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 bmr11398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -2.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 5.53 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 HIS 4.46 5.04 0 71 ASP -0.23 2.87 0 11 GLU -0.30 0.26 1 13 ASP 0.11 0.21 1 15 TYR 0.79 0.49 1 16 ALA 0.27 0.44 1 17 LEU 0.23 0.35 1 18 SER 0.10 0.05 1 19 LEU 0.57 0.49 1 20 GLU 0.09 0.55 1 21 SER -0.31 -0.06 1 22 SER -2.25 -0.36 1 23 GLU -4.49 -1.41 1 24 GLN -3.09 -1.35 1 25 LEU -3.51 -0.63 1 26 THR 0.64 0.44 1 27 LEU -4.01 -1.13 1 28 GLU -1.05 -1.17 1 29 ILE -2.95 -0.65 1 31 LEU -1.96 -1.11 1 32 ASN 1.09 0.98 1 33 ASP 0.43 0.47 1 34 SER 0.56 0.81 1 36 SER 1.49 1.12 1 37 ALA 0.54 0.76 1 39 LEU 0.86 1.73 1 41 VAL -6.22 -3.40 1 42 SER -2.72 -1.47 1 43 LEU -4.35 -1.34 1 44 LYS -5.09 -1.61 1 46 ASN -3.57 -1.42 1 47 LYS -4.43 -0.89 1 48 SER -0.72 -0.87 1 49 ARG 3.27 2.56 1 50 GLU 2.36 2.78 1 51 THR -1.41 -0.35 1 53 THR -0.06 0.39 1 54 ASP 3.28 1.99 1 55 LEU -2.90 -0.67 1 57 ILE -2.42 -2.76 1 58 PHE -6.77 -2.39 1 59 ILE 2.99 0.54 1 60 LYS 0.41 0.96 1 61 SER -2.48 -0.74 1 62 ILE -0.65 -0.54 1 63 ILE 1.29 0.20 1 64 HIS 4.15 4.10 1 67 ALA 3.14 3.23 1 68 ALA 2.51 2.68 1 69 PHE 3.68 3.50 1 70 LYS 3.66 3.15 1 73 ARG 0.31 2.45 1 74 LEU -0.87 0.49 1 75 ARG -5.98 -2.05 1 76 MET 2.60 2.71 1 77 ASN 4.65 3.03 1 78 ASP 1.95 2.42 1 79 GLN -2.32 -1.90 1 80 LEU 0.61 -0.04 1 81 ILE -0.35 0.28 1 82 ALA -2.51 0.59 1 83 VAL -4.80 -3.40 1 84 ASN 2.46 0.98 1 86 GLU -2.60 -1.82 1 87 THR 1.38 0.87 1 88 LEU -0.63 -0.98 1 89 LEU 1.40 0.59 1 91 LYS -3.95 -1.45 1 92 SER -1.06 -0.34 1 93 ASN 5.49 2.93 1 95 GLU 2.34 2.40 1 96 ALA 3.27 3.08 1 97 MET 4.34 3.00 1 98 GLU 3.14 2.55 1 99 THR 6.71 5.55 1 100 LEU 4.32 3.62 1 101 ARG 4.99 4.18 1 102 ARG 4.13 3.42 1 103 SER 3.40 3.47 1 104 MET 0.97 1.34 1 105 SER -0.06 0.48 1 106 MET 1.20 1.00 1 107 GLU 1.37 1.25 1 109 ASN 0.59 0.48 1 110 ILE 1.34 0.92 1 111 ARG 0.45 0.62 1 113 MET -4.20 -1.36 1 114 ILE -4.71 -1.53 1 115 GLN -3.66 -1.57 1 116 LEU -6.08 -1.99 1 117 VAL -0.29 -0.54 1 118 ILE -7.64 -3.69 1 119 LEU -5.05 -1.45 1 120 ARG -4.01 -1.11 1 121 ARG -0.57 0.05 1 122 SER 0.55 0.75 1 125 SER 0.09 0.