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 bmr27034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.61 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 4.89 _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 80 MET -5.61 -1.20 0 78 LYS 6.13 1.32 0 10 LEU 0.30 0.09 1 11 GLU -1.15 -0.30 1 14 LYS -0.15 -0.23 1 15 ASP 0.01 -0.02 1 16 LEU -0.47 -0.25 1 19 GLN 0.07 -0.04 1 20 LEU 0.22 0.19 1 21 GLU -0.17 0.16 1 22 SER 0.23 0.12 1 23 ASN 0.39 0.09 1 24 GLN 0.91 0.66 1 26 ALA 0.11 0.07 1 27 ARG 0.52 0.24 1 29 SER 0.10 0.29 1 31 SER -0.09 0.01 1 32 ALA 0.42 0.37 1 33 ASN 0.08 -0.01 1 34 SER 0.07 0.07 1 35 VAL 0.87 0.42 1 38 SER 0.31 0.27 1 39 THR 0.39 0.11 1 40 THR 0.21 0.05 1 41 ARG -0.04 -0.06 1 43 LYS -0.10 -0.07 1 44 SER -0.41 -0.25 1 46 TRP -0.80 -0.49 1 51 THR 5.06 3.82 1 52 LEU 3.79 2.95 1 53 PHE 2.85 0.20 1 54 ALA 3.53 2.34 1 55 ALA 1.57 1.88 1 56 ILE 1.56 1.61 1 57 SER 4.47 3.69 1 58 HIS 1.19 2.00 1 59 LYS -2.36 -0.72 1 60 VAL -3.19 -2.03 1 61 ALA -0.56 -0.41 1 62 GLU 4.12 3.72 1 63 ASN 4.33 3.16 1 64 ASP 3.51 2.85 1 65 MET 3.72 0.92 1 66 LEU 4.08 3.17 1 67 LEU 3.90 3.01 1 68 ILE 4.67 4.07 1 69 ASN 3.65 3.24 1 70 ALA 4.08 2.84 1 71 ASP 5.09 3.34 1 72 TYR 3.73 2.69 1 73 GLN 4.56 2.82 1 74 GLN 4.37 3.80 1 75 LEU 4.63 3.24 1 76 ARG 4.92 3.27 1 77 ASP 0.55 0.18 1 79 LYS -0.68 -0.42 1 81 THR -2.26 -0.96 1 82 ARG 5.70 4.43 1 83 ALA 3.54 2.70 1 84 GLU 2.30 1.97 1 85 PHE 4.77 4.88 1 86 VAL 6.23 4.78 1 87 ARG 5.10 4.14 1 88 LYS 4.52 3.40 1 89 LEU 3.04 2.69 1 90 ARG 4.39 4.01 1 91 VAL 4.91 3.79 1 92 ILE 3.40 3.62 1 93 VAL 1.68 1.51 1 95 ASP 3.38 3.63 1 96 ASP 4.46 3.55 1 97 LEU 3.42 2.06 1 98 LEU 4.10 3.47 1 99 ARG 4.76 3.87 1 100 SER 4.22 3.09 1 101 THR 6.24 4.93 1 102 ILE 5.26 4.26 1 103 THR 5.41 4.45 1 104 THR 4.78 3.90 1 105 LEU 2.23 1.97 1 106 GLN 1.83 1.44 1 107 ASN -0.02 0.07 1 108 GLN 0.55 0.39 1 110 LYS 0.31 0.08 1 111 SER -0.05 0.03 1 112 LYS 0.45 0.23 1 113 GLU -0.57 -0.32 1 114 ILE -0.00 -0.22 1 117 SER -0.04 0.10 1 118 ILE 0.51 0.20 1 119 ARG 0.09 -0.01 1 120 ASP 0.49 0.43 1 121 HIS -0.16 1.19 1 122 GLU -0.61 -0.10 1 123 GLU 0.12 0.33 1 125 ALA -0.16 0.04 1 128 LEU 0.64 1.57 