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 bmr30313_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.90 _LACS_plot.Line_1_terminator_val_y_1 -1.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.66 _LACS_plot.Line_2_terminator_val_x_2 7.42 _LACS_plot.Line_2_terminator_val_y_2 5.84 _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 65 PHE 7.13 2.83 0 10 SER -0.01 -0.08 1 11 ALA 0.31 0.29 1 12 THR 0.19 0.12 1 13 ASP 0.40 0.31 1 14 THR 2.33 1.64 1 16 LYS 2.50 1.89 1 17 ARG 3.08 2.10 1 18 GLU 2.90 2.25 1 19 LYS 2.95 2.19 1 20 GLN 3.59 2.43 1 21 LEU 3.52 3.02 1 22 GLN 4.33 3.12 1 23 GLN 4.18 3.11 1 24 TRP 1.83 1.12 1 25 LYS 5.26 4.86 1 26 ASN 4.38 2.98 1 27 ASN 4.26 2.97 1 28 LEU 2.09 2.68 1 29 LYS 6.45 5.00 1 30 ASN 4.05 3.04 1 31 ASP 5.11 3.33 1 32 VAL 6.40 3.85 1 33 ASP 4.30 3.27 1 34 ASN -0.11 0.20 1 35 THR -1.44 0.28 1 36 ILE 2.00 -0.33 1 37 LEU 1.28 1.18 1 38 SER -2.01 -0.85 1 39 HIS 4.55 5.32 1 40 GLU 4.55 3.56 1 41 GLN 2.61 3.08 1 42 LYS 4.40 4.33 1 43 ASN 4.21 2.98 1 44 GLU 3.62 2.96 1 45 PHE 6.39 6.35 1 46 LYS 7.42 5.82 1 47 THR 5.94 4.92 1 48 LYS 3.80 3.40 1 49 ILE 4.89 4.22 1 50 ASP 4.58 3.58 1 51 GLU 0.04 0.49 1 52 THR 0.84 0.52 1 53 ASN -2.35 -1.10 1 54 ASP -2.90 -0.66 1 55 SER 5.19 4.21 1 56 ASP 4.74 3.48 1 57 ALA 2.34 2.08 1 58 LEU 3.99 3.02 1 59 LEU 3.38 2.71 1 60 GLU 3.45 2.46 1 61 LEU 3.38 3.28 1 62 GLU 2.33 1.64 1 63 ASN 3.85 2.99 1 64 GLN 4.29 3.45 1 66 ASN 4.49 3.52 1 67 GLU 3.22 2.21 1 68 THR 6.63 5.47 1 69 ASN 2.82 3.82 1 70 ARG 4.56 4.15 1 71 LEU 3.58 2.71 1 72 LEU 3.01 2.36 1 73 HIS 5.58 5.48 1 74 ILE 4.26 3.56 1 75 LYS 2.78 2.07 1 76 GLN 2.93 2.15 1 77 HIS 2.63 2.86 1 78 GLU 1.51 1.50 1 79 GLU 1.51 1.24 1 80 VAL 2.95 2.11 1 81 GLU 1.75 1.36 1 82 LYS 2.71 2.10 1 83 ASP 1.62 1.45 1 84 LYS 2.51 1.92 1 85 LYS 2.09 1.57 1 86 ALA 1.39 0.87 1 87 LYS 1.28 0.85 1 88 GLN 0.94 0.59 1 89 GLN 0.65 0.43 1 90 LYS 0.83 0.41 1 91 THR 0.31 0.12 1 92 LEU 0.23 0.05 1 93 LYS 0.18 -0.07 1 94 GLN 0.31 0.23 1 95 SER 0.21 0.05 1 96 ASP 0.29 0.12 1 97 THR 0.26 0.10 1 98 LYS 0.40 0.04 1 99 VAL 1.18 1.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30313_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.90 _LACS_plot.Line_1_terminator_val_y_1 1.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 7.42 _LACS_plot.Line_2_terminator_val_y_2 -1.58 _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 65 PHE 7.13 -4.30 0 10 SER -0.01 -0.07 1 11 ALA 0.31 -0.02 1 12 THR 0.19 -0.07 1 13 ASP 0.40 -0.09 1 14 THR 2.33 -0.69 1 16 LYS 2.50 -0.61 1 17 ARG 3.08 -0.98 1 18 GLU 2.90 -0.65 1 19 LYS 2.95 -0.76 1 20 GLN 3.59 -1.16 1 21 LEU 3.52 -0.50 1 22 GLN 4.33 -1.21 1 23 GLN 4.18 -1.07 1 24 TRP 1.83 -0.71 1 25 LYS 5.26 -0.40 1 26 ASN 4.38 -1.40 1 27 ASN 4.26 -1.29 1 28 LEU 2.09 0.59 1 29 LYS 6.45 -1.45 