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 bmr10251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.87 _LACS_plot.Line_1_terminator_val_y_1 -2.92 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.94 _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 6.72 _LACS_plot.Line_2_terminator_val_y_2 5.03 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 PHE -7.87 -0.35 0 49 HIS -5.44 1.48 0 10 SER 0.28 0.12 1 11 THR 1.21 0.68 1 12 VAL 3.45 2.56 1 13 GLU 2.81 1.75 1 14 LEU -1.02 -1.78 1 15 SER 0.66 1.48 1 17 THR -0.44 0.47 1 18 VAL 3.70 2.61 1 19 VAL -1.06 -0.14 1 20 LYS -2.92 0.60 1 21 GLN -5.54 -1.49 1 23 TYR -0.33 0.12 1 24 LEU -4.87 -1.19 1 25 ALA -3.75 -1.78 1 26 LYS -4.84 -1.82 1 27 GLN -0.38 0.08 1 29 HIS 1.52 3.80 1 30 LYS 2.24 1.09 1 31 ARG 0.97 -0.03 1 32 LYS 1.55 0.05 1 33 ASN -1.67 -0.69 1 34 TRP -1.38 -0.38 1 35 LYS -4.80 -1.78 1 36 VAL 3.42 2.12 1 37 ARG -6.39 -2.73 1 38 ARG -1.72 -0.40 1 39 PHE -3.30 -0.28 1 40 VAL -2.72 0.14 1 41 LEU -4.47 -1.53 1 42 ARG -6.02 -1.37 1 43 LYS -7.02 -2.82 1 44 ASP 3.55 2.64 1 46 ALA -1.96 -0.94 1 48 LEU -4.91 -1.81 1 50 TYR -4.22 -4.47 1 51 TYR -3.45 -0.57 1 52 ASP -1.87 -0.89 1 54 SER 0.75 1.08 1 55 LYS -2.01 -1.04 1 56 GLU 0.71 0.50 1 57 GLU -0.00 0.36 1 58 ASN 0.42 -0.36 1 59 ARG -2.17 -0.85 1 61 VAL 1.80 0.95 1 64 PHE -3.09 -2.45 1 65 SER -1.07 -1.48 1 66 LEU -1.25 -0.86 1 67 ARG 3.99 2.14 1 69 SER -0.58 0.99 1 70 LEU -4.13 -1.19 1 71 VAL -5.43 -3.44 1 72 SER -2.92 -1.11 1 73 ALA 0.46 0.17 1 74 LEU -2.37 -1.32 1 75 GLU -0.44 -0.09 1 76 ASP 0.58 0.91 1 77 ASN 0.31 0.03 1 79 VAL 0.20 0.19 1 81 THR 1.23 1.07 1 83 VAL 0.87 0.23 1 84 LYS 0.29 0.07 1 86 ASN 0.41 -0.11 1 87 VAL 0.46 0.11 1 88 GLN -1.53 -0.36 1 90 ASN 2.56 1.51 1 91 LEU -3.00 0.06 1 92 PHE -4.52 -1.46 1 93 LYS -6.61 -3.05 1 94 VAL -3.64 -1.68 1 95 ILE -2.62 -1.39 1 96 THR -1.42 -0.43 1 97 LYS 3.63 2.38 1 98 ASP 0.26 -0.93 1 99 ASP 3.06 1.79 1 100 THR 3.58 1.69 1 101 HIS -3.77 0.07 1 102 TYR -2.22 -0.64 1 103 TYR -1.54 0.14 1 104 ILE -3.38 -1.55 1 105 GLN -4.19 -0.73 1 106 ALA -4.33 -2.23 1 107 SER 0.91 1.75 1 108 SER -3.96 -1.39 1 109 LYS 4.33 3.57 1 110 ALA 3.40 2.37 1 111 GLU 1.70 2.87 1 112 ARG 5.36 4.42 1 113 ALA 4.15 2.87 1 114 GLU 2.37 2.55 1 115 TRP 5.75 5.20 1 116 ILE 6.73 5.54 1 117 GLU 3.14 2.62 1 118 ALA 3.09 2.27 1 119 ILE 4.63 4.67 1 120 LYS 4.38 3.83 1 