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 bmr6528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 -2.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.75 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 5.18 _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 67 GLU -4.68 -1.60 0 10 ALA 3.80 2.60 1 11 GLU 1.94 1.79 1 12 ALA 3.24 2.75 1 13 GLU -0.00 2.30 1 14 LYS 3.70 2.51 1 15 LYS 4.20 2.90 1 16 VAL 6.45 5.21 1 17 GLU 4.10 3.00 1 18 GLU 2.70 2.60 1 19 ALA 3.83 2.46 1 20 LYS 5.10 4.00 1 21 LYS 4.10 2.80 1 22 LYS 4.30 3.00 1 23 ALA 2.03 1.21 1 24 GLU 3.90 2.50 1 25 ASP 4.50 2.80 1 26 GLN 3.28 1.98 1 27 LYS 4.02 2.90 1 28 GLU 3.10 1.90 1 29 GLU 3.70 2.70 1 30 ASP 4.10 3.40 1 31 ARG 4.10 2.80 1 32 ARG 2.87 2.53 1 33 ASN 3.50 3.80 1 36 THR 0.14 -0.50 1 37 ASN 0.65 0.28 1 38 THR 0.14 -0.50 1 39 TYR -3.00 -2.02 1 40 LYS -1.11 0.10 1 41 THR -1.84 -0.14 1 42 LEU 2.92 2.18 1 43 GLU 6.58 4.90 1 44 LEU 5.18 2.81 1 45 GLU 4.86 3.34 1 46 ILE 5.27 5.00 1 47 ALA 4.31 2.50 1 48 GLU 4.75 3.60 1 49 SER 4.56 3.51 1 50 ASP 3.15 3.40 1 51 VAL 6.80 5.40 1 52 GLU 3.92 2.87 1 53 VAL 6.48 5.55 1 54 LYS 5.10 2.70 1 55 LYS 4.71 4.52 1 56 ALA 4.34 2.44 1 57 GLU 3.30 3.34 1 58 LEU 4.95 3.43 1 59 GLU 3.90 2.40 1 60 LEU 4.65 3.43 1 61 VAL 5.64 3.99 1 62 LYS 4.87 4.21 1 63 GLU 3.00 2.10 1 64 GLU 2.40 2.40 1 65 ALA -0.12 -0.06 1 66 LYS 0.65 1.40 1 69 ARG -0.10 0.50 1 70 ASN -0.76 -1.13 1 71 GLU 3.61 2.87 1 72 GLU 3.44 2.70 1 73 LYS 3.62 2.49 1 74 VAL 6.63 5.70 1 75 LYS 5.02 4.36 1 76 GLN 4.33 3.15 1 77 ALA 3.81 2.46 1 78 LYS 4.56 4.21 1 79 ALA 4.10 2.44 1 80 GLU 3.40 2.40 1 81 VAL 6.79 5.55 1 82 GLU 4.38 3.18 1 83 SER 4.25 3.20 1 84 LYS 4.00 1.10 1 85 LYS 4.87 4.21 1 86 ALA 4.11 2.46 1 87 GLU 2.80 1.50 1 88 ALA 4.10 3.22 1 89 THR 6.13 4.54 1 90 ARG 4.43 3.93 1 91 LEU 1.98 2.80 1 92 GLU 3.09 2.09 1 93 LYS 4.10 2.90 1 94 ILE 5.76 4.40 1 95 LYS 4.89 3.73 1 96 THR 6.13 4.54 1 97 ASP 4.06 2.62 1 98 ARG 4.20 3.49 1 99 LYS 3.80 2.60 1 100 LYS 3.90 2.90 1 101 ALA 3.39 2.10 1 102 GLU 0.80 2.90 1 103 GLU 2.30 2.40 1 104 GLU 3.10 2.40 1 105 ALA 4.14 2.30 1 106 LYS 2.80 2.20 1 107 ARG 3.60 2.70 1 108 LYS 3.30 2.30 1 109 ALA 2.29 1.20 1 110 ALA 1.88 1.10 1 111 GLU 1.00 0.90 1 112 GLU 1.10 0.50 1 113 ASP 1.27 0.67 1 114 LYS 1.00 0.70 1 115 VAL 1.18 0.22 1 116 LYS 0.20 0.10 1 117 GLU -0.30 -0.10 1 118 LYS -0.20 -0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 2.