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 bmr26553_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.14 _LACS_plot.Line_1_terminator_val_y_1 -3.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.73 _LACS_plot.Line_2_terminator_val_x_2 6.80 _LACS_plot.Line_2_terminator_val_y_2 5.20 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 MET -7.14 -0.96 0 10 LYS 0.73 0.35 1 11 THR -2.09 -1.51 1 12 PHE -1.32 -0.20 1 14 GLN -0.86 -0.60 1 15 LYS 1.08 0.66 1 17 VAL 0.18 -0.07 1 18 LYS -5.36 -2.51 1 19 PHE -3.55 -1.99 1 20 GLN -4.10 -1.71 1 21 LEU -1.57 -0.37 1 22 GLU -5.47 -2.52 1 23 ASP 2.96 1.64 1 24 ASP 1.47 0.23 1 26 GLU -1.13 -0.80 1 27 PHE -1.96 -0.36 1 28 TYR -6.14 -1.86 1 30 ILE 0.43 0.03 1 32 SER 5.12 2.95 1 33 GLU 2.74 2.30 1 34 VAL 6.62 4.80 1 36 ASN 4.05 3.04 1 37 TYR 1.63 1.98 1 38 LEU -0.70 -1.07 1 39 ARG 5.23 0.63 1 40 MET -1.12 -1.20 1 41 PHE -2.02 -1.05 1 42 ARG 4.35 1.17 1 44 SER 3.95 2.96 1 45 LEU 2.62 3.00 1 46 TYR 1.38 -0.83 1 47 LYS 1.93 1.07 1 48 ARG 2.28 1.43 1 49 TYR -1.67 -1.79 1 51 SER 0.99 0.60 1 52 LEU -0.29 0.68 1 53 TRP 2.42 1.98 1 54 ARG -2.02 -0.96 1 55 ARG -3.12 -1.43 1 56 LEU -0.14 -0.84 1 57 ALA -1.30 -1.72 1 58 THR -1.75 -0.98 1 59 VAL 5.97 4.65 1 60 GLU 3.99 2.96 1 61 GLU 2.65 2.40 1 62 ARG 5.53 4.31 1 63 LYS 4.42 3.41 1 64 LYS 3.43 2.72 1 65 ILE 4.46 3.78 1 66 VAL 4.30 3.05 1 67 ALA 1.83 1.27 1 68 SER 1.12 0.96 1 69 SER 1.42 0.88 1 70 HIS 1.24 1.88 1 72 LYS 0.23 -0.04 1 73 LYS 0.50 0.11 1 74 THR -0.13 -0.31 1 75 LYS 0.11 -0.14 1 77 ASN 0.66 0.09 1 78 THR 0.05 -0.10 1 79 LYS 0.82 0.19 1 80 ASP 0.00 -0.09 1 81 HIS 0.21 0.89 1 83 TYR 0.23 -0.01 1 84 THR 0.29 -0.07 1 85 THR 0.06 -0.30 1 86 LEU 0.12 0.01 1 87 ALA -0.31 -0.23 1 88 THR 1.97 1.35 1 89 SER -0.72 -0.84 1 90 VAL -3.06 -0.71 1 91 THR 1.37 1.24 1 92 LEU -2.19 -1.26 1 93 LEU -4.88 -2.65 1 94 LYS 0.65 0.44 1 95 ALA 1.85 2.20 1 96 SER 5.23 2.96 1 97 GLU 2.98 2.29 1 98 VAL 5.84 4.31 1 99 GLU 4.63 3.07 1 100 GLU 4.29 3.33 1 101 ILE 6.80 5.19 1 102 LEU 4.63 2.18 1 103 ASP -0.07 0.07 1 105 ASN -0.45 -1.88 1 106 ASP -2.53 -1.03 1 107 GLU 4.59 3.85 1 108 LYS 3.73 1.63 1 109 TYR 1.65 1.16 1 110 LYS 0.10 0.95 1 111 ALA -0.38 -0.29 1 112 VAL 0.27 -0.08 1 113 SER -0.43 -0.61 1 114 ILE 0.06 0.03 1 115 SER 0.50 1.32 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26553_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.14 _LACS_plot.Line_1_terminator_val_y_1 3.