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 bmr5280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 -2.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 8.38 _LACS_plot.Line_2_terminator_val_y_2 8.12 _LACS_plot.Y_axis_chem_shift_offset -1.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 LEU -8.86 0.03 0 10 LYS 0.03 1.01 1 11 LYS -0.14 0.97 1 12 ASN -0.36 2.83 1 14 LYS 0.24 1.31 1 15 TYR -1.09 0.56 1 16 GLU -2.85 -0.43 1 17 LYS -0.14 0.94 1 20 PHE -3.52 -0.16 1 21 SER -2.19 -0.30 1 22 TYR 5.34 4.40 1 23 ASN 4.13 4.70 1 24 ALA 3.67 3.84 1 25 LEU 3.32 4.15 1 26 ILE 5.71 5.89 1 27 MET 4.57 5.68 1 28 MET 2.94 4.83 1 29 ALA 1.57 2.72 1 30 ILE 5.01 5.85 1 31 ARG 4.53 4.77 1 32 GLN 1.26 1.31 1 33 SER 1.38 1.85 1 35 GLU -0.56 0.23 1 36 LYS 4.52 1.00 1 37 ARG -2.45 -0.25 1 39 THR -3.44 -0.36 1 40 LEU 4.19 4.51 1 41 ASN 4.33 4.57 1 43 ILE 6.20 6.33 1 44 TYR 2.70 1.60 1 45 GLU 3.29 4.29 1 46 PHE 4.97 5.49 1 47 ILE 5.74 6.34 1 48 MET 3.93 5.68 1 49 LYS 2.95 3.69 1 50 ASN 0.72 3.17 1 51 PHE -1.31 0.39 1 53 TYR 2.45 5.07 1 54 TYR 4.06 3.96 1 55 ARG 3.15 3.65 1 56 GLU -1.73 0.18 1 57 ASN 1.16 1.70 1 58 LYS 1.50 2.00 1 59 GLN 2.29 2.59 1 61 TRP 2.76 2.46 1 62 GLN 8.39 5.67 1 63 ASN 3.95 3.97 1 64 SER 5.48 5.38 1 65 ILE 5.23 3.54 1 66 ARG 4.79 5.24 1 67 HIS 3.93 4.88 1 68 ASN 4.56 5.15 1 69 LEU 3.71 3.65 1 70 SER 1.90 3.26 1 71 LEU -1.30 1.30 1 72 ASN -0.46 1.32 1 73 LYS 2.76 2.29 1 74 SER 3.43 3.74 1 75 PHE -2.99 -1.20 1 76 VAL -3.78 -0.55 1 77 LYS -0.40 0.20 1 78 VAL -1.65 0.41 1 80 ARG 0.36 1.59 1 81 HIS -0.76 0.92 1 82 TYR 2.36 2.69 1 83 ASP 0.50 0.32 1 84 ASP -0.69 0.82 1 87 LYS -0.85 0.65 1 89 ASN -1.44 1.23 1 90 TYR -2.94 0.76 1 91 TRP -2.56 0.30 1 92 MET -5.99 -0.29 1 93 LEU -0.95 0.13 1 94 ASP -1.20 0.92 1 96 SER 1.60 2.32 1 97 SER 0.34 1.61 1 98 ASP 0.47 1.57 1 99 ASP 0.59 1.49 1 100 VAL 1.01 1.55 1 101 PHE 0.29 1.22 1 102 ILE 0.33 1.26 1 105 THR 0.46 1.36 1 106 THR 0.49 1.49 1 108 LYS 0.50 1.40 1 109 LEU 0.27 1.22 1 110 ARG 0.21 1.04 1 111 ARG 0.16 1.12 1 112 ARG 0.15 1.22 1 113 SER -0.15 0.97 1 114 THR -0.05 1.14 1 115 THR 0.01 1.19 1 116 SER 0.29 1.29 1 117 ARG 0.63 1.39 1 118 ALA 0.23 1.32 1 119 LYS 0.65 1.32 1 120 LEU 0.02 1.05 1 121 ALA -0.25 0.93 1 122 PHE -0.21 0.87 1 123 LYS -0.26 0.93 1 124 ARG 0.66 1.45 1 126 ALA -0.31 1.10 1 127 ARG 0.79 2.45 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 5.