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 bmr11588_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 -2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.61 _LACS_plot.Line_2_terminator_val_x_2 9.55 _LACS_plot.Line_2_terminator_val_y_2 6.80 _LACS_plot.Y_axis_chem_shift_offset -0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 HIS -8.50 -0.68 0 10 ARG -4.33 -0.95 1 12 SER -4.28 -2.02 1 14 LEU -2.23 0.83 1 15 LEU -5.47 -2.34 1 16 VAL -0.70 -0.25 1 17 LYS -2.92 0.67 1 18 HIS -5.01 -0.23 1 19 SER 3.11 2.55 1 20 GLN -0.50 -0.51 1 21 SER 3.58 3.43 1 22 ARG 4.33 2.96 1 23 ARG -3.01 -1.08 1 25 SER -2.25 -0.29 1 26 SER -6.72 -1.36 1 27 TRP 3.11 0.62 1 28 ARG 1.83 0.96 1 29 GLN -2.90 0.08 1 30 GLU 3.13 3.01 1 31 LYS -2.06 -1.09 1 32 ILE 1.16 -0.21 1 33 THR -1.22 -1.04 1 34 ARG -0.38 -0.41 1 35 THR -2.81 -0.91 1 36 LYS 5.35 4.29 1 37 GLU 5.25 4.04 1 38 GLU 2.08 2.38 1 39 ALA 2.81 2.52 1 40 LEU 3.33 2.41 1 41 GLU 3.32 2.78 1 42 LEU 3.22 2.52 1 43 ILE 4.83 1.43 1 44 ASN 4.12 2.88 1 46 TYR 3.69 0.88 1 47 ILE 6.54 6.03 1 48 GLN 4.53 3.26 1 49 LYS 2.78 3.27 1 50 ILE 2.68 2.80 1 51 LYS 4.08 3.53 1 52 SER 0.68 1.00 1 54 GLU 1.06 2.20 1 55 GLU -6.80 -2.42 1 56 ASP -3.80 -1.78 1 57 PHE 4.28 5.08 1 58 GLU 3.95 3.79 1 59 SER 4.04 2.93 1 60 LEU 2.90 2.19 1 61 ALA 5.05 2.90 1 62 SER 2.58 2.56 1 63 GLN -0.27 1.75 1 64 PHE -1.72 -0.22 1 65 SER -3.61 -1.43 1 66 ASP -0.55 1.91 1 67 SER -1.19 -1.83 1 69 SER 2.14 2.15 1 70 ALA 3.26 4.06 1 71 LYS 3.11 1.63 1 72 ALA -1.02 -1.70 1 73 ARG 5.76 1.79 1 75 ASP 0.84 1.83 1 76 LEU -2.12 -0.53 1 78 ALA -2.98 -1.96 1 79 PHE -3.18 -1.67 1 80 SER -4.34 -1.58 1 81 ARG 3.59 2.55 1 83 GLN -0.18 2.26 1 84 MET -3.38 -3.08 1 85 GLN 0.58 1.33 1 86 LYS 9.56 7.06 1 88 PHE 2.08 2.99 1 89 GLU 2.92 3.70 1 90 ASP 4.62 3.17 1 91 ALA 1.01 2.02 1 92 SER 5.56 5.25 1 93 PHE 4.17 3.58 1 94 ALA -1.07 -0.36 1 95 LEU -1.10 -0.45 1 96 ARG -0.86 -0.89 1 97 THR 7.01 4.73 1 99 GLU -3.38 -0.95 1 100 MET -7.10 -2.41 1 101 SER -0.68 0.83 1 104 VAL -2.78 -0.54 1 105 PHE 0.38 0.44 1 106 THR -3.67 -1.55 1 107 ASP 2.85 2.25 1 108 SER 2.64 2.51 1 110 ILE -1.65 -1.13 1 111 HIS -4.69 -1.14 1 112 ILE -1.55 1.38 1 113 ILE -3.35 -0.29 1 114 LEU -5.21 -2.09 1 115 ARG 1.51 0.43 1 116 THR 0.59 0.32 1 117 GLU -1.95 1.69 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11588_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 5.