1 30 ASN 4.05 -1.01 1 31 ASP 5.11 -1.78 1 32 VAL 6.40 -2.55 1 33 ASP 4.30 -1.03 1 34 ASN -0.11 0.31 1 35 THR -1.44 1.72 1 36 ILE 2.00 -2.33 1 37 LEU 1.28 -0.10 1 38 SER -2.01 1.16 1 39 HIS 4.55 0.77 1 40 GLU 4.55 -0.99 1 41 GLN 2.61 0.47 1 42 LYS 4.40 -0.07 1 43 ASN 4.21 -1.23 1 44 GLU 3.62 -0.66 1 45 PHE 6.39 -0.04 1 46 LYS 7.42 -1.60 1 47 THR 5.94 -1.02 1 48 LYS 3.80 -0.40 1 49 ILE 4.89 -0.67 1 50 ASP 4.58 -1.00 1 51 GLU 0.04 0.45 1 52 THR 0.84 -0.32 1 53 ASN -2.35 1.25 1 54 ASP -2.90 2.24 1 55 SER 5.19 -0.98 1 56 ASP 4.74 -1.26 1 57 ALA 2.34 -0.26 1 58 LEU 3.99 -0.97 1 59 LEU 3.38 -0.67 1 60 GLU 3.45 -0.99 1 61 LEU 3.38 -0.10 1 62 GLU 2.33 -0.69 1 63 ASN 3.85 -0.86 1 64 GLN 4.29 -0.84 1 66 ASN 4.49 -0.97 1 67 GLU 3.22 -1.01 1 68 THR 6.63 -1.16 1 69 ASN 2.82 1.00 1 70 ARG 4.56 -0.41 1 71 LEU 3.58 -0.87 1 72 LEU 3.01 -0.65 1 73 HIS 5.58 -0.10 1 74 ILE 4.26 -0.70 1 75 LYS 2.78 -0.71 1 76 GLN 2.93 -0.78 1 77 HIS 2.63 0.23 1 78 GLU 1.51 -0.01 1 79 GLU 1.51 -0.27 1 80 VAL 2.95 -0.84 1 81 GLU 1.75 -0.39 1 82 LYS 2.71 -0.61 1 83 ASP 1.62 -0.17 1 84 LYS 2.51 -0.59 1 85 LYS 2.09 -0.52 1 86 ALA 1.39 -0.52 1 87 LYS 1.28 -0.43 1 88 GLN 0.94 -0.35 1 89 GLN 0.65 -0.22 1 90 LYS 0.83 -0.42 1 91 THR 0.31 -0.19 1 92 LEU 0.23 -0.18 1 93 LYS 0.18 -0.25 1 94 GLN 0.31 -0.08 1 95 SER 0.21 -0.16 1 96 ASP 0.29 -0.17 1 97 THR 0.26 -0.16 1 98 LYS 0.40 -0.36 1 99 VAL 1.18 0.15 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30313_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.90 _LACS_plot.Line_1_terminator_val_y_1 0.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 7.42 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _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 62 GLU 2.33 -1.08 0 10 SER -0.01 0.01 1 11 ALA 0.31 0.08 1 12 THR 0.19 -0.03 1 13 ASP 0.40 0.06 1 14 THR 2.33 -0.18 1 16 LYS 2.50 -0.15 1 17 ARG 3.08 -0.16 1 18 GLU 2.90 -0.21 1 19 LYS 2.95 -0.14 1 20 GLN 3.59 -0.12 1 21 LEU 3.52 0.09 1 22 GLN 4.33 -0.40 1 23 GLN 4.18 -0.21 1 24 TRP 1.83 0.15 1 25 LYS 5.26 -0.80 1 26 ASN 4.38 -0.41 1 27 ASN 4.26 -0.22 1 28 LEU 2.09 -0.07 1 29 LYS 6.45 -0.81 1 30 ASN 4.05 -0.34 1 31 ASP 5.11 -0.18 1 32 VAL 6.40 -1.25 1 33 ASP 4.30 -0.19 1 34 ASN -0.11 0.20 1 35 THR -1.44 0.28 1 36 ILE 2.00 0.55 1 37 LEU 1.28 -0.33 1 38 SER -2.01 -0.07 1 39 HIS 4.55 -0.56 1 40 GLU 4.55 -0.35 1 41 GLN 2.61 -0.20 1 42 LYS 4.40 -0.62 1 43 ASN 4.21 -0.44 1 44 GLU 3.62 -0.37 1 45 PHE 6.39 -0.48 1 46 LYS 7.42 -0.54 1 47 THR 5.94 -0.39 1 48 LYS 3.80 -0.33 1 49 ILE 4.89 -0.77 1 50 ASP 4.58 -0.31 1 51 GLU 0.04 -0.22 1 52 THR 0.84 0.01 1 53 ASN -2.35 0.29 1 54 ASP -2.90 0.16 1 55 SER 5.19 -0.25 1 56 ASP 4.74 -0.10 1 57 ALA 2.34 -0.08 1 58 LEU 3.99 -0.41 1 59 LEU 3.38 0.00 1 60 GLU 3.45 -0.09 1 61 LEU 3.38 -0.13 1 63 ASN 3.85 -0.41 1 64 GLN 4.29 -0.14 1 65 PHE 7.13 -0.63 1 66 ASN 4.49 -0.23 1 67 GLU 3.22 0.12 1 68 THR 6.63 -0.36 1 69 ASN 2.82 -0.29 1 70 ARG 4.56 -0.22 1 71 LEU 3.58 -0.22 1 72 LEU 3.01 -0.15 1 73 HIS 5.58 -0.55 1 74 ILE 4.26 -0.26 1 75 LYS 2.78 -0.13 1 76 GLN 2.93 -0.16 1 77 HIS 2.63 -0.23 1 78 GLU 1.51 -0.22 1 79 GLU 1.51 -0.17 1 80 VAL 2.95 -0.17 1 81 GLU 1.75 -0.23 1 82 LYS 2.71 -0.22 1 83 ASP 1.62 -0.10 1 84 LYS 2.51 -0.21 1 85 LYS 2.09 -0.14 1 86 ALA 1.39 -0.08 1 87 LYS 1.28 -0.11 1 88 GLN 0.94 -0.07 1 89 GLN 0.65 -0.06 1 90 LYS 0.83 0.02 1 91 THR 0.31 -0.05 1 92 LEU 0.23 0.02 1 93 LYS 0.18 0.00 1 94 GLN 0.31 0.00 1 95 SER 0.21 -0.03 1 96 ASP 0.29 0.04 1 97 THR 0.26 -0.06 1 98 LYS 0.40 0.06 1 99 VAL 1.18 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30313_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.90 _LACS_plot.Line_1_terminator_val_y_1 -1.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.49 _LACS_plot.Line_2_terminator_val_x_2 7.42 _LACS_plot.Line_2_terminator_val_y_2 3.47 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 99 VAL 1.18 4.77 0 10 SER -0.01 -0.03 1 11 ALA 0.31 0.40 1 12 THR 0.19 -0.05 1 13 ASP 0.40 0.80 1 14 THR 2.33 1.32 1 16 LYS 2.50 1.50 1 17 ARG 3.08 1.93 1 18 GLU 2.90 1.87 1 19 LYS 2.95 2.15 1 20 GLN 3.59 2.50 1 21 LEU 3.52 0.80 1 22 GLN 4.33 2.50 1 23 GLN 4.18 2.15 1 24 TRP 1.83 2.44 1 25 LYS 5.26 1.91 1 26 ASN 4.38 3.04 1 27 ASN 4.26 2.52 1 28 LEU 2.09 1.61 1 29 LYS 6.45 1.30 1 30 ASN 4.05 2.50 1 31 ASP 5.11 4.22 1 32 VAL 6.40 2.81 1 33 ASP 4.30 0.89 1 34 ASN -0.11 0.70 1 35 THR -1.44 0.10 1 36 ILE 2.00 -0.70 1 37 LEU 1.28 -1.70 1 38 SER -2.01 0.23 1 39 HIS 4.55 3.43 1 40 GLU 4.55 2.95 1 41 GLN 2.61 3.30 1 42 LYS 4.40 1.98 1 43 ASN 4.21 2.80 1 44 GLU 3.62 2.60 1 45 PHE 6.39 2.50 1 46 LYS 7.42 1.07 1 47 THR 5.94 1.48 1 48 LYS 3.80 3.20 1 49 ILE 4.89 0.80 1 50 ASP 4.58 2.50 1 51 GLU 0.04 -0.60 1 52 THR 0.84 -2.10 1 53 ASN -2.35 -1.60 1 54 ASP -2.90 -0.06 1 55 SER 5.19 1.25 1 56 ASP 4.74 2.80 1 57 ALA 2.34 3.40 1 58 LEU 3.99 0.81 1 59 LEU 3.38 2.36 1 60 GLU 3.45 2.50 1 61 LEU 3.38 0.46 1 62 GLU 2.33 1.84 1 63 ASN 3.85 3.00 1 64 GLN 4.29 4.10 1 65 PHE 7.13 2.10 1 66 ASN 4.49 2.90 1 67 GLU 3.22 1.89 1 68 THR 6.63 1.59 1 69 ASN 2.82 2.22 1 70 ARG 4.56 3.23 1 71 LEU 3.58 2.84 1 72 LEU 3.01 2.37 1 73 HIS 5.58 3.68 1 74 ILE 4.26 1.67 1 75 LYS 2.78 1.60 1 76 GLN 2.93 1.40 1 77 HIS 2.63 2.20 1 78 GLU 1.51 1.50 1 79 GLU 1.51 1.30 1 80 VAL 2.95 1.56 1 81 GLU 1.75 1.40 1 82 LYS 2.71 1.30 1 83 ASP 1.62 1.00 1 84 LYS 2.51 1.60 1 85 LYS 2.09 1.00 1 86 ALA 1.39 1.10 1 87 LYS 1.28 0.80 1 88 GLN 0.94 0.47 1 89 GLN 0.65 0.32 1 90 LYS 0.83 0.20 1 91 THR 0.31 -0.20 1 92 LEU 0.23 -0.40 1 93 LYS 0.18 0.00 1 94 GLN 0.31 0.10 1 95 SER 0.21 -0.20 1 96 ASP 0.29 0.00 1 97 THR 0.26 -0.40 1 98 LYS 0.40 -1.00 1 stop_ save_