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.36 _LACS_plot.Line_2_terminator_val_x_2 8.38 _LACS_plot.Line_2_terminator_val_y_2 -0.26 _LACS_plot.Y_axis_chem_shift_offset -1.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 LEU -8.86 8.89 0 10 LYS 0.03 0.98 1 11 LYS -0.14 1.11 1 12 ASN -0.36 3.19 1 14 LYS 0.24 1.07 1 15 TYR -1.09 1.65 1 16 GLU -2.85 2.42 1 17 LYS -0.14 1.08 1 20 PHE -3.52 3.36 1 21 SER -2.19 1.89 1 22 TYR 5.34 -0.94 1 23 ASN 4.13 0.57 1 24 ALA 3.67 0.17 1 25 LEU 3.32 0.83 1 26 ILE 5.71 0.18 1 27 MET 4.57 1.11 1 28 MET 2.94 1.89 1 29 ALA 1.57 1.15 1 30 ILE 5.01 0.84 1 31 ARG 4.53 0.24 1 32 GLN 1.26 0.05 1 33 SER 1.38 0.47 1 35 GLU -0.56 0.79 1 36 LYS 4.52 -3.52 1 37 ARG -2.45 2.20 1 39 THR -3.44 3.08 1 40 LEU 4.19 0.32 1 41 ASN 4.33 0.24 1 43 ILE 6.20 0.13 1 44 TYR 2.70 -1.10 1 45 GLU 3.29 1.00 1 46 PHE 4.97 0.52 1 47 ILE 5.74 0.60 1 48 MET 3.93 1.75 1 49 LYS 2.95 0.74 1 50 ASN 0.72 2.45 1 51 PHE -1.31 1.70 1 53 TYR 2.45 2.62 1 54 TYR 4.06 -0.10 1 55 ARG 3.15 0.50 1 56 GLU -1.73 1.91 1 57 ASN 1.16 0.54 1 58 LYS 1.50 0.50 1 59 GLN 2.29 0.30 1 61 TRP 2.76 -0.30 1 62 GLN 8.39 -2.72 1 63 ASN 3.95 0.02 1 64 SER 5.48 -0.10 1 65 ILE 5.23 -1.69 1 66 ARG 4.79 0.45 1 67 HIS 3.93 0.95 1 68 ASN 4.56 0.59 1 69 LEU 3.71 -0.06 1 70 SER 1.90 1.36 1 71 LEU -1.30 2.60 1 72 ASN -0.46 1.78 1 73 LYS 2.76 -0.47 1 74 SER 3.43 0.31 1 75 PHE -2.99 1.79 1 76 VAL -3.78 3.23 1 77 LYS -0.40 0.60 1 78 VAL -1.65 2.06 1 80 ARG 0.36 1.23 1 81 HIS -0.76 1.68 1 82 TYR 2.36 0.33 1 83 ASP 0.50 -0.18 1 84 ASP -0.69 1.51 1 87 LYS -0.85 1.50 1 89 ASN -1.44 2.67 1 90 TYR -2.94 3.70 1 91 TRP -2.56 2.86 1 92 MET -5.99 5.70 1 93 LEU -0.95 1.08 1 94 ASP -1.20 2.12 1 96 SER 1.60 0.72 1 97 SER 0.34 1.27 1 98 ASP 0.47 1.10 1 99 ASP 0.59 0.90 1 100 VAL 1.01 0.54 1 101 PHE 0.29 0.93 1 102 ILE 0.33 0.93 1 105 THR 0.46 0.90 1 106 THR 0.49 1.00 1 108 LYS 0.50 0.90 1 109 LEU 0.27 0.95 1 110 ARG 0.21 0.83 1 111 ARG 0.16 0.96 1 112 ARG 0.15 1.07 1 113 SER -0.15 1.12 1 114 THR -0.05 1.19 1 115 THR 0.01 1.18 1 116 SER 0.29 1.00 1 117 ARG 0.63 0.76 1 118 ALA 0.23 1.09 1 119 LYS 0.65 0.67 1 120 LEU 0.02 1.03 1 121 ALA -0.25 1.18 1 122 PHE -0.21 1.08 1 123 LYS -0.26 1.19 1 124 ARG 0.66 0.79 1 126 ALA -0.31 1.41 1 127 ARG 0.79 1.66 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 0.