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.39 _LACS_plot.Line_2_terminator_val_x_2 9.55 _LACS_plot.Line_2_terminator_val_y_2 -2.75 _LACS_plot.Y_axis_chem_shift_offset -0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 HIS -8.50 7.82 0 10 ARG -4.33 3.38 1 12 SER -4.28 2.26 1 14 LEU -2.23 3.06 1 15 LEU -5.47 3.13 1 16 VAL -0.70 0.45 1 17 LYS -2.92 3.59 1 18 HIS -5.01 4.78 1 19 SER 3.11 -0.56 1 20 GLN -0.50 -0.01 1 21 SER 3.58 -0.15 1 22 ARG 4.33 -1.37 1 23 ARG -3.01 1.93 1 25 SER -2.25 1.96 1 26 SER -6.72 5.36 1 27 TRP 3.11 -2.49 1 28 ARG 1.83 -0.87 1 29 GLN -2.90 2.98 1 30 GLU 3.13 -0.12 1 31 LYS -2.06 0.97 1 32 ILE 1.16 -1.37 1 33 THR -1.22 0.18 1 34 ARG -0.38 -0.03 1 35 THR -2.81 1.90 1 36 LYS 5.35 -1.06 1 37 GLU 5.25 -1.21 1 38 GLU 2.08 0.30 1 39 ALA 2.81 -0.29 1 40 LEU 3.33 -0.92 1 41 GLU 3.32 -0.54 1 42 LEU 3.22 -0.70 1 43 ILE 4.83 -3.40 1 44 ASN 4.12 -1.24 1 46 TYR 3.69 -2.81 1 47 ILE 6.54 -0.51 1 48 GLN 4.53 -1.27 1 49 LYS 2.78 0.49 1 50 ILE 2.68 0.12 1 51 LYS 4.08 -0.55 1 52 SER 0.68 0.32 1 54 GLU 1.06 1.14 1 55 GLU -6.80 4.38 1 56 ASP -3.80 2.02 1 57 PHE 4.28 0.80 1 58 GLU 3.95 -0.16 1 59 SER 4.04 -1.11 1 60 LEU 2.90 -0.71 1 61 ALA 5.05 -2.15 1 62 SER 2.58 -0.02 1 63 GLN -0.27 2.02 1 64 PHE -1.72 1.50 1 65 SER -3.61 2.18 1 66 ASP -0.55 2.46 1 67 SER -1.19 -0.64 1 69 SER 2.14 0.01 1 70 ALA 3.26 0.80 1 71 LYS 3.11 -1.48 1 72 ALA -1.02 -0.68 1 73 ARG 5.76 -3.97 1 75 ASP 0.84 0.99 1 76 LEU -2.12 1.59 1 78 ALA -2.98 1.02 1 79 PHE -3.18 1.51 1 80 SER -4.34 2.76 1 81 ARG 3.59 -1.04 1 83 GLN -0.18 2.44 1 84 MET -3.38 0.30 1 85 GLN 0.58 0.75 1 86 LYS 9.56 -2.50 1 88 PHE 2.08 0.91 1 89 GLU 2.92 0.78 1 90 ASP 4.62 -1.45 1 91 ALA 1.01 1.01 1 92 SER 5.56 -0.31 1 93 PHE 4.17 -0.59 1 94 ALA -1.07 0.71 1 95 LEU -1.10 0.65 1 96 ARG -0.86 -0.03 1 97 THR 7.01 -2.28 1 99 GLU -3.38 2.43 1 100 MET -7.10 4.69 1 101 SER -0.68 1.51 1 104 VAL -2.78 2.24 1 105 PHE 0.38 0.06 1 106 THR -3.67 2.12 1 107 ASP 2.85 -0.60 1 108 SER 2.64 -0.13 1 110 ILE -1.65 0.52 1 111 HIS -4.69 3.55 1 112 ILE -1.55 2.93 1 113 ILE -3.35 3.06 1 114 LEU -5.21 3.12 1 115 ARG 1.51 -1.08 1 116 THR 0.59 -0.27 1 117 