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 bmr15584_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 -2.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.63 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 5.02 _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 60 SER -2.75 2.88 0 10 ILE -3.59 -1.17 1 11 ALA -2.20 -1.14 1 12 ASP 4.57 3.49 1 13 ASN 2.65 0.79 1 14 GLU 0.20 0.15 1 15 LEU -3.18 -1.64 1 16 GLU -2.65 -1.39 1 17 ILE -1.20 -0.89 1 18 THR -3.46 -1.51 1 19 ALA -1.53 -1.26 1 20 ILE -0.92 -0.77 1 21 ARG -0.15 -0.23 1 22 ALA -0.44 -0.20 1 23 GLN 0.01 0.08 1 25 ALA -0.23 0.04 1 28 GLN 0.62 0.36 1 29 HIS -0.26 1.17 1 30 VAL 0.45 0.15 1 31 ASN 0.22 0.06 1 32 LYS 0.28 0.45 1 33 THR -0.19 -0.11 1 34 SER -0.52 -0.44 1 35 SER -0.21 0.00 1 36 ALA -2.38 -0.30 1 37 ILE -6.33 -4.33 1 38 HIS -4.27 -0.36 1 39 LEU -4.16 -1.12 1 40 ARG -4.99 -1.47 1 41 PHE -4.64 -2.08 1 42 ASP -0.21 -0.57 1 43 ILE 5.34 4.28 1 44 ARG -0.28 -0.42 1 45 ALA -2.32 0.86 1 46 SER -0.22 0.20 1 48 LEU 4.16 3.47 1 50 GLU 3.51 2.69 1 51 TYR 2.51 3.09 1 52 TYR 5.49 5.17 1 53 LYS 4.70 3.11 1 54 GLN 3.13 1.76 1 55 ARG 1.98 2.36 1 56 LEU 2.06 1.39 1 57 LEU -0.78 -0.61 1 58 THR -2.14 -0.38 1 59 ALA -0.48 -1.40 1 61 HIS 0.42 0.57 1 62 HIS 0.95 0.21 1 63 LEU 0.72 -0.16 1 64 ILE -2.18 -0.59 1 65 SER 3.25 2.36 1 66 ASP -0.10 -1.05 1 67 ASP -3.14 -2.06 1 69 VAL 0.88 0.29 1 70 ILE -2.11 -1.24 1 71 ILE -5.45 -1.78 1 72 ILE -2.40 -1.51 1 73 LYS -4.03 -0.82 1 74 ALA -2.96 -1.58 1 75 GLN 2.14 2.29 1 76 GLU -2.36 -1.03 1 77 PHE 1.19 0.15 1 78 ARG -4.79 -2.78 1 79 SER 3.70 3.53 1 80 GLN 4.38 3.39 1 81 GLU 3.07 1.94 1 82 LEU 4.58 3.22 1 83 ASN 5.61 4.51 1 84 ARG 2.98 2.60 1 85 GLU 2.54 2.16 1 86 ALA 3.50 2.69 1 87 ALA 5.16 4.45 1 88 ILE 4.00 2.54 1 89 ALA 3.74 2.45 1 90 ARG 4.33 2.96 1 91 LEU 6.10 4.88 1 92 VAL 3.75 2.84 1 93 ALA 4.86 3.26 1 94 VAL 6.47 5.08 1 95 ILE 4.94 4.28 1 96 LYS 2.67 2.58 1 97 GLU 0.22 0.65 1 98 LEU -0.17 -0.49 1 99 THR 0.08 0.27 1 100 ALA -0.23 0.02 1 101 GLU -0.36 0.19 1 102 GLN 3.79 0.93 1 103 LYS -3.34 -1.34 1 104 SER -1.65 0.45 1 106 ARG -0.19 -0.09 1 107 ALA -0.49 -0.30 1 108 THR -0.12 -0.17 1 109 ARG -0.27 -0.15 1 111 THR 0.29 0.07 1 112 ARG -0.09 0.06 1 113 ALA 0.18 0.08 1 114 SER -0.17 -0.80 1 116 GLU 0.05 -0.05 1 119 LEU -0.08 -0.15 1 120 SER -0.87 -0.43 1 123 ALA -0.46 -0.01 1 124 GLN -0.04 -0.09 1 126 SER -0.11 -0.19 1 127 SER 0.83 0.37 1 128 VAL 0.41 0.21 1 129 LYS -0.34 -0.13 1 130 ALA 0.11 -0.04 1 131 LEU 0.63 0.15 1 132 ARG 0.01 -0.13 1 134 LYS 0.23 -0.18 1 135 VAL -0.09 -0.25 1 136 ARG 0.17 -0.17 1 137 ARG 0.57 0.20 1 139 LEU 0.15 -0.07 1 140 ASP 0.51 0.27 1 141 LEU 0.14 0.24 1 142 GLU -0.52 1.07 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15584_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 3.83 _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 