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 4.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.91 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -1.17 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 94 HIS 4.46 0.58 0 71 ASP -0.23 3.10 0 11 GLU -0.30 0.56 1 13 ASP 0.11 0.10 1 15 TYR 0.79 -0.30 1 16 ALA 0.27 0.17 1 17 LEU 0.23 0.12 1 18 SER 0.10 -0.05 1 19 LEU 0.57 -0.08 1 20 GLU 0.09 0.46 1 21 SER -0.31 0.25 1 22 SER -2.25 1.89 1 23 GLU -4.49 3.08 1 24 GLN -3.09 1.74 1 25 LEU -3.51 2.88 1 26 THR 0.64 -0.20 1 27 LEU -4.01 2.88 1 28 GLU -1.05 -0.12 1 29 ILE -2.95 2.30 1 31 LEU -1.96 0.85 1 32 ASN 1.09 -0.11 1 33 ASP 0.43 0.04 1 34 SER 0.56 0.25 1 36 SER 1.49 -0.37 1 37 ALA 0.54 0.22 1 39 LEU 0.86 0.87 1 41 VAL -6.22 2.82 1 42 SER -2.72 1.25 1 43 LEU -4.35 3.01 1 44 LYS -5.09 3.48 1 46 ASN -3.57 2.15 1 47 LYS -4.43 3.54 1 48 SER -0.72 -0.15 1 49 ARG 3.27 -0.71 1 50 GLU 2.36 0.42 1 51 THR -1.41 1.06 1 53 THR -0.06 0.45 1 54 ASP 3.28 -1.29 1 55 LEU -2.90 2.23 1 57 ILE -2.42 -0.34 1 58 PHE -6.77 4.38 1 59 ILE 2.99 -2.45 1 60 LYS 0.41 0.55 1 61 SER -2.48 1.74 1 62 ILE -0.65 0.11 1 63 ILE 1.29 -1.09 1 64 HIS 4.15 -0.05 1 67 ALA 3.14 0.09 1 68 ALA 2.51 0.17 1 69 PHE 3.68 -0.18 1 70 LYS 3.66 -0.51 1 73 ARG 0.31 2.14 1 74 LEU -0.87 1.36 1 75 ARG -5.98 3.93 1 76 MET 2.60 0.11 1 77 ASN 4.65 -1.62 1 78 ASP 1.95 0.47 1 79 GLN -2.32 0.42 1 80 LEU 0.61 -0.65 1 81 ILE -0.35 0.63 1 82 ALA -2.51 3.10 1 83 VAL -4.80 1.40 1 84 ASN 2.46 -1.48 1 86 GLU -2.60 0.78 1 87 THR 1.38 -0.51 1 88 LEU -0.63 -0.35 1 89 LEU 1.40 -0.81 1 91 LYS -3.95 2.50 1 92 SER -1.06 0.72 1 93 ASN 5.49 -2.56 1 95 GLU 2.34 0.06 1 96 ALA 3.27 -0.19 1 97 MET 4.34 -1.34 1 98 GLU 3.14 -0.59 1 99 THR 6.71 -1.16 1 100 LEU 4.32 -0.70 1 101 ARG 4.99 -0.81 1 102 ARG 4.13 -0.71 1 103 SER 3.40 0.07 1 104 MET 0.97 0.37 1 105 SER -0.06 0.54 1 106 MET 1.20 -0.20 1 107 GLU 1.37 -0.12 1 109 ASN 0.59 -0.11 1 110 ILE 1.34 -0.42 1 111 ARG 0.45 0.17 1 113 MET -4.20 2.84 1 114 ILE -4.71 3.18 1 115 GLN -3.66 2.09 1 116 LEU -6.08 4.09 1 117 VAL -0.29 -0.25 1 118 ILE -7.64 3.95 1 119 LEU -5.05 3.60 1 120 ARG -4.01 2.90 1 121 ARG -0.57 0.62 1 122 SER 0.55 0.20 1 125 SER 0.09 0.