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _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 6.80 _LACS_plot.Line_2_terminator_val_y_2 -1.60 _LACS_plot.Y_axis_chem_shift_offset 0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 MET -7.14 6.18 0 10 LYS 0.73 -0.38 1 11 THR -2.09 0.58 1 12 PHE -1.32 1.12 1 14 GLN -0.86 0.26 1 15 LYS 1.08 -0.42 1 17 VAL 0.18 -0.25 1 18 LYS -5.36 2.85 1 19 PHE -3.55 1.56 1 20 GLN -4.10 2.39 1 21 LEU -1.57 1.20 1 22 GLU -5.47 2.95 1 23 ASP 2.96 -1.32 1 24 ASP 1.47 -1.24 1 26 GLU -1.13 0.33 1 27 PHE -1.96 1.60 1 28 TYR -6.14 4.28 1 30 ILE 0.43 -0.40 1 32 SER 5.12 -2.17 1 33 GLU 2.74 -0.44 1 34 VAL 6.62 -1.82 1 36 ASN 4.05 -1.01 1 37 TYR 1.63 0.35 1 38 LEU -0.70 -0.37 1 39 ARG 5.23 -4.60 1 40 MET -1.12 -0.08 1 41 PHE -2.02 0.97 1 42 ARG 4.35 -3.18 1 44 SER 3.95 -0.99 1 45 LEU 2.62 0.38 1 46 TYR 1.38 -2.21 1 47 LYS 1.93 -0.86 1 48 ARG 2.28 -0.85 1 49 TYR -1.67 -0.12 1 51 SER 0.99 -0.39 1 52 LEU -0.29 0.97 1 53 TRP 2.42 -0.44 1 54 ARG -2.02 1.06 1 55 ARG -3.12 1.69 1 56 LEU -0.14 -0.70 1 57 ALA -1.30 -0.42 1 58 THR -1.75 0.77 1 59 VAL 5.97 -1.32 1 60 GLU 3.99 -1.03 1 61 GLU 2.65 -0.25 1 62 ARG 5.53 -1.22 1 63 LYS 4.42 -1.01 1 64 LYS 3.43 -0.71 1 65 ILE 4.46 -0.68 1 66 VAL 4.30 -1.25 1 67 ALA 1.83 -0.56 1 68 SER 1.12 -0.16 1 69 SER 1.42 -0.54 1 70 HIS 1.24 0.64 1 72 LYS 0.23 -0.27 1 73 LYS 0.50 -0.39 1 74 THR -0.13 -0.18 1 75 LYS 0.11 -0.25 1 77 ASN 0.66 -0.57 1 78 THR 0.05 -0.15 1 79 LYS 0.82 -0.63 1 80 ASP 0.00 -0.09 1 81 HIS 0.21 0.68 1 83 TYR 0.23 -0.24 1 84 THR 0.29 -0.36 1 85 THR 0.06 -0.36 1 86 LEU 0.12 -0.11 1 87 ALA -0.31 0.08 1 88 THR 1.97 -0.62 1 89 SER -0.72 -0.12 1 90 VAL -3.06 2.35 1 91 THR 1.37 -0.13 1 92 LEU -2.19 0.93 1 93 LEU -4.88 2.23 1 94 LYS 0.65 -0.21 1 95 ALA 1.85 0.35 1 96 SER 5.23 -2.27 1 97 GLU 2.98 -0.69 1 98 VAL 5.84 -1.53 1 99 GLU 4.63 -1.56 1 100 GLU 4.29 -0.96 1 101 ILE 6.80 -1.61 1 102 LEU 4.63 -2.45 1 103 ASP -0.07 0.14 1 105 ASN -0.45 -1.43 1 106 ASP -2.53 1.50 1 107 GLU 4.59 -0.74 1 108 LYS 3.73 -2.10 1 109 TYR 1.65 -0.49 1 110 LYS 0.10 0.85 1 111 