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -1.61 _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 67 GLU -4.68 3.08 0 10 ALA 3.80 -1.20 1 11 GLU 1.94 -0.15 1 12 ALA 3.24 -0.49 1 13 GLU -0.00 2.30 1 14 LYS 3.70 -1.19 1 15 LYS 4.20 -1.30 1 16 VAL 6.45 -1.24 1 17 GLU 4.10 -1.10 1 18 GLU 2.70 -0.10 1 19 ALA 3.83 -1.37 1 20 LYS 5.10 -1.10 1 21 LYS 4.10 -1.30 1 22 LYS 4.30 -1.30 1 23 ALA 2.03 -0.82 1 24 GLU 3.90 -1.40 1 25 ASP 4.50 -1.70 1 26 GLN 3.28 -1.30 1 27 LYS 4.02 -1.12 1 28 GLU 3.10 -1.20 1 29 GLU 3.70 -1.00 1 30 ASP 4.10 -0.70 1 31 ARG 4.10 -1.30 1 32 ARG 2.87 -0.34 1 33 ASN 3.50 0.30 1 36 THR 0.14 -0.64 1 37 ASN 0.65 -0.37 1 38 THR 0.14 -0.64 1 39 TYR -3.00 0.98 1 40 LYS -1.11 1.21 1 41 THR -1.84 1.70 1 42 LEU 2.92 -0.74 1 43 GLU 6.58 -1.68 1 44 LEU 5.18 -2.37 1 45 GLU 4.86 -1.52 1 46 ILE 5.27 -0.27 1 47 ALA 4.31 -1.81 1 48 GLU 4.75 -1.15 1 49 SER 4.56 -1.05 1 50 ASP 3.15 0.25 1 51 VAL 6.80 -1.40 1 52 GLU 3.92 -1.05 1 53 VAL 6.48 -0.93 1 54 LYS 5.10 -2.40 1 55 LYS 4.71 -0.19 1 56 ALA 4.34 -1.90 1 57 GLU 3.30 0.04 1 58 LEU 4.95 -1.52 1 59 GLU 3.90 -1.50 1 60 LEU 4.65 -1.22 1 61 VAL 5.64 -1.65 1 62 LYS 4.87 -0.66 1 63 GLU 3.00 -0.90 1 64 GLU 2.40 0.00 1 65 ALA -0.12 0.06 1 66 LYS 0.65 0.75 1 69 ARG -0.10 0.60 1 70 ASN -0.76 -0.37 1 71 GLU 3.61 -0.74 1 72 GLU 3.44 -0.74 1 73 LYS 3.62 -1.13 1 74 VAL 6.63 -0.93 1 75 LYS 5.02 -0.66 1 76 GLN 4.33 -1.18 1 77 ALA 3.81 -1.35 1 78 LYS 4.56 -0.35 1 79 ALA 4.10 -1.66 1 80 GLU 3.40 -1.00 1 81 VAL 6.79 -1.24 1 82 GLU 4.38 -1.20 1 83 SER 4.25 -1.05 1 84 LYS 4.00 -2.90 1 85 LYS 4.87 -0.66 1 86 ALA 4.11 -1.65 1 87 GLU 2.80 -1.30 1 88 ALA 4.10 -0.88 1 89 THR 6.13 -1.59 1 90 ARG 4.43 -0.50 1 91 LEU 1.98 0.82 1 92 GLU 3.09 -1.00 1 93 LYS 4.10 -1.20 1 94 ILE 5.76 -1.36 1 95 LYS 4.89 -1.16 1 96 THR 6.13 -1.59 1 97 ASP 4.06 -1.44 1 98 ARG 4.20 -0.71 1 99 LYS 3.80 -1.20 1 100 LYS 3.90 -1.00 1 101 ALA 3.39 -1.29 1 102 GLU 0.80 2.10 1 103 GLU 2.30 0.10 1 104 GLU 3.10 -0.70 1 105 ALA 4.14 -1.84 1 106 LYS 2.80 -0.60 1 107 ARG 3.60 -0.90 1 108 LYS 3.30 -1.00 1 109 ALA 2.29 -1.09 1 110 ALA 1.88 -0.78 1 111 GLU 1.00 -0.10 1 112 GLU 1.10 -0.60 1 113 ASP 1.27 -0.60 1 114 LYS 1.00 -0.30 1 115 VAL 1.18 -0.96 1 116 LYS 0.20 -0.10 1 117 GLU -0.30 0.20 1 118 LYS -0.20 -0.10 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 0.