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.61 _LACS_plot.Line_1_terminator_val_y_1 3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 -1.35 _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 80 MET -5.61 4.41 0 78 LYS 6.13 -4.81 0 10 LEU 0.30 -0.21 1 11 GLU -1.15 0.85 1 14 LYS -0.15 -0.08 1 15 ASP 0.01 -0.03 1 16 LEU -0.47 0.22 1 19 GLN 0.07 -0.11 1 20 LEU 0.22 -0.03 1 21 GLU -0.17 0.33 1 22 SER 0.23 -0.11 1 23 ASN 0.39 -0.30 1 24 GLN 0.91 -0.25 1 26 ALA 0.11 -0.04 1 27 ARG 0.52 -0.28 1 29 SER 0.10 0.19 1 31 SER -0.09 0.10 1 32 ALA 0.42 -0.05 1 33 ASN 0.08 -0.09 1 34 SER 0.07 0.00 1 35 VAL 0.87 -0.45 1 38 SER 0.31 -0.04 1 39 THR 0.39 -0.28 1 40 THR 0.21 -0.16 1 41 ARG -0.04 -0.02 1 43 LYS -0.10 0.03 1 44 SER -0.41 0.16 1 46 TRP -0.80 0.31 1 51 THR 5.06 -1.24 1 52 LEU 3.79 -0.84 1 53 PHE 2.85 -2.65 1 54 ALA 3.53 -1.19 1 55 ALA 1.57 0.31 1 56 ILE 1.56 0.05 1 57 SER 4.47 -0.78 1 58 HIS 1.19 0.81 1 59 LYS -2.36 1.64 1 60 VAL -3.19 1.16 1 61 ALA -0.56 0.15 1 62 GLU 4.12 -0.40 1 63 ASN 4.33 -1.17 1 64 ASP 3.51 -0.66 1 65 MET 3.72 -2.80 1 66 LEU 4.08 -0.91 1 67 LEU 3.90 -0.89 1 68 ILE 4.67 -0.60 1 69 ASN 3.65 -0.41 1 70 ALA 4.08 -1.24 1 71 ASP 5.09 -1.75 1 72 TYR 3.73 -1.04 1 73 GLN 4.56 -1.74 1 74 GLN 4.37 -0.57 1 75 LEU 4.63 -1.39 1 76 ARG 4.92 -1.65 1 77 ASP 0.55 -0.37 1 79 LYS -0.68 0.26 1 81 THR -2.26 1.30 1 82 ARG 5.70 -1.27 1 83 ALA 3.54 -0.84 1 84 GLU 2.30 -0.33 1 85 PHE 4.77 0.11 1 86 VAL 6.23 -1.45 1 87 ARG 5.10 -0.96 1 88 LYS 4.52 -1.12 1 89 LEU 3.04 -0.35 1 90 ARG 4.39 -0.38 1 91 VAL 4.91 -1.12 1 92 ILE 3.40 0.22 1 93 VAL 1.68 -0.17 1 95 ASP 3.38 0.25 1 96 ASP 4.46 -0.91 1 97 LEU 3.42 -1.36 1 98 LEU 4.10 -0.63 1 99 ARG 4.76 -0.89 1 100 SER 4.22 -1.13 1 101 THR 6.24 -1.31 1 102 ILE 5.26 -1.00 1 103 THR 5.41 -0.96 1 104 THR 4.78 -0.88 1 105 LEU 2.23 -0.26 1 106 GLN 1.83 -0.39 1 107 ASN -0.02 0.09 1 108 GLN 0.55 -0.16 1 110 LYS 0.31 -0.23 1 111 SER -0.05 0.08 1 112 LYS 0.45 -0.22 1 113 GLU -0.57 0.25 1 114 ILE -0.00 -0.22 1 117 SER -0.04 0.14 1 118 ILE 0.51 -0.31 1 119 ARG 0.09 -0.10 1 120 ASP 0.49 -0.06 1 121 HIS -0.16 1.35 1 122 GLU -0.61 0.51 1 123 GLU 0.12 0.21 1 125 ALA -0.16 0.20 1 128 LEU 0.64 0.93 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.61 _LACS_plot.Line_1_terminator_val_y_1 0.