121 LYS 3.20 2.65 1 122 LEU -0.52 -0.03 1 123 THR 0.38 0.84 1 124 SER -0.36 0.09 1 127 SER 0.33 0.21 1 128 SER -0.23 0.14 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.87 _LACS_plot.Line_1_terminator_val_y_1 4.95 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.05 _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 6.72 _LACS_plot.Line_2_terminator_val_y_2 -1.69 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 PHE -7.87 7.52 0 49 HIS -5.44 6.92 0 10 SER 0.28 -0.16 1 11 THR 1.21 -0.53 1 12 VAL 3.45 -0.89 1 13 GLU 2.81 -1.06 1 14 LEU -1.02 -0.76 1 15 SER 0.66 0.82 1 17 THR -0.44 0.91 1 18 VAL 3.70 -1.09 1 19 VAL -1.06 0.92 1 20 LYS -2.92 3.52 1 21 GLN -5.54 4.05 1 23 TYR -0.33 0.45 1 24 LEU -4.87 3.68 1 25 ALA -3.75 1.97 1 26 LYS -4.84 3.02 1 27 GLN -0.38 0.46 1 29 HIS 1.52 2.28 1 30 LYS 2.24 -1.15 1 31 ARG 0.97 -1.00 1 32 LYS 1.55 -1.50 1 33 ASN -1.67 0.98 1 34 TRP -1.38 1.00 1 35 LYS -4.80 3.02 1 36 VAL 3.42 -1.30 1 37 ARG -6.39 3.66 1 38 ARG -1.72 1.32 1 39 PHE -3.30 3.02 1 40 VAL -2.72 2.86 1 41 LEU -4.47 2.94 1 42 ARG -6.02 4.65 1 43 LYS -7.02 4.20 1 44 ASP 3.55 -0.91 1 46 ALA -1.96 1.02 1 48 LEU -4.91 3.10 1 50 TYR -4.22 -0.25 1 51 TYR -3.45 2.88 1 52 ASP -1.87 0.98 1 54 SER 0.75 0.33 1 55 LYS -2.01 0.97 1 56 GLU 0.71 -0.21 1 57 GLU -0.00 0.36 1 58 ASN 0.42 -0.78 1 59 ARG -2.17 1.32 1 61 VAL 1.80 -0.85 1 64 PHE -3.09 0.64 1 65 SER -1.07 -0.41 1 66 LEU -1.25 0.39 1 67 ARG 3.99 -1.85 1 69 SER -0.58 1.57 1 70 LEU -4.13 2.94 1 71 VAL -5.43 1.99 1 72 SER -2.92 1.81 1 73 ALA 0.46 -0.29 1 74 LEU -2.37 1.05 1 75 GLU -0.44 0.35 1 76 ASP 0.58 0.33 1 77 ASN 0.31 -0.28 1 79 VAL 0.20 -0.01 1 81 THR 1.23 -0.16 1 83 VAL 0.87 -0.64 1 84 LYS 0.29 -0.22 1 86 ASN 0.41 -0.52 1 87 VAL 0.46 -0.35 1 88 GLN -1.53 1.17 1 90 ASN 2.56 -1.05 1 91 LEU -3.00 3.06 1 92 PHE -4.52 3.06 1 93 LYS -6.61 3.56 1 94 VAL -3.64 1.96 1 95 ILE -2.62 1.23 1 96 THR -1.42 0.99 1 97 LYS 3.63 -1.25 1 98 ASP 0.26 -1.19 1 99 ASP 3.06 -1.27 1 100 THR 3.58 -1.89 1 101 HIS -3.77 3.84 1 102 TYR -2.22 1.58 1 103 TYR -1.54 1.68 1 104 ILE -3.38 1.83 1 105 GLN -4.19 3.46 1 106 ALA -4.33 2.10 1 107 SER 0.91 0.84 1 108 SER -3.96 2.57 1 109 LYS 4.33 -0.76 1 110 ALA 3.40 -1.03 1 111 GLU 1.70 1.17 1 112 ARG 5.36 -0.94 1 113 ALA 4.15 -1.28 1 114 GLU 2.37 0.18 1 115 TRP 5.75 -0.55 1 116 ILE 6.73 -1.19 1 117 GLU 3.14 -0.52 1 118 ALA 