ALA -0.38 0.09 1 112 VAL 0.27 -0.35 1 113 SER -0.43 -0.18 1 114 ILE 0.06 -0.03 1 115 SER 0.50 0.82 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26553_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.14 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.80 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 15 LYS 1.08 -1.49 0 10 LYS 0.73 -0.05 1 11 THR -2.09 0.15 1 12 PHE -1.32 0.07 1 14 GLN -0.86 -0.03 1 17 VAL 0.18 -0.15 1 18 LYS -5.36 1.20 1 19 PHE -3.55 0.59 1 20 GLN -4.10 0.27 1 21 LEU -1.57 0.19 1 22 GLU -5.47 0.19 1 23 ASP 2.96 -0.43 1 24 ASP 1.47 -0.29 1 26 GLU -1.13 -0.34 1 27 PHE -1.96 -0.20 1 28 TYR -6.14 1.08 1 29 MET -7.14 0.20 1 30 ILE 0.43 0.38 1 32 SER 5.12 -0.13 1 33 GLU 2.74 -0.10 1 34 VAL 6.62 -0.58 1 36 ASN 4.05 -0.35 1 37 TYR 1.63 0.28 1 38 LEU -0.70 -0.17 1 39 ARG 5.23 -1.28 1 40 MET -1.12 -0.21 1 41 PHE -2.02 0.10 1 42 ARG 4.35 -0.30 1 44 SER 3.95 -0.53 1 45 LEU 2.62 -0.40 1 46 TYR 1.38 -0.33 1 47 LYS 1.93 -0.20 1 48 ARG 2.28 -0.47 1 49 TYR -1.67 0.49 1 51 SER 0.99 0.31 1 52 LEU -0.29 -0.04 1 53 TRP 2.42 -0.39 1 54 ARG -2.02 0.77 1 55 ARG -3.12 -0.12 1 56 LEU -0.14 0.44 1 57 ALA -1.30 0.31 1 58 THR -1.75 0.05 1 59 VAL 5.97 -0.53 1 60 GLU 3.99 -0.39 1 61 GLU 2.65 -0.49 1 62 ARG 5.53 -0.62 1 63 LYS 4.42 -0.42 1 64 LYS 3.43 -0.25 1 65 ILE 4.46 -0.92 1 66 VAL 4.30 -0.44 1 67 ALA 1.83 -0.12 1 68 SER 1.12 -0.04 1 69 SER 1.42 -0.12 1 70 HIS 1.24 -0.21 1 72 LYS 0.23 -0.01 1 73 LYS 0.50 0.04 1 74 THR -0.13 -0.07 1 75 LYS 0.11 -0.02 1 77 ASN 0.66 -0.05 1 78 THR 0.05 -0.07 1 79 LYS 0.82 -0.09 1 80 ASP 0.00 -0.13 1 81 HIS 0.21 -0.16 1 83 TYR 0.23 0.04 1 84 THR 0.29 -0.03 1 85 THR 0.06 -0.04 1 86 LEU 0.12 -0.08 1 87 ALA -0.31 -0.03 1 88 THR 1.97 -0.26 1 89 SER -0.72 0.01 1 90 VAL -3.06 0.17 1 91 THR 1.37 0.09 1 92 LEU -2.19 0.59 1 93 LEU -4.88 0.95 1 94 LYS 0.65 -0.09 1 95 ALA 1.85 -0.39 1 96 SER 5.23 -0.68 1 97 GLU 2.98 -0.24 1 98 VAL 5.84 -1.00 1 99 GLU 4.63 -0.63 1 100 GLU 4.29 -0.14 1 101 ILE 6.80 -0.95 1 102 LEU 4.63 -0.33 1 103 ASP -0.07 0.08 1 105 ASN -0.45 0.46 1 106 ASP -2.53 -0.02 1 107 GLU 4.59 -0.57 1 108 LYS 3.73 -0.38 1 109 TYR 1.65 -0.24 1 110 LYS 0.10 0.39 1 111 ALA -0.38 -0.05 1 112 VAL 0.27 -0.12 1 113 SER -0.43 0.04 1 114 ILE 0.06 0.10 1 115 SER 0.50 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26553_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.14 _LACS_plot.Line_1_terminator_val_y_1 -2.