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 bmr6577_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.59 _LACS_plot.Line_1_terminator_val_y_1 -2.81 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 5.84 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 HIS -3.70 1.86 0 47 LYS -2.26 -4.15 0 10 SER -0.33 0.43 1 11 SER -0.05 0.51 1 12 ARG 0.38 0.71 1 13 VAL 0.54 0.79 1 14 ASP 0.04 0.54 1 15 LEU 0.63 0.92 1 16 GLN 0.33 1.64 1 17 GLU -0.46 0.52 1 18 GLN 0.92 1.16 1 19 ARG 0.30 0.73 1 20 SER -0.13 0.40 1 21 VAL 0.44 0.67 1 22 LYS 0.15 0.59 1 23 THR 0.03 0.50 1 24 ARG -0.59 -0.17 1 26 SER -1.53 -0.36 1 41 GLU -3.79 -1.07 1 42 LEU -3.09 -1.06 1 43 ASN -0.89 -0.19 1 44 LEU -6.14 -1.13 1 45 ILE -3.08 -0.57 1 46 VAL -2.52 -0.58 1 48 ALA -7.59 -2.51 1 49 ASP 3.68 2.83 1 50 VAL -6.61 -2.57 1 51 GLN 5.71 4.03 1 53 SER 3.34 3.16 1 54 VAL 6.84 5.72 1 55 GLU 3.37 3.25 1 56 ALA 2.90 2.72 1 57 LEU 3.61 3.18 1 58 VAL 7.09 5.94 1 59 ALA 3.49 2.87 1 60 ALA 3.05 2.78 1 61 LEU 2.42 2.74 1 62 GLN 2.87 2.56 1 63 LYS 0.17 0.45 1 64 ILE 2.89 2.53 1 65 ASP 0.01 0.53 1 66 VAL -1.43 -0.34 1 67 GLU 1.81 1.59 1 69 VAL -1.76 -0.18 1 70 ARG -3.99 -1.78 1 71 VAL -0.16 -0.07 1 72 LYS -2.70 -0.86 1 73 ILE 1.37 -0.83 1 74 ILE 1.55 0.60 1 76 ALA -4.07 -1.83 1 77 ALA -5.47 -0.81 1 78 VAL -1.16 -0.45 1 80 ALA 0.07 0.30 1 81 ILE 0.13 1.05 1 82 THR -4.89 -1.27 1 83 GLU 4.39 4.55 1 84 SER 4.77 3.71 1 85 ASP 3.84 4.08 1 86 ILE 5.67 1.38 1 87 SER 4.64 3.81 1 88 LEU 3.41 2.82 1 89 ALA 3.55 3.46 1 90 THR 4.67 3.89 1 91 ALA 2.22 2.38 1 92 SER -1.31 0.05 1 93 ASN 2.93 1.69 1 94 ALA -4.76 -1.30 1 95 ILE -1.46 0.31 1 96 VAL -1.04 -0.62 1 97 ILE -3.01 -1.88 1 99 PHE -1.67 -0.63 1 100 ASN 3.54 2.36 1 101 VAL -6.88 -2.88 1 102 ARG -2.48 -0.53 1 104 ASP -0.66 -0.88 1 105 ALA 4.41 4.23 1 106 ASN 3.55 2.84 1 107 ALA 2.46 3.11 1 108 LYS 4.10 4.06 1 109 ARG 3.93 3.52 1 110 ALA 3.20 2.83 1 111 ALA 3.48 3.08 1 112 GLU 2.58 2.63 1 113 SER 3.29 3.32 1 114 GLU -1.01 -0.52 1 115 LYS 4.43 0.89 1 116 VAL -1.76 -0.18 1 117 ASP -0.83 0.34 1 118 ILE -2.27 -0.90 1 119 ARG -2.94 -2.64 1 120 LEU -0.59 -1.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6577_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.59 _LACS_plot.Line_1_terminator_val_y_1 4.78 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.99 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 -1.24 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 75 HIS -3.70 5.56 0 47 LYS -2.26 -1.89 0 10 SER -0.33 0.76 1 11 SER -0.05 0.56 1 12 ARG 0.38 0.33 1 13 VAL 0.54 0.25 1 14 ASP 0.04 0.50 1 15 LEU 0.63 0.29 1 16 GLN 0.33 1.31 1 17 GLU -0.46 0.98 1 18 GLN 0.92 0.24 1 19 ARG 0.30 0.43 1 20 SER -0.13 0.53 1 21 VAL 0.44 0.23 1 22 LYS 0.15 0.44 1 23 THR 0.03 0.47 1 24 ARG -0.59 0.42 1 26 SER -1.53 1.17 1 41 GLU -3.79 