0.37 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -1.45 _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 60 SER -2.75 5.63 0 10 ILE -3.59 2.42 1 11 ALA -2.20 1.06 1 12 ASP 4.57 -1.08 1 13 ASN 2.65 -1.86 1 14 GLU 0.20 -0.05 1 15 LEU -3.18 1.54 1 16 GLU -2.65 1.26 1 17 ILE -1.20 0.31 1 18 THR -3.46 1.95 1 19 ALA -1.53 0.27 1 20 ILE -0.92 0.15 1 21 ARG -0.15 -0.08 1 22 ALA -0.44 0.24 1 23 GLN 0.01 0.07 1 25 ALA -0.23 0.27 1 28 GLN 0.62 -0.26 1 29 HIS -0.26 1.43 1 30 VAL 0.45 -0.30 1 31 ASN 0.22 -0.16 1 32 LYS 0.28 0.17 1 33 THR -0.19 0.08 1 34 SER -0.52 0.08 1 35 SER -0.21 0.21 1 36 ALA -2.38 2.08 1 37 ILE -6.33 2.00 1 38 HIS -4.27 3.91 1 39 LEU -4.16 3.04 1 40 ARG -4.99 3.52 1 41 PHE -4.64 2.56 1 42 ASP -0.21 -0.36 1 43 ILE 5.34 -1.06 1 44 ARG -0.28 -0.14 1 45 ALA -2.32 3.18 1 46 SER -0.22 0.42 1 48 LEU 4.16 -0.69 1 50 GLU 3.51 -0.82 1 51 TYR 2.51 0.58 1 52 TYR 5.49 -0.32 1 53 LYS 4.70 -1.59 1 54 GLN 3.13 -1.37 1 55 ARG 1.98 0.38 1 56 LEU 2.06 -0.67 1 57 LEU -0.78 0.17 1 58 THR -2.14 1.76 1 59 ALA -0.48 -0.92 1 61 HIS 0.42 0.15 1 62 HIS 0.95 -0.74 1 63 LEU 0.72 -0.88 1 64 ILE -2.18 1.59 1 65 SER 3.25 -0.89 1 66 ASP -0.10 -0.95 1 67 ASP -3.14 1.08 1 69 VAL 0.88 -0.59 1 70 ILE -2.11 0.87 1 71 ILE -5.45 3.67 1 72 ILE -2.40 0.89 1 73 LYS -4.03 3.21 1 74 ALA -2.96 1.38 1 75 GLN 2.14 0.15 1 76 GLU -2.36 1.33 1 77 PHE 1.19 -1.04 1 78 ARG -4.79 2.01 1 79 SER 3.70 -0.17 1 80 GLN 4.38 -0.99 1 81 GLU 3.07 -1.13 1 82 LEU 4.58 -1.36 1 83 ASN 5.61 -1.10 1 84 ARG 2.98 -0.38 1 85 GLU 2.54 -0.38 1 86 ALA 3.50 -0.81 1 87 ALA 5.16 -0.71 1 88 ILE 4.00 -1.46 1 89 ALA 3.74 -1.29 1 90 ARG 4.33 -1.37 1 91 LEU 6.10 -1.22 1 92 VAL 3.75 -0.91 1 93 ALA 4.86 -1.60 1 94 VAL 6.47 -1.39 1 95 ILE 4.94 -0.66 1 96 LYS 2.67 -0.09 1 97 GLU 0.22 0.43 1 98 LEU -0.17 -0.32 1 99 THR 0.08 0.19 1 100 ALA -0.23 0.25 1 101 GLU -0.36 0.55 1 102 GLN 3.79 -2.86 1 103 LYS -3.34 2.00 1 104 SER -1.65 2.10 1 106 ARG -0.19 0.10 1 107 ALA -0.49 0.19 1 108 THR -0.12 -0.05 1 109 ARG -0.27 0.12 1 111 THR 0.29 -0.22 1 112 ARG -0.09 0.15 1 113 ALA 0.18 -0.10 1 114 SER -0.17 -0.63 1 116 GLU 0.05 -0.10 1 119 LEU -0.08 -0.07 1 120 SER -0.87 0.44 1 123 ALA -0.46 0.45 1 124 GLN -0.04 -0.05 1 126 SER -0.11 -0.08 1 127 SER 0.83 -0.46 1 128 VAL 0.41 -0.20 1 129 LYS -0.34 0.21 1 130 ALA 0.11 -0.15 1 131 LEU 0.63 -0.48 1 132 ARG 0.01 -0.14 1 134 LYS 0.23 -0.41 1 135 VAL -0.09 -0.16 1 136 ARG 0.17 -0.34 1 137 ARG 0.57 -0.37 1 139 LEU 0.15 -0.22 1 140 ASP 0.51 -0.24 1 141 LEU 0.14 0.10 1 142 GLU -0.52 1.59 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15584_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 0.64 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _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 70 ILE -2.11 0.96 0 102 GLN 3.79 0.32 0 69 VAL 0.88 0.69 0 17 ILE -1.20 0.92 0 10 