3.09 -0.82 1 119 ILE 4.63 0.04 1 120 LYS 4.38 -0.55 1 121 LYS 3.20 -0.55 1 122 LEU -0.52 0.49 1 123 THR 0.38 0.46 1 124 SER -0.36 0.45 1 127 SER 0.33 -0.12 1 128 SER -0.23 0.37 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.87 _LACS_plot.Line_1_terminator_val_y_1 0.98 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 -0.79 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 SER -1.07 -1.21 0 10 SER 0.28 -0.05 1 11 THR 1.21 -0.15 1 12 VAL 3.45 -0.29 1 13 GLU 2.81 -1.11 1 14 LEU -1.02 -0.18 1 15 SER 0.66 -0.17 1 17 THR -0.44 -0.03 1 18 VAL 3.70 -0.17 1 19 VAL -1.06 0.11 1 20 LYS -2.92 0.03 1 21 GLN -5.54 1.66 1 23 TYR -0.33 1.04 1 24 LEU -4.87 0.38 1 25 ALA -3.75 1.16 1 26 LYS -4.84 0.90 1 27 GLN -0.38 -0.82 1 29 HIS 1.52 -0.37 1 30 LYS 2.24 -0.22 1 31 ARG 0.97 -0.36 1 32 LYS 1.55 -0.16 1 33 ASN -1.67 0.06 1 34 TRP -1.38 0.09 1 35 LYS -4.80 0.53 1 36 VAL 3.42 0.15 1 37 ARG -6.39 0.71 1 38 ARG -1.72 0.29 1 39 PHE -3.30 0.80 1 40 VAL -2.72 0.73 1 41 LEU -4.47 0.95 1 42 ARG -6.02 1.03 1 43 LYS -7.02 0.24 1 44 ASP 3.55 -0.58 1 46 ALA -1.96 1.14 1 47 PHE -7.87 0.17 1 48 LEU -4.91 0.86 1 49 HIS -5.44 0.31 1 50 TYR -4.22 1.15 1 51 TYR -3.45 0.05 1 52 ASP -1.87 0.13 1 54 SER 0.75 0.01 1 55 LYS -2.01 0.26 1 56 GLU 0.71 -0.18 1 57 GLU -0.00 -0.14 1 58 ASN 0.42 0.03 1 59 ARG -2.17 0.11 1 61 VAL 1.80 -0.15 1 64 PHE -3.09 0.31 1 66 LEU -1.25 0.13 1 67 ARG 3.99 -0.17 1 69 SER -0.58 0.34 1 70 LEU -4.13 0.51 1 71 VAL -5.43 1.43 1 72 SER -2.92 0.27 1 73 ALA 0.46 0.09 1 74 LEU -2.37 0.38 1 75 GLU -0.44 -0.01 1 76 ASP 0.58 0.03 1 77 ASN 0.31 -0.01 1 79 VAL 0.20 -0.10 1 81 THR 1.23 -0.26 1 83 VAL 0.87 -0.14 1 84 LYS 0.29 -0.04 1 86 ASN 0.41 -0.07 1 87 VAL 0.46 -0.17 1 88 GLN -1.53 -0.04 1 90 ASN 2.56 -0.52 1 91 LEU -3.00 1.03 1 92 PHE -4.52 0.49 1 93 LYS -6.61 1.26 1 94 VAL -3.64 0.75 1 95 ILE -2.62 0.62 1 96 THR -1.42 0.23 1 97 LYS 3.63 -0.22 1 98 ASP 0.26 -0.01 1 99 ASP 3.06 -0.39 1 100 THR 3.58 -0.17 1 101 HIS -3.77 0.17 1 102 TYR -2.22 -0.01 1 103 TYR -1.54 0.18 1 104 ILE -3.38 0.69 1 105 GLN -4.19 0.55 1 106 ALA -4.33 0.64 1 107 SER 0.91 -0.02 1 108 SER -3.96 0.20 1 109 LYS 4.33 0.46 1 110 ALA 3.40 -0.14 1 111 GLU 1.70 -0.17 1 112 ARG 5.36 -0.70 1 113 ALA 4.15 -0.40 1 114 GLU 2.37 -0.41 1 115 TRP 5.75 -0.89 1 116 ILE 6.73 -0.90 1 117 GLU 3.14 -0.47 1 118 ALA 3.09 -0.37 1 119 ILE 4.63 -0.61 1 120 