASP 0.60 -0.70 1 43 TRP -0.50 -2.90 1 44 THR -3.70 -3.20 1 46 ARG -3.80 -2.80 1 47 LEU -6.00 -2.50 1 48 ARG -5.10 -1.50 1 49 ILE -1.90 -0.20 1 50 THR -3.70 -1.40 1 51 SER -3.70 -0.80 1 52 LYS -1.30 -0.20 1 54 LYS 1.90 -0.20 1 55 ILE -0.30 -2.50 1 56 ALA -4.20 -3.20 1 57 TYR -2.60 -1.10 1 58 ILE 0.30 -1.70 1 59 LYS -1.30 -2.50 1 60 LEU -0.60 -1.80 1 61 GLU -2.30 -2.00 1 62 ASP -1.70 1.90 1 63 LYS 3.00 -0.20 1 64 VAL 3.00 1.50 1 65 SER -1.30 2.00 1 67 GLU -0.30 0.30 1 68 LEU 1.20 -1.70 1 69 PHE 1.10 -0.60 1 70 ALA -4.40 -3.80 1 71 GLN -6.20 -3.10 1 72 ALA -7.00 -1.30 1 74 VAL -0.10 -2.40 1 75 GLU -1.10 -1.10 1 76 GLN -3.20 -3.60 1 77 TYR -4.00 -2.30 1 80 ILE 0.80 -0.40 1 81 ALA -0.30 -0.90 1 82 VAL -3.20 -2.90 1 83 GLU -5.40 -0.50 1 84 THR -0.10 0.30 1 85 VAL -0.90 0.50 1 86 THR 1.90 1.60 1 87 ASP -0.90 -1.20 1 88 SER -1.30 -1.20 1 89 SER -0.10 0.20 1 90 ARG 0.60 -3.20 1 91 TYR -5.60 -2.20 1 92 PHE -5.80 -2.10 1 93 VAL -1.10 0.50 1 94 ILE -5.60 -2.80 1 95 ARG -2.70 0.10 1 96 ILE -1.30 -1.00 1 97 GLN -4.60 0.40 1 98 ASP -1.80 1.40 1 100 THR -0.40 0.50 1 102 ARG 0.70 -0.20 1 103 SER -3.10 -1.60 1 104 ALA -4.10 -3.60 1 105 PHE -1.40 -0.10 1 106 ILE -4.90 -3.10 1 108 ILE -5.90 -0.70 1 110 PHE -3.80 0.20 1 111 THR 4.30 -0.60 1 112 ASP -4.00 0.40 1 113 ARG 4.60 2.00 1 115 ASP 3.80 0.50 1 116 ALA 1.50 0.70 1 117 PHE 4.70 1.40 1 118 ASP 3.00 2.50 1 119 PHE 3.90 -1.30 1 120 ASN 2.90 2.00 1 121 VAL 5.60 1.20 1 122 SER 5.20 2.20 1 123 LEU 3.30 0.50 1 124 GLN 4.50 3.50 1 125 ASP 4.30 2.50 1 126 HIS 4.20 2.70 1 127 PHE 4.60 0.60 1 128 LYS 3.50 0.40 1 129 TRP 0.80 0.80 1 130 VAL 1.60 -0.50 1 131 LYS 0.40 -0.50 1 132 GLN 0.50 -1.20 1 stop_ save_