2.72 1 42 LEU -3.09 2.03 1 43 ASN -0.89 0.70 1 44 LEU -6.14 5.01 1 45 ILE -3.08 2.51 1 46 VAL -2.52 1.94 1 48 ALA -7.59 5.08 1 49 ASP 3.68 -0.85 1 50 VAL -6.61 4.04 1 51 GLN 5.71 -1.68 1 53 SER 3.34 -0.18 1 54 VAL 6.84 -1.12 1 55 GLU 3.37 -0.12 1 56 ALA 2.90 -0.18 1 57 LEU 3.61 -0.43 1 58 VAL 7.09 -1.15 1 59 ALA 3.49 -0.62 1 60 ALA 3.05 -0.27 1 61 LEU 2.42 0.32 1 62 GLN 2.87 -0.31 1 63 LYS 0.17 0.28 1 64 ILE 2.89 -0.36 1 65 ASP 0.01 0.52 1 66 VAL -1.43 1.09 1 67 GLU 1.81 -0.22 1 69 VAL -1.76 1.58 1 70 ARG -3.99 2.21 1 71 VAL -0.16 0.09 1 72 LYS -2.70 1.84 1 73 ILE 1.37 -2.20 1 74 ILE 1.55 -0.95 1 76 ALA -4.07 2.24 1 77 ALA -5.47 4.66 1 78 VAL -1.16 0.71 1 80 ALA 0.07 0.23 1 81 ILE 0.13 0.92 1 82 THR -4.89 3.62 1 83 GLU 4.39 0.16 1 84 SER 4.77 -1.06 1 85 ASP 3.84 0.24 1 86 ILE 5.67 -4.29 1 87 SER 4.64 -0.83 1 88 LEU 3.41 -0.59 1 89 ALA 3.55 -0.09 1 90 THR 4.67 -0.78 1 91 ALA 2.22 0.16 1 92 SER -1.31 1.36 1 93 ASN 2.93 -1.24 1 94 ALA -4.76 3.46 1 95 ILE -1.46 1.77 1 96 VAL -1.04 0.42 1 97 ILE -3.01 1.13 1 99 PHE -1.67 1.04 1 100 ASN 3.54 -1.18 1 101 VAL -6.88 4.00 1 102 ARG -2.48 1.95 1 104 ASP -0.66 -0.22 1 105 ALA 4.41 -0.18 1 106 ASN 3.55 -0.71 1 107 ALA 2.46 0.65 1 108 LYS 4.10 -0.04 1 109 ARG 3.93 -0.41 1 110 ALA 3.20 -0.37 1 111 ALA 3.48 -0.40 1 112 GLU 2.58 0.05 1 113 SER 3.29 0.03 1 114 GLU -1.01 0.49 1 115 LYS 4.43 -3.54 1 116 VAL -1.76 1.58 1 117 ASP -0.83 1.17 1 118 ILE -2.27 1.37 1 119 ARG -2.94 0.30 1 120 LEU -0.59 -0.74 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6577_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.59 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _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 101 VAL -6.88 0.37 0 47 LYS -2.26 1.31 0 10 SER -0.33 0.04 1 11 SER -0.05 0.03 1 12 ARG 0.38 0.06 1 13 VAL 0.54 -0.01 1 14 ASP 0.04 -0.01 1 15 LEU 0.63 -0.05 1 16 GLN 0.33 -0.05 1 17 GLU -0.46 -0.09 1 18 GLN 0.92 -0.06 1 19 ARG 0.30 0.06 1 20 SER -0.13 0.03 1 21 VAL 0.44 0.06 1 22 LYS 0.15 0.09 1 23 THR 0.03 -0.02 1 24 ARG -0.59 0.02 1 26 SER -1.53 0.14 1 41 GLU -3.79 0.63 1 42 LEU -3.09 0.61 1 43 ASN -0.89 0.83 1 44 LEU -6.14 1.13 1 45 ILE -3.08 0.62 1 46 VAL -2.52 0.58 1 48 ALA -7.59 1.51 1 49 ASP 3.68 -0.61 1 50 VAL -6.61 0.61 1 51 GLN 5.71 -0.61 1 53 SER 3.34 -0.11 1 54 VAL 6.84 -0.96 1 55 GLU 3.37 -0.57 1 56 ALA 2.90 -0.22 1 57 LEU 3.61 -0.47 1 58 VAL 7.09 -0.77 1 59 ALA 3.49 -0.25 1 60 ALA 3.05 -0.27 1 61 LEU 2.42 -0.45 1 62 GLN 2.87 -0.22 1 63 LYS 0.17 -0.02 1 64 ILE 2.89 -0.37 1 66 VAL -1.43 0.07 1 67 GLU 1.81 -0.32 1 69 VAL -1.76 0.06 1 70 ARG -3.99 1.12 1 71 VAL -0.16 0.53 1 72 LYS -2.70 0.24 1 73 ILE 1.37 0.25 1 74 ILE 1.55 -0.06 1 75 HIS -3.70 0.03 1 76 ALA -4.07 1.26 1 77 ALA -5.47 0.24 1 78 VAL -1.16 0.32 1 80 ALA 0.07 -0.28 1 81 ILE 0.13 0.10 1 82 THR -4.89 0.57 1 