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -0.42 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 67 GLU -4.68 0.04 0 10 ALA 3.80 -0.12 1 11 GLU 1.94 -0.20 1 12 ALA 3.24 -0.12 1 13 GLU -0.00 -0.23 1 14 LYS 3.70 -0.20 1 15 LYS 4.20 -0.16 1 16 VAL 6.45 -0.58 1 17 GLU 4.10 -0.36 1 18 GLU 2.70 -0.27 1 19 ALA 3.83 -0.03 1 20 LYS 5.10 -0.40 1 21 LYS 4.10 -0.20 1 22 LYS 4.30 -0.12 1 23 ALA 2.03 -0.12 1 24 GLU 3.90 -0.34 1 25 ASP 4.50 -0.22 1 26 GLN 3.28 -0.40 1 27 LYS 4.02 -0.17 1 28 GLU 3.10 -0.23 1 29 GLU 3.70 -0.37 1 30 ASP 4.10 -0.12 1 31 ARG 4.10 -0.33 1 32 ARG 2.87 -0.33 1 33 ASN 3.50 -0.69 1 36 THR 0.14 0.10 1 37 ASN 0.65 -0.10 1 38 THR 0.14 -0.06 1 39 TYR -3.00 0.19 1 40 LYS -1.11 0.08 1 41 THR -1.84 -0.17 1 42 LEU 2.92 -0.06 1 43 GLU 6.58 -0.49 1 44 LEU 5.18 -0.19 1 45 GLU 4.86 -0.32 1 46 ILE 5.27 -0.53 1 47 ALA 4.31 -0.04 1 48 GLU 4.75 -0.40 1 49 SER 4.56 -0.14 1 50 ASP 3.15 0.04 1 51 VAL 6.80 -0.72 1 52 GLU 3.92 -0.31 1 53 VAL 6.48 -0.67 1 54 LYS 5.10 -0.20 1 55 LYS 4.71 -0.42 1 56 ALA 4.34 -0.05 1 57 GLU 3.30 -0.49 1 58 LEU 4.95 -0.25 1 59 GLU 3.90 -0.30 1 60 LEU 4.65 -0.28 1 61 VAL 5.64 -0.26 1 62 LYS 4.87 -0.48 1 63 GLU 3.00 -0.30 1 64 GLU 2.40 -0.49 1 65 ALA -0.12 -0.01 1 66 LYS 0.65 -0.29 1 69 ARG -0.10 -0.26 1 70 ASN -0.76 0.13 1 71 GLU 3.61 -0.38 1 72 GLU 3.44 -0.22 1 73 LYS 3.62 -0.22 1 74 VAL 6.63 -0.72 1 75 LYS 5.02 -0.43 1 76 GLN 4.33 -0.21 1 77 ALA 3.81 -0.04 1 78 LYS 4.56 -0.36 1 79 ALA 4.10 -0.10 1 80 GLU 3.40 -0.04 1 81 VAL 6.79 -0.68 1 82 GLU 4.38 -0.36 1 83 SER 4.25 -0.15 1 84 LYS 4.00 -0.15 1 85 LYS 4.87 -0.31 1 86 ALA 4.11 -0.12 1 87 GLU 2.80 0.16 1 88 ALA 4.10 -0.17 1 89 THR 6.13 -0.44 1 90 ARG 4.43 -0.33 1 91 LEU 1.98 -0.31 1 92 GLU 3.09 -0.35 1 93 LYS 4.10 -0.16 1 94 ILE 5.76 -0.38 1 95 LYS 4.89 -0.53 1 96 THR 6.13 -0.40 1 97 ASP 4.06 -0.23 1 98 ARG 4.20 -0.19 1 99 LYS 3.80 -0.12 1 100 LYS 3.90 -0.16 1 101 ALA 3.39 -0.15 1 102 GLU 0.80 -0.18 1 103 GLU 2.30 -0.26 1 104 GLU 3.10 -0.26 1 105 ALA 4.14 -0.12 1 106 LYS 2.80 -0.31 1 107 ARG 3.60 -0.22 1 108 LYS 3.30 -0.35 1 109 ALA 2.29 -0.10 1 110 ALA 1.88 -0.04 1 111 GLU 1.00 -0.15 1 112 GLU 1.10 -0.15 1 113 ASP 1.27 -0.09 1 114 LYS 1.00 -0.04 1 115 VAL 1.18 -0.08 1 116 LYS 0.20 -0.04 1 117 GLU -0.30 -0.11 1 118 LYS -0.20 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6528_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.68 _LACS_plot.Line_1_terminator_val_y_1 -1.