GLU -1.95 3.64 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11588_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _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 9.55 _LACS_plot.Line_2_terminator_val_y_2 -0.93 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 115 ARG 1.51 0.80 0 111 HIS -4.69 1.39 0 12 SER -4.28 1.43 0 13 HIS -8.50 1.59 0 86 LYS 9.56 -0.39 0 10 ARG -4.33 0.52 1 14 LEU -2.23 -0.39 1 15 LEU -5.47 0.47 1 16 VAL -0.70 0.51 1 17 LYS -2.92 -0.16 1 18 HIS -5.01 -0.04 1 19 SER 3.11 -0.36 1 20 GLN -0.50 0.35 1 21 SER 3.58 -0.63 1 22 ARG 4.33 -0.24 1 23 ARG -3.01 0.15 1 25 SER -2.25 -0.03 1 26 SER -6.72 0.55 1 27 TRP 3.11 -0.30 1 28 ARG 1.83 -0.79 1 29 GLN -2.90 -0.09 1 30 GLU 3.13 -0.31 1 31 LYS -2.06 0.35 1 32 ILE 1.16 -0.32 1 33 THR -1.22 0.00 1 34 ARG -0.38 0.26 1 35 THR -2.81 0.25 1 36 LYS 5.35 -0.88 1 37 GLU 5.25 -0.45 1 38 GLU 2.08 -0.39 1 39 ALA 2.81 -0.32 1 40 LEU 3.33 -0.44 1 41 GLU 3.32 -0.31 1 42 LEU 3.22 -0.69 1 43 ILE 4.83 -0.50 1 44 ASN 4.12 -0.21 1 46 TYR 3.69 -0.14 1 47 ILE 6.54 -0.65 1 48 GLN 4.53 -0.30 1 49 LYS 2.78 -0.21 1 50 ILE 2.68 0.14 1 51 LYS 4.08 -0.21 1 52 SER 0.68 -0.04 1 54 GLU 1.06 -0.31 1 55 GLU -6.80 0.31 1 56 ASP -3.80 0.26 1 57 PHE 4.28 -1.00 1 58 GLU 3.95 -0.49 1 59 SER 4.04 -0.31 1 60 LEU 2.90 -0.34 1 61 ALA 5.05 -0.68 1 62 SER 2.58 0.03 1 63 GLN -0.27 -0.14 1 64 PHE -1.72 0.10 1 65 SER -3.61 0.31 1 66 ASP -0.55 -0.05 1 67 SER -1.19 0.49 1 69 SER 2.14 -0.08 1 70 ALA 3.26 -0.48 1 71 LYS 3.11 -0.34 1 72 ALA -1.02 0.40 1 73 ARG 5.76 -0.65 1 75 ASP 0.84 0.17 1 76 LEU -2.12 0.16 1 78 ALA -2.98 0.93 1 79 PHE -3.18 0.48 1 80 SER -4.34 0.90 1 81 ARG 3.59 -0.38 1 83 GLN -0.18 0.10 1 84 MET -3.38 0.13 1 85 GLN 0.58 -0.12 1 88 PHE 2.08 -0.95 1 89 GLU 2.92 -0.26 1 90 ASP 4.62 -0.19 1 91 ALA 1.01 -0.15 1 92 SER 5.56 -0.39 1 93 PHE 4.17 -0.76 1 94 ALA -1.07 0.11 1 95 LEU -1.10 -0.09 1 96 ARG -0.86 0.03 1 97 THR 7.01 -1.14 1 99 GLU -3.38 -0.02 1 100 MET -7.10 1.18 1 101 SER -0.68 -0.05 1 104 VAL -2.78 0.21 1 105 PHE 0.38 0.42 1 106 THR -3.67 0.67 1 107 ASP 2.85 0.02 1 108 SER 2.64 0.20 1 110 ILE -1.65 0.85 1 112 ILE -1.55 0.04 1 113 ILE -3.35 0.57 1 114 LEU -5.21 0.54 1 116 THR 0.59 0.04 1 117 GLU -1.95 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11588_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.50 _LACS_plot.Line_1_terminator_val_y_1 -2.