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _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 8.38 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 29 ALA 1.57 -2.22 0 10 LYS 0.03 0.12 1 11 LYS -0.14 0.13 1 12 ASN -0.36 -0.02 1 14 LYS 0.24 -0.01 1 15 TYR -1.09 0.23 1 16 GLU -2.85 0.08 1 17 LYS -0.14 -1.65 1 20 PHE -3.52 0.16 1 21 SER -2.19 -0.06 1 22 TYR 5.34 -0.08 1 23 ASN 4.13 -0.09 1 24 ALA 3.67 -0.11 1 25 LEU 3.32 -0.28 1 26 ILE 5.71 -0.83 1 27 MET 4.57 -0.46 1 28 MET 2.94 -0.63 1 30 ILE 5.01 -0.83 1 31 ARG 4.53 -0.33 1 32 GLN 1.26 0.10 1 33 SER 1.38 0.04 1 35 GLU -0.56 0.18 1 36 LYS 4.52 -0.21 1 37 ARG -2.45 1.02 1 38 LEU -8.86 0.87 1 39 THR -3.44 0.66 1 40 LEU 4.19 -0.58 1 41 ASN 4.33 -0.35 1 43 ILE 6.20 -0.49 1 44 TYR 2.70 0.31 1 45 GLU 3.29 -0.16 1 46 PHE 4.97 -0.40 1 47 ILE 5.74 -0.44 1 48 MET 3.93 -0.53 1 49 LYS 2.95 -0.28 1 50 ASN 0.72 -0.53 1 51 PHE -1.31 0.34 1 53 TYR 2.45 -0.58 1 54 TYR 4.06 -0.49 1 55 ARG 3.15 -0.03 1 56 GLU -1.73 0.18 1 57 ASN 1.16 0.01 1 58 LYS 1.50 0.14 1 59 GLN 2.29 -0.08 1 61 TRP 2.76 -0.14 1 62 GLN 8.39 -1.13 1 63 ASN 3.95 -0.25 1 64 SER 5.48 -0.13 1 65 ILE 5.23 -0.51 1 66 ARG 4.79 -0.56 1 67 HIS 3.93 -0.25 1 68 ASN 4.56 -0.35 1 69 LEU 3.71 -0.48 1 70 SER 1.90 0.03 1 71 LEU -1.30 0.21 1 72 ASN -0.46 0.15 1 73 LYS 2.76 0.13 1 74 SER 3.43 -0.20 1 75 PHE -2.99 1.01 1 76 VAL -3.78 0.53 1 77 LYS -0.40 -0.26 1 78 VAL -1.65 0.05 1 80 ARG 0.36 -0.12 1 81 HIS -0.76 0.07 1 82 TYR 2.36 -0.16 1 83 ASP 0.50 -0.06 1 84 ASP -0.69 0.10 1 87 LYS -0.85 0.18 1 89 ASN -1.44 0.08 1 90 TYR -2.94 0.06 1 91 TRP -2.56 0.71 1 92 MET -5.99 0.66 1 93 LEU -0.95 0.80 1 94 ASP -1.20 -0.16 1 96 SER 1.60 0.02 1 97 SER 0.34 0.04 1 98 ASP 0.47 0.07 1 99 ASP 0.59 0.08 1 100 VAL 1.01 -0.01 1 101 PHE 0.29 0.15 1 102 ILE 0.33 0.07 1 105 THR 0.46 0.17 1 106 THR 0.49 0.18 1 108 LYS 0.50 0.07 1 109 LEU 0.27 0.10 1 110 ARG 0.21 0.10 1 111 ARG 0.16 0.09 1 112 ARG 0.15 0.11 1 113 SER -0.15 0.19 1 114 THR -0.05 0.18 1 115 THR 0.01 0.14 1 116 SER 0.29 0.10 1 117 ARG 0.63 0.11 1 118 ALA 0.23 0.06 1 119 LYS 0.65 0.07 1 120 LEU 0.02 0.10 1 121 ALA -0.25 0.11 1 122 PHE -0.21 0.14 1 123 LYS -0.26 0.13 1 124 ARG 0.66 0.05 1 126 ALA -0.31 0.06 1 127 ARG 0.79 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.86 _LACS_plot.Line_1_terminator_val_y_1 -2.