LYS 4.38 -0.36 1 121 LYS 3.20 -0.23 1 122 LEU -0.52 0.20 1 123 THR 0.38 0.10 1 124 SER -0.36 0.16 1 128 SER -0.23 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.87 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.77 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 2.11 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 92 PHE -4.52 -5.66 0 10 SER 0.28 0.43 1 11 THR 1.21 1.60 1 12 VAL 3.45 2.20 1 13 GLU 2.81 -0.90 1 14 LEU -1.02 -0.74 1 15 SER 0.66 0.74 1 17 THR -0.44 0.06 1 18 VAL 3.70 0.37 1 19 VAL -1.06 -0.56 1 20 LYS -2.92 -3.78 1 21 GLN -5.54 -1.09 1 23 TYR -0.33 -0.08 1 24 LEU -4.87 -2.95 1 25 ALA -3.75 -2.05 1 26 LYS -4.84 -1.18 1 27 GLN -0.38 1.02 1 32 LYS 1.55 -0.92 1 33 ASN -1.67 -1.20 1 34 TRP -1.38 -0.01 1 35 LYS -4.80 -0.51 1 36 VAL 3.42 0.43 1 37 ARG -6.39 -1.86 1 38 ARG -1.72 -0.79 1 39 PHE -3.30 -0.38 1 40 VAL -2.72 -1.82 1 41 LEU -4.47 -2.97 1 42 ARG -6.02 -2.30 1 43 LYS -7.02 -1.95 1 44 ASP 3.55 -1.62 1 46 ALA -1.96 -0.57 1 47 PHE -7.87 -3.21 1 48 LEU -4.91 -4.03 1 49 HIS -5.44 -0.11 1 50 TYR -4.22 -1.62 1 51 TYR -3.45 -0.55 1 52 ASP -1.87 0.48 1 54 SER 0.75 -0.59 1 55 LYS -2.01 -0.63 1 56 GLU 0.71 0.48 1 58 ASN 0.42 -0.30 1 61 VAL 1.80 0.20 1 64 PHE -3.09 -2.66 1 65 SER -1.07 1.82 1 66 LEU -1.25 0.39 1 67 ARG 3.99 2.26 1 69 SER -0.58 -1.75 1 70 LEU -4.13 -1.82 1 71 VAL -5.43 -2.66 1 72 SER -2.92 -1.54 1 73 ALA 0.46 -1.09 1 74 LEU -2.37 -1.05 1 75 GLU -0.44 -0.13 1 76 ASP 0.58 -0.21 1 77 ASN 0.31 0.37 1 81 THR 1.23 0.57 1 83 VAL 0.87 -0.25 1 84 LYS 0.29 0.23 1 86 ASN 0.41 -0.21 1 87 VAL 0.46 -1.40 1 88 GLN -1.53 -0.36 1 90 ASN 2.56 -0.27 1 91 LEU -3.00 1.13 1 93 LYS -6.61 -1.77 1 94 VAL -3.64 -1.89 1 95 ILE -2.62 1.24 1 96 THR -1.42 2.32 1 97 LYS 3.63 -0.11 1 98 ASP 0.26 -1.03 1 99 ASP 3.06 -0.99 1 100 THR 3.58 -1.32 1 101 HIS -3.77 0.24 1 102 TYR -2.22 -1.77 1 103 TYR -1.54 -1.76 1 104 ILE -3.38 -3.63 1 105 GLN -4.19 -0.36 1 106 ALA -4.33 -1.95 1 107 SER 0.91 -0.82 1 108 SER -3.96 -0.22 1 109 LYS 4.33 3.39 1 110 ALA 3.40 2.10 1 111 GLU 1.70 1.99 1 112 ARG 5.36 0.18 1 113 ALA 4.15 2.32 1 114 GLU 2.37 3.99 1 115 TRP 5.75 1.61 1 116 ILE 6.73 1.17 1 117 GLU 3.14 1.88 1 118 ALA 3.09 2.06 1 119 ILE 4.63 2.16 1 120 LYS 4.38 3.07 1 121 LYS 3.20 1.36 1 122 LEU -0.52 0.30 1 123 THR 0.38 1.01 1 124 SER -0.36 -0.19 1 127 SER 0.33 0.03 1 128 SER -0.23 -0.68 1 stop_ save_