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.24 _LACS_plot.Line_2_terminator_val_x_2 9.55 _LACS_plot.Line_2_terminator_val_y_2 2.75 _LACS_plot.Y_axis_chem_shift_offset -0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 GLU -1.95 4.76 0 86 LYS 9.56 -0.73 0 10 ARG -4.33 -0.44 1 12 SER -4.28 -1.44 1 13 HIS -8.50 -2.27 1 14 LEU -2.23 -4.19 1 15 LEU -5.47 -3.57 1 16 VAL -0.70 -0.02 1 17 LYS -2.92 -2.51 1 18 HIS -5.01 2.47 1 19 SER 3.11 0.99 1 20 GLN -0.50 0.32 1 21 SER 3.58 -1.57 1 22 ARG 4.33 0.32 1 23 ARG -3.01 -0.32 1 25 SER -2.25 -2.31 1 26 SER -6.72 -0.01 1 27 TRP 3.11 0.21 1 28 ARG 1.83 0.16 1 29 GLN -2.90 -2.80 1 30 GLU 3.13 0.06 1 31 LYS -2.06 -2.16 1 32 ILE 1.16 -0.80 1 33 THR -1.22 0.60 1 34 ARG -0.38 -1.72 1 35 THR -2.81 1.79 1 36 LYS 5.35 1.21 1 37 GLU 5.25 3.19 1 38 GLU 2.08 3.31 1 39 ALA 2.81 0.22 1 40 LEU 3.33 0.25 1 41 GLU 3.32 3.74 1 42 LEU 3.22 1.06 1 43 ILE 4.83 1.06 1 44 ASN 4.12 3.91 1 46 TYR 3.69 2.27 1 47 ILE 6.54 1.52 1 48 GLN 4.53 3.27 1 49 LYS 2.78 1.73 1 50 ILE 2.68 4.84 1 51 LYS 4.08 2.41 1 52 SER 0.68 1.09 1 54 GLU 1.06 0.07 1 55 GLU -6.80 -2.34 1 56 ASP -3.80 -0.36 1 57 PHE 4.28 0.89 1 58 GLU 3.95 2.52 1 59 SER 4.04 3.43 1 60 LEU 2.90 1.34 1 61 ALA 5.05 1.01 1 62 SER 2.58 0.15 1 63 GLN -0.27 1.56 1 64 PHE -1.72 -0.86 1 65 SER -3.61 1.21 1 66 ASP -0.55 -0.51 1 67 SER -1.19 1.82 1 69 SER 2.14 2.23 1 70 ALA 3.26 2.27 1 71 LYS 3.11 0.06 1 72 ALA -1.02 -0.39 1 73 ARG 5.76 -1.38 1 75 ASP 0.84 -0.36 1 76 LEU -2.12 1.34 1 78 ALA -2.98 1.17 1 79 PHE -3.18 -2.98 1 80 SER -4.34 0.51 1 81 ARG 3.59 1.57 1 83 GLN -0.18 0.20 1 84 MET -3.38 -0.65 1 85 GLN 0.58 2.68 1 88 PHE 2.08 2.51 1 89 GLU 2.92 0.95 1 90 ASP 4.62 3.01 1 91 ALA 1.01 1.81 1 92 SER 5.56 0.29 1 93 PHE 4.17 0.04 1 94 ALA -1.07 0.15 1 95 LEU -1.10 0.32 1 96 ARG -0.86 0.72 1 97 THR 7.01 1.10 1 99 GLU -3.38 -3.53 1 100 MET -7.10 0.09 1 101 SER -0.68 0.17 1 104 VAL -2.78 -1.30 1 105 PHE 0.38 0.17 1 106 THR -3.67 0.76 1 107 ASP 2.85 2.18 1 108 SER 2.64 1.27 1 110 ILE -1.65 -2.48 1 111 HIS -4.69 2.94 1 112 ILE -1.55 -0.89 1 113 ILE -3.35 -3.69 1 114 LEU -5.21 -2.07 1 115 ARG 1.51 -0.07 1 116 THR 0.59 0.75 1 stop_ save_