83 GLU 4.39 -0.63 1 84 SER 4.77 -0.26 1 85 ASP 3.84 -0.38 1 86 ILE 5.67 -0.54 1 87 SER 4.64 -0.22 1 88 LEU 3.41 -0.19 1 89 ALA 3.55 -0.46 1 90 THR 4.67 -0.22 1 91 ALA 2.22 -0.09 1 92 SER -1.31 0.11 1 93 ASN 2.93 -0.27 1 94 ALA -4.76 0.63 1 95 ILE -1.46 0.23 1 96 VAL -1.04 0.54 1 97 ILE -3.01 0.82 1 99 PHE -1.67 0.55 1 100 ASN 3.54 -0.63 1 102 ARG -2.48 0.17 1 104 ASP -0.66 -0.02 1 105 ALA 4.41 -0.33 1 106 ASN 3.55 -0.24 1 107 ALA 2.46 -0.54 1 108 LYS 4.10 -0.54 1 109 ARG 3.93 -0.20 1 110 ALA 3.20 -0.08 1 111 ALA 3.48 -0.47 1 112 GLU 2.58 -0.18 1 113 SER 3.29 -0.18 1 114 GLU -1.01 0.09 1 115 LYS 4.43 -0.35 1 116 VAL -1.76 0.03 1 117 ASP -0.83 -0.14 1 118 ILE -2.27 0.73 1 119 ARG -2.94 0.40 1 120 LEU -0.59 0.96 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6577_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.59 _LACS_plot.Line_1_terminator_val_y_1 -3.79 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 7.08 _LACS_plot.Line_2_terminator_val_y_2 3.34 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 THR -4.89 2.41 0 10 SER -0.33 -0.03 1 11 SER -0.05 -0.33 1 12 ARG 0.38 -0.04 1 13 VAL 0.54 -0.70 1 14 ASP 0.04 2.77 1 15 LEU 0.63 -0.09 1 16 GLN 0.33 0.26 1 17 GLU -0.46 -0.20 1 18 GLN 0.92 -0.08 1 19 ARG 0.30 -0.20 1 20 SER -0.13 -0.32 1 21 VAL 0.44 -0.33 1 22 LYS 0.15 -0.14 1 23 THR 0.03 -0.65 1 24 ARG -0.59 -0.47 1 41 GLU -3.79 1.46 1 43 ASN -0.89 -0.35 1 44 LEU -6.14 -1.35 1 45 ILE -3.08 -2.50 1 46 VAL -2.52 -2.79 1 47 LYS -2.26 -1.26 1 48 ALA -7.59 -2.59 1 49 ASP 3.68 -0.24 1 50 VAL -6.61 0.65 1 51 GLN 5.71 2.14 1 53 SER 3.34 0.68 1 54 VAL 6.84 0.73 1 55 GLU 3.37 2.84 1 56 ALA 2.90 2.59 1 57 LEU 3.61 0.43 1 58 VAL 7.09 1.12 1 59 ALA 3.49 2.36 1 60 ALA 3.05 3.06 1 61 LEU 2.42 1.31 1 62 GLN 2.87 0.41 1 63 LYS 0.17 0.45 1 64 ILE 2.89 -0.91 1 66 VAL -1.43 -0.63 1 67 GLU 1.81 0.58 1 69 VAL -1.76 -1.88 1 71 VAL -0.16 -1.06 1 72 LYS -2.70 -2.22 1 73 ILE 1.37 -0.08 1 74 ILE 1.55 -0.37 1 75 HIS -3.70 -2.39 1 76 ALA -4.07 -2.66 1 77 ALA -5.47 -3.16 1 78 VAL -1.16 1.20 1 80 ALA 0.07 -0.15 1 81 ILE 0.13 -1.58 1 83 GLU 4.39 1.81 1 84 SER 4.77 2.37 1 85 ASP 3.84 1.31 1 86 ILE 5.67 1.54 1 87 SER 4.64 2.87 1 88 LEU 3.41 1.86 1 89 ALA 3.55 2.72 1 90 THR 4.67 2.30 1 91 ALA 2.22 1.21 1 92 SER -1.31 -1.07 1 94 ALA -4.76 -0.63 1 95 ILE -1.46 -1.47 1 96 VAL -1.04 -2.41 1 97 ILE -3.01 -1.69 1 99 PHE -1.67 -2.45 1 100 ASN 3.54 -2.30 1 101 VAL -6.88 -2.46 1 102 ARG -2.48 -0.02 1 104 ASP -0.66 -0.74 1 105 ALA 4.41 2.95 1 106 ASN 3.55 2.86 1 107 ALA 2.46 0.89 1 108 LYS 4.10 1.87 1 109 ARG 3.93 2.73 1 110 ALA 3.20 1.26 1 111 ALA 3.48 2.01 1 112 GLU 2.58 2.50 1 113 SER 3.29 1.30 1 114 GLU -1.01 -1.45 1 115 LYS 4.43 -1.02 1 116 VAL -1.76 -1.91 1 117 ASP -0.83 -2.34 1 118 ILE -2.27 -0.67 1 119 ARG -2.94 -1.73 1 120 LEU -0.59 -1.68 1 stop_ save_