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 6.80 _LACS_plot.Line_2_terminator_val_y_2 2.29 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 SER 0.50 3.79 0 39 ARG 5.23 -1.93 0 10 LYS 0.73 -0.48 1 11 THR -2.09 -0.62 1 12 PHE -1.32 -0.59 1 14 GLN -0.86 -0.64 1 15 LYS 1.08 -0.57 1 17 VAL 0.18 -0.87 1 18 LYS -5.36 -1.01 1 19 PHE -3.55 -2.99 1 20 GLN -4.10 0.13 1 21 LEU -1.57 -1.79 1 22 GLU -5.47 -1.09 1 23 ASP 2.96 0.24 1 24 ASP 1.47 -0.82 1 26 GLU -1.13 -1.85 1 27 PHE -1.96 0.04 1 28 TYR -6.14 -1.81 1 29 MET -7.14 -2.16 1 30 ILE 0.43 1.77 1 32 SER 5.12 2.16 1 33 GLU 2.74 3.24 1 34 VAL 6.62 0.92 1 36 ASN 4.05 2.70 1 37 TYR 1.63 0.23 1 38 LEU -0.70 -2.42 1 40 MET -1.12 -1.40 1 41 PHE -2.02 1.60 1 42 ARG 4.35 -0.21 1 44 SER 3.95 1.68 1 45 LEU 2.62 -1.22 1 46 TYR 1.38 1.18 1 47 LYS 1.93 1.13 1 48 ARG 2.28 -0.20 1 49 TYR -1.67 -1.35 1 51 SER 0.99 -0.25 1 52 LEU -0.29 -0.73 1 53 TRP 2.42 -0.53 1 54 ARG -2.02 -1.82 1 55 ARG -3.12 -2.81 1 56 LEU -0.14 0.54 1 57 ALA -1.30 1.13 1 58 THR -1.75 0.41 1 59 VAL 5.97 1.99 1 60 GLU 3.99 3.15 1 61 GLU 2.65 2.07 1 62 ARG 5.53 1.84 1 63 LYS 4.42 2.40 1 64 LYS 3.43 2.24 1 65 ILE 4.46 2.28 1 66 VAL 4.30 1.26 1 67 ALA 1.83 0.98 1 68 SER 1.12 0.14 1 69 SER 1.42 0.04 1 70 HIS 1.24 1.50 1 72 LYS 0.23 0.00 1 73 LYS 0.50 -0.06 1 74 THR -0.13 -0.68 1 75 LYS 0.11 -0.49 1 77 ASN 0.66 0.01 1 78 THR 0.05 -0.23 1 79 LYS 0.82 -0.48 1 80 ASP 0.00 -0.52 1 81 HIS 0.21 1.18 1 83 TYR 0.23 0.03 1 84 THR 0.29 -0.50 1 85 THR 0.06 -0.52 1 86 LEU 0.12 -0.91 1 87 ALA -0.31 -0.24 1 88 THR 1.97 -0.49 1 89 SER -0.72 -1.55 1 90 VAL -3.06 -2.36 1 91 THR 1.37 -1.79 1 92 LEU -2.19 -3.54 1 93 LEU -4.88 0.31 1 94 LYS 0.65 0.41 1 95 ALA 1.85 0.29 1 96 SER 5.23 2.16 1 97 GLU 2.98 1.16 1 98 VAL 5.84 1.66 1 99 GLU 4.63 2.16 1 100 GLU 4.29 2.32 1 101 ILE 6.80 3.78 1 102 LEU 4.63 0.64 1 103 ASP -0.07 -0.02 1 105 ASN -0.45 -1.06 1 106 ASP -2.53 1.47 1 107 GLU 4.59 2.78 1 108 LYS 3.73 0.35 1 109 TYR 1.65 -0.42 1 110 LYS 0.10 -0.81 1 111 ALA -0.38 -0.69 1 112 VAL 0.27 -0.36 1 113 SER -0.43 -0.40 1 114 ILE 0.06 -1.05 1 stop_ save_