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 0.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _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 64 HIS 4.15 -1.66 0 11 GLU -0.30 0.00 1 13 ASP 0.11 -0.05 1 15 TYR 0.79 0.00 1 16 ALA 0.27 -0.05 1 17 LEU 0.23 0.00 1 18 SER 0.10 0.02 1 19 LEU 0.57 0.01 1 20 GLU 0.09 0.01 1 21 SER -0.31 0.12 1 22 SER -2.25 0.61 1 23 GLU -4.49 0.28 1 24 GLN -3.09 1.20 1 25 LEU -3.51 0.51 1 26 THR 0.64 0.67 1 27 LEU -4.01 0.28 1 28 GLU -1.05 0.72 1 29 ILE -2.95 0.15 1 31 LEU -1.96 0.14 1 32 ASN 1.09 -0.05 1 33 ASP 0.43 0.07 1 34 SER 0.56 0.00 1 36 SER 1.49 -0.07 1 37 ALA 0.54 0.05 1 39 LEU 0.86 -0.21 1 41 VAL -6.22 1.02 1 42 SER -2.72 0.51 1 43 LEU -4.35 0.94 1 44 LYS -5.09 0.48 1 46 ASN -3.57 0.48 1 47 LYS -4.43 0.72 1 48 SER -0.72 0.08 1 49 ARG 3.27 -0.20 1 50 GLU 2.36 -0.12 1 51 THR -1.41 0.22 1 53 THR -0.06 -0.06 1 54 ASP 3.28 0.03 1 55 LEU -2.90 0.31 1 57 ILE -2.42 0.80 1 58 PHE -6.77 0.85 1 59 ILE 2.99 -0.08 1 60 LYS 0.41 0.14 1 61 SER -2.48 0.16 1 62 ILE -0.65 0.22 1 63 ILE 1.29 -0.19 1 67 ALA 3.14 -0.20 1 68 ALA 2.51 -0.18 1 69 PHE 3.68 -0.64 1 70 LYS 3.66 -0.52 1 71 ASP -0.23 -0.25 1 73 ARG 0.31 0.01 1 74 LEU -0.87 -0.37 1 75 ARG -5.98 0.26 1 76 MET 2.60 -0.80 1 77 ASN 4.65 -0.32 1 78 ASP 1.95 0.14 1 79 GLN -2.32 0.02 1 80 LEU 0.61 0.20 1 81 ILE -0.35 0.40 1 82 ALA -2.51 0.67 1 83 VAL -4.80 1.04 1 84 ASN 2.46 -0.26 1 86 GLU -2.60 0.27 1 87 THR 1.38 0.07 1 88 LEU -0.63 0.10 1 89 LEU 1.40 0.00 1 91 LYS -3.95 0.34 1 92 SER -1.06 0.04 1 93 ASN 5.49 -0.32 1 94 HIS 4.46 -0.40 1 95 GLU 2.34 -0.36 1 96 ALA 3.27 -0.20 1 97 MET 4.34 -0.37 1 98 GLU 3.14 -0.23 1 99 THR 6.71 -0.47 1 100 LEU 4.32 -0.42 1 101 ARG 4.99 -0.43 1 102 ARG 4.13 -0.24 1 103 SER 3.40 -0.10 1 104 MET 0.97 -0.17 1 105 SER -0.06 0.07 1 106 MET 1.20 0.03 1 107 GLU 1.37 -0.10 1 109 ASN 0.59 0.00 1 110 ILE 1.34 0.00 1 111 ARG 0.45 0.02 1 113 MET -4.20 0.64 1 114 ILE -4.71 0.58 1 115 GLN -3.66 0.94 1 116 LEU -6.08 0.90 1 117 VAL -0.29 0.90 1 118 ILE -7.64 1.42 1 119 LEU -5.05 0.90 1 120 ARG -4.01 0.50 1 121 ARG -0.57 0.02 1 122 SER 0.55 0.09 1 125 SER 0.09 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11398_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -2.