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.38 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.11 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 3.07 _LACS_plot.Y_axis_chem_shift_offset -0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 GLU 2.70 -2.60 0 67 GLU -4.68 -0.90 0 10 ALA 3.80 0.60 1 11 GLU 1.94 1.60 1 12 ALA 3.24 0.92 1 13 GLU -0.00 2.20 1 14 LYS 3.70 4.12 1 15 LYS 4.20 2.64 1 16 VAL 6.45 0.85 1 17 GLU 4.10 0.20 1 19 ALA 3.83 3.20 1 20 LYS 5.10 2.20 1 21 LYS 4.10 1.50 1 22 LYS 4.30 0.90 1 23 ALA 2.03 1.30 1 24 GLU 3.90 2.80 1 25 ASP 4.50 2.70 1 26 GLN 3.28 0.95 1 27 LYS 4.02 1.90 1 28 GLU 3.10 2.30 1 29 GLU 3.70 2.10 1 30 ASP 4.10 2.40 1 31 ARG 4.10 1.50 1 32 ARG 2.87 2.00 1 33 ASN 3.50 1.65 1 36 THR 0.14 0.10 1 37 ASN 0.65 1.20 1 38 THR 0.14 -0.90 1 39 TYR -3.00 -1.10 1 40 LYS -1.11 0.60 1 41 THR -1.84 0.70 1 42 LEU 2.92 1.10 1 43 GLU 6.58 3.70 1 44 LEU 5.18 0.51 1 45 GLU 4.86 4.20 1 46 ILE 5.27 2.30 1 47 ALA 4.31 4.20 1 48 GLU 4.75 3.00 1 49 SER 4.56 2.50 1 50 ASP 3.15 2.40 1 51 VAL 6.80 1.70 1 52 GLU 3.92 4.00 1 53 VAL 6.48 1.20 1 54 LYS 5.10 4.50 1 55 LYS 4.71 2.10 1 56 ALA 4.34 0.20 1 57 GLU 3.30 2.10 1 58 LEU 4.95 -0.40 1 59 GLU 3.90 2.30 1 60 LEU 4.65 -0.10 1 61 VAL 5.64 3.00 1 62 LYS 4.87 3.40 1 63 GLU 3.00 3.40 1 64 GLU 2.40 0.30 1 65 ALA -0.12 -0.20 1 66 LYS 0.65 -1.50 1 69 ARG -0.10 0.03 1 70 ASN -0.76 0.58 1 71 GLU 3.61 2.40 1 72 GLU 3.44 2.60 1 73 LYS 3.62 4.20 1 74 VAL 6.63 1.00 1 75 LYS 5.02 3.80 1 76 GLN 4.33 2.40 1 77 ALA 3.81 3.60 1 78 LYS 4.56 2.20 1 79 ALA 4.10 3.00 1 80 GLU 3.40 2.45 1 81 VAL 6.79 1.60 1 82 GLU 4.38 3.30 1 83 SER 4.25 3.47 1 84 LYS 4.00 4.21 1 85 LYS 4.87 2.31 1 86 ALA 4.11 2.97 1 87 GLU 2.80 1.18 1 88 ALA 4.10 3.01 1 89 THR 6.13 1.45 1 90 ARG 4.43 3.02 1 91 LEU 1.98 1.28 1 92 GLU 3.09 2.37 1 93 LYS 4.10 1.70 1 94 ILE 5.76 2.51 1 95 LYS 4.89 2.35 1 96 THR 6.13 2.32 1 97 ASP 4.06 2.95 1 98 ARG 4.20 0.10 1 99 LYS 3.80 1.20 1 100 LYS 3.90 0.40 1 101 ALA 3.39 3.20 1 102 GLU 0.80 2.59 1 103 GLU 2.30 2.64 1 104 GLU 3.10 1.90 1 105 ALA 4.14 2.80 1 106 LYS 2.80 2.20 1 107 ARG 3.60 2.60 1 108 LYS 3.30 1.70 1 109 ALA 2.29 1.20 1 110 ALA 1.88 1.50 1 111 GLU 1.00 1.10 1 112 GLU 1.10 0.40 1 113 ASP 1.27 0.26 1 114 LYS 1.00 0.60 1 115 VAL 1.18 0.10 1 116 LYS 0.20 -0.10 1 117 GLU -0.30 -0.70 1 118 LYS -0.20 -1.30 1 stop_ save_