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.02 _LACS_plot.Line_2_terminator_val_x_2 6.24 _LACS_plot.Line_2_terminator_val_y_2 -0.51 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 TYR 3.73 -0.97 0 10 LEU 0.30 -0.02 1 11 GLU -1.15 -0.11 1 14 LYS -0.15 -0.08 1 15 ASP 0.01 -0.15 1 16 LEU -0.47 -0.16 1 19 GLN 0.07 -0.11 1 20 LEU 0.22 -0.07 1 21 GLU -0.17 -0.15 1 22 SER 0.23 -0.14 1 23 ASN 0.39 -0.11 1 24 GLN 0.91 -0.14 1 26 ALA 0.11 -0.09 1 27 ARG 0.52 -0.10 1 29 SER 0.10 -0.08 1 31 SER -0.09 -0.09 1 32 ALA 0.42 -0.09 1 33 ASN 0.08 -0.12 1 34 SER 0.07 -0.06 1 35 VAL 0.87 -0.05 1 39 THR 0.39 -0.02 1 40 THR 0.21 -0.10 1 41 ARG -0.04 -0.11 1 43 LYS -0.10 -0.13 1 46 TRP -0.80 -0.08 1 51 THR 5.06 -0.44 1 52 LEU 3.79 -0.47 1 53 PHE 2.85 -0.39 1 54 ALA 3.53 -0.25 1 55 ALA 1.57 -0.04 1 56 ILE 1.56 0.00 1 57 SER 4.47 -0.39 1 58 HIS 1.19 -0.11 1 59 LYS -2.36 0.08 1 60 VAL -3.19 0.18 1 61 ALA -0.56 -0.10 1 62 GLU 4.12 -0.50 1 63 ASN 4.33 -0.43 1 64 ASP 3.51 -0.14 1 65 MET 3.72 -0.23 1 66 LEU 4.08 -0.34 1 67 LEU 3.90 -0.34 1 68 ILE 4.67 -0.49 1 69 ASN 3.65 -0.44 1 70 ALA 4.08 -0.15 1 71 ASP 5.09 -0.23 1 73 GLN 4.56 -0.76 1 74 GLN 4.37 -0.37 1 75 LEU 4.63 -0.20 1 76 ARG 4.92 -0.72 1 77 ASP 0.55 -0.04 1 78 LYS 6.13 -0.29 1 79 LYS -0.68 -0.03 1 80 MET -5.61 0.10 1 81 THR -2.26 0.04 1 82 ARG 5.70 -0.41 1 83 ALA 3.54 -0.29 1 84 GLU 2.30 -0.29 1 85 PHE 4.77 -0.54 1 86 VAL 6.23 -0.92 1 87 ARG 5.10 -0.56 1 88 LYS 4.52 -0.62 1 89 LEU 3.04 -0.66 1 90 ARG 4.39 -0.79 1 91 VAL 4.91 -0.56 1 92 ILE 3.40 -0.51 1 93 VAL 1.68 -0.22 1 95 ASP 3.38 -0.39 1 96 ASP 4.46 -0.38 1 97 LEU 3.42 -0.15 1 98 LEU 4.10 -0.54 1 99 ARG 4.76 -0.49 1 100 SER 4.22 -0.33 1 101 THR 6.24 -0.48 1 102 ILE 5.26 -0.64 1 103 THR 5.41 -0.44 1 104 THR 4.78 -0.34 1 105 LEU 2.23 -0.30 1 106 GLN 1.83 -0.26 1 107 ASN -0.02 -0.09 1 108 GLN 0.55 -0.14 1 110 LYS 0.31 -0.10 1 111 SER -0.05 -0.14 1 112 LYS 0.45 -0.10 1 113 GLU -0.57 -0.17 1 114 ILE -0.00 -0.09 1 117 SER -0.04 -0.11 1 118 ILE 0.51 -0.08 1 119 ARG 0.09 -0.10 1 120 ASP 0.49 -0.21 1 121 HIS -0.16 -0.22 1 122 GLU -0.61 -0.17 1 123 GLU 0.12 -0.18 1 125 ALA -0.16 -0.09 1 128 LEU 0.64 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27034_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.61 _LACS_plot.Line_1_terminator_val_y_1 -2.