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 8.38 _LACS_plot.Line_2_terminator_val_y_2 3.93 _LACS_plot.Y_axis_chem_shift_offset -0.93 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 LEU -8.86 0.40 0 10 LYS 0.03 0.58 1 11 LYS -0.14 -0.26 1 12 ASN -0.36 2.15 1 14 LYS 0.24 0.54 1 15 TYR -1.09 1.24 1 16 GLU -2.85 0.05 1 21 SER -2.19 0.90 1 22 TYR 5.34 2.01 1 23 ASN 4.13 2.84 1 24 ALA 3.67 3.58 1 25 LEU 3.32 1.70 1 26 ILE 5.71 2.20 1 27 MET 4.57 2.37 1 28 MET 2.94 2.37 1 30 ILE 5.01 4.07 1 31 ARG 4.53 2.21 1 32 GLN 1.26 0.90 1 35 GLU -0.56 -0.05 1 36 LYS 4.52 -0.93 1 37 ARG -2.45 -1.15 1 39 THR -3.44 1.64 1 40 LEU 4.19 1.05 1 41 ASN 4.33 3.54 1 43 ILE 6.20 2.37 1 44 TYR 2.70 3.85 1 45 GLU 3.29 3.03 1 46 PHE 4.97 3.55 1 47 ILE 5.74 1.51 1 48 MET 3.93 2.02 1 49 LYS 2.95 2.26 1 50 ASN 0.72 -0.12 1 53 TYR 2.45 2.14 1 54 TYR 4.06 0.75 1 55 ARG 3.15 1.40 1 56 GLU -1.73 0.47 1 57 ASN 1.16 1.87 1 59 GLN 2.29 2.77 1 61 TRP 2.76 2.90 1 62 GLN 8.39 4.82 1 63 ASN 3.95 3.59 1 64 SER 5.48 3.44 1 65 ILE 5.23 0.97 1 66 ARG 4.79 3.26 1 67 HIS 3.93 3.85 1 68 ASN 4.56 3.36 1 69 LEU 3.71 0.33 1 70 SER 1.90 1.56 1 71 LEU -1.30 0.26 1 72 ASN -0.46 1.33 1 73 LYS 2.76 1.33 1 74 SER 3.43 -0.85 1 75 PHE -2.99 -0.09 1 76 VAL -3.78 -1.19 1 77 LYS -0.40 0.79 1 80 ARG 0.36 1.16 1 81 HIS -0.76 3.06 1 82 TYR 2.36 0.47 1 83 ASP 0.50 0.09 1 87 LYS -0.85 1.14 1 89 ASN -1.44 0.23 1 90 TYR -2.94 -0.51 1 91 TRP -2.56 -0.09 1 92 MET -5.99 -0.98 1 93 LEU -0.95 0.65 1 96 SER 1.60 1.46 1 97 SER 0.34 1.46 1 99 ASP 0.59 1.00 1 100 VAL 1.01 0.59 1 102 ILE 0.33 0.99 1 105 THR 0.46 1.43 1 106 THR 0.49 1.53 1 108 LYS 0.50 0.96 1 109 LEU 0.27 0.58 1 110 ARG 0.21 0.72 1 111 ARG 0.16 0.86 1 113 SER -0.15 1.21 1 114 THR -0.05 1.13 1 115 THR 0.01 0.90 1 116 SER 0.29 2.89 1 118 ALA 0.23 -0.80 1 119 LYS 0.65 0.98 1 120 LEU 0.02 0.26 1 122 PHE -0.21 0.68 1 123 LYS -0.26 0.70 1 124 ARG 0.66 1.36 1 126 ALA -0.31 -0.03 1 stop_ save_