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 2.82 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 PHE -6.77 0.26 0 11 GLU -0.30 -0.16 1 13 ASP 0.11 0.08 1 15 TYR 0.79 -0.08 1 16 ALA 0.27 -0.04 1 17 LEU 0.23 -0.11 1 18 SER 0.10 0.33 1 19 LEU 0.57 0.04 1 20 GLU 0.09 -0.04 1 21 SER -0.31 -0.64 1 22 SER -2.25 -1.77 1 23 GLU -4.49 -2.59 1 24 GLN -3.09 -0.32 1 25 LEU -3.51 -2.69 1 26 THR 0.64 -0.89 1 27 LEU -4.01 -3.13 1 28 GLU -1.05 -1.30 1 29 ILE -2.95 -1.35 1 32 ASN 1.09 0.02 1 33 ASP 0.43 -0.08 1 34 SER 0.56 1.65 1 36 SER 1.49 0.42 1 37 ALA 0.54 1.04 1 39 LEU 0.86 -0.58 1 41 VAL -6.22 -1.94 1 42 SER -2.72 -0.43 1 43 LEU -4.35 -2.02 1 44 LYS -5.09 -2.40 1 46 ASN -3.57 0.36 1 47 LYS -4.43 -1.10 1 48 SER -0.72 2.35 1 49 ARG 3.27 1.18 1 50 GLU 2.36 1.62 1 51 THR -1.41 1.54 1 53 THR -0.06 -0.71 1 54 ASP 3.28 0.65 1 55 LEU -2.90 -1.06 1 57 ILE -2.42 -1.99 1 59 ILE 2.99 0.16 1 61 SER -2.48 -2.85 1 62 ILE -0.65 -0.82 1 63 ILE 1.29 0.70 1 64 HIS 4.15 1.84 1 67 ALA 3.14 3.54 1 68 ALA 2.51 3.11 1 69 PHE 3.68 1.10 1 70 LYS 3.66 1.47 1 71 ASP -0.23 1.80 1 73 ARG 0.31 1.39 1 74 LEU -0.87 -1.88 1 75 ARG -5.98 -0.68 1 76 MET 2.60 1.06 1 77 ASN 4.65 -0.55 1 78 ASP 1.95 -0.97 1 79 GLN -2.32 0.23 1 80 LEU 0.61 -2.48 1 81 ILE -0.35 -0.34 1 82 ALA -2.51 -2.79 1 84 ASN 2.46 -0.10 1 86 GLU -2.60 -0.92 1 87 THR 1.38 -1.17 1 88 LEU -0.63 0.46 1 89 LEU 1.40 0.17 1 91 LYS -3.95 0.37 1 92 SER -1.06 -0.22 1 93 ASN 5.49 2.72 1 94 HIS 4.46 3.41 1 95 GLU 2.34 3.27 1 96 ALA 3.27 1.44 1 97 MET 4.34 2.73 1 98 GLU 3.14 2.32 1 99 THR 6.71 2.36 1 100 LEU 4.32 0.39 1 101 ARG 4.99 3.42 1 102 ARG 4.13 2.76 1 103 SER 3.40 0.68 1 104 MET 0.97 -0.59 1 105 SER -0.06 0.05 1 106 MET 1.20 0.42 1 107 GLU 1.37 0.89 1 109 ASN 0.59 0.38 1 110 ILE 1.34 0.19 1 111 ARG 0.45 0.67 1 113 MET -4.20 -2.02 1 114 ILE -4.71 -4.23 1 115 GLN -3.66 -1.24 1 117 VAL -0.29 -0.38 1 118 ILE -7.64 -1.93 1 119 LEU -5.05 -2.01 1 120 ARG -4.01 -1.34 1 121 ARG -0.57 0.00 1 122 SER 0.55 3.60 1 stop_ save_