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.87 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 2.69 _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 78 LYS 6.13 -0.22 0 10 LEU 0.30 -0.69 1 11 GLU -1.15 -0.23 1 14 LYS -0.15 -0.44 1 15 ASP 0.01 -0.81 1 16 LEU -0.47 -1.03 1 19 GLN 0.07 -0.12 1 20 LEU 0.22 -0.26 1 21 GLU -0.17 -0.04 1 22 SER 0.23 -0.11 1 23 ASN 0.39 0.17 1 24 GLN 0.91 0.56 1 26 ALA 0.11 0.16 1 27 ARG 0.52 0.68 1 29 SER 0.10 0.63 1 31 SER -0.09 -0.05 1 32 ALA 0.42 -0.28 1 33 ASN 0.08 0.00 1 34 SER 0.07 0.03 1 35 VAL 0.87 0.46 1 39 THR 0.39 0.01 1 40 THR 0.21 -0.58 1 41 ARG -0.04 -0.50 1 43 LYS -0.10 -0.11 1 44 SER -0.41 -0.37 1 51 THR 5.06 1.31 1 53 PHE 2.85 2.06 1 54 ALA 3.53 1.92 1 55 ALA 1.57 2.12 1 56 ILE 1.56 1.34 1 58 HIS 1.19 1.64 1 59 LYS -2.36 -1.15 1 60 VAL -3.19 -1.61 1 61 ALA -0.56 1.08 1 62 GLU 4.12 2.40 1 63 ASN 4.33 2.28 1 64 ASP 3.51 1.78 1 65 MET 3.72 2.69 1 66 LEU 4.08 2.91 1 67 LEU 3.90 1.73 1 68 ILE 4.67 1.85 1 69 ASN 3.65 2.86 1 70 ALA 4.08 3.15 1 71 ASP 5.09 1.60 1 72 TYR 3.73 1.47 1 73 GLN 4.56 2.03 1 74 GLN 4.37 2.59 1 76 ARG 4.92 1.44 1 77 ASP 0.55 -1.49 1 79 LYS -0.68 -1.02 1 80 MET -5.61 -1.86 1 81 THR -2.26 0.79 1 82 ARG 5.70 1.54 1 83 ALA 3.54 3.02 1 84 GLU 2.30 1.31 1 85 PHE 4.77 0.82 1 86 VAL 6.23 0.89 1 87 ARG 5.10 2.78 1 88 LYS 4.52 2.19 1 89 LEU 3.04 1.03 1 90 ARG 4.39 2.89 1 91 VAL 4.91 0.07 1 92 ILE 3.40 1.16 1 93 VAL 1.68 0.18 1 95 ASP 3.38 1.87 1 96 ASP 4.46 2.36 1 97 LEU 3.42 2.66 1 98 LEU 4.10 0.15 1 99 ARG 4.76 3.00 1 100 SER 4.22 2.14 1 102 ILE 5.26 0.95 1 103 THR 5.41 1.60 1 104 THR 4.78 1.62 1 105 LEU 2.23 1.16 1 106 GLN 1.83 0.27 1 107 ASN -0.02 -0.42 1 108 GLN 0.55 -0.57 1 110 LYS 0.31 0.18 1 111 SER -0.05 -0.09 1 112 LYS 0.45 -0.33 1 113 GLU -0.57 -0.56 1 114 ILE -0.00 -0.44 1 117 SER -0.04 -0.06 1 118 ILE 0.51 -0.22 1 119 ARG 0.09 -0.36 1 120 ASP 0.49 -0.33 1 121 HIS -0.16 0.88 1 122 GLU -0.61 -0.13 1 123 GLU 0.12 0.51 1 125 ALA -0.16 0.32 1 128 LEU 0.64 0.53 1 stop_ save_