ILE -3.59 0.16 1 11 ALA -2.20 0.19 1 12 ASP 4.57 -0.51 1 13 ASN 2.65 -0.08 1 14 GLU 0.20 -0.07 1 15 LEU -3.18 0.57 1 16 GLU -2.65 0.34 1 18 THR -3.46 0.29 1 19 ALA -1.53 0.61 1 20 ILE -0.92 0.02 1 21 ARG -0.15 0.09 1 22 ALA -0.44 0.09 1 23 GLN 0.01 0.04 1 25 ALA -0.23 0.02 1 28 GLN 0.62 -0.08 1 29 HIS -0.26 -0.08 1 30 VAL 0.45 -0.03 1 31 ASN 0.22 -0.01 1 32 LYS 0.28 0.06 1 33 THR -0.19 0.06 1 34 SER -0.52 0.15 1 35 SER -0.21 0.06 1 36 ALA -2.38 0.34 1 37 ILE -6.33 0.78 1 38 HIS -4.27 0.43 1 39 LEU -4.16 0.86 1 40 ARG -4.99 1.04 1 41 PHE -4.64 0.58 1 42 ASP -0.21 -0.28 1 43 ILE 5.34 -0.59 1 44 ARG -0.28 -0.12 1 45 ALA -2.32 -0.07 1 46 SER -0.22 -0.32 1 48 LEU 4.16 -0.39 1 50 GLU 3.51 -0.21 1 51 TYR 2.51 -0.69 1 52 TYR 5.49 -0.79 1 53 LYS 4.70 -0.39 1 54 GLN 3.13 -0.48 1 55 ARG 1.98 -0.41 1 56 LEU 2.06 -0.18 1 57 LEU -0.78 0.12 1 58 THR -2.14 0.09 1 59 ALA -0.48 0.17 1 60 SER -2.75 -0.21 1 61 HIS 0.42 0.06 1 62 HIS 0.95 0.22 1 63 LEU 0.72 0.40 1 64 ILE -2.18 0.16 1 65 SER 3.25 -0.16 1 66 ASP -0.10 0.12 1 67 ASP -3.14 0.60 1 71 ILE -5.45 0.20 1 72 ILE -2.40 0.84 1 73 LYS -4.03 0.52 1 74 ALA -2.96 0.48 1 75 GLN 2.14 -0.47 1 76 GLU -2.36 0.29 1 77 PHE 1.19 -0.02 1 78 ARG -4.79 0.41 1 79 SER 3.70 0.04 1 80 GLN 4.38 -0.36 1 81 GLU 3.07 -0.31 1 82 LEU 4.58 0.10 1 83 ASN 5.61 -0.50 1 84 ARG 2.98 -0.43 1 85 GLU 2.54 -0.06 1 86 ALA 3.50 -0.37 1 87 ALA 5.16 -0.85 1 88 ILE 4.00 -0.27 1 89 ALA 3.74 -0.21 1 90 ARG 4.33 -0.59 1 91 LEU 6.10 -0.99 1 92 VAL 3.75 -0.26 1 93 ALA 4.86 -0.33 1 94 VAL 6.47 -0.67 1 95 ILE 4.94 -0.58 1 96 LYS 2.67 -0.33 1 97 GLU 0.22 -0.03 1 98 LEU -0.17 -0.19 1 99 THR 0.08 0.01 1 100 ALA -0.23 -0.09 1 101 GLU -0.36 0.24 1 103 LYS -3.34 -0.13 1 104 SER -1.65 -0.17 1 106 ARG -0.19 0.08 1 107 ALA -0.49 -0.02 1 108 THR -0.12 -0.01 1 109 ARG -0.27 -0.02 1 111 THR 0.29 -0.01 1 112 ARG -0.09 -0.03 1 113 ALA 0.18 -0.06 1 114 SER -0.17 0.01 1 116 GLU 0.05 0.05 1 119 LEU -0.08 0.01 1 120 SER -0.87 -0.02 1 123 ALA -0.46 0.03 1 124 GLN -0.04 0.15 1 126 SER -0.11 0.07 1 127 SER 0.83 -0.03 1 128 VAL 0.41 -0.05 1 129 LYS -0.34 -0.04 1 130 ALA 0.11 -0.01 1 131 LEU 0.63 -0.02 1 132 ARG 0.01 0.03 1 134 LYS 0.23 -0.03 1 135 VAL -0.09 0.01 1 136 ARG 0.17 -0.01 1 137 ARG 0.57 -0.09 1 139 LEU 0.15 -0.05 1 140 ASP 0.51 -0.10 1 141 LEU 0.14 -0.21 1 142 GLU -0.52 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15584_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 -2.62 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.65 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 2.41 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 GLU -2.36 5.19 0 10 ILE -3.59 -1.61 1 11 ALA -2.20 0.85 1 12 ASP 4.57 1.68 1 13 ASN 2.65 0.87 1 14 GLU 0.20 -1.20 1 15 LEU -3.18 -2.41 1 16 GLU -2.65 -1.00 1 17 ILE -1.20 -0.73 1 18 THR -3.46 -2.19 1 19 ALA -1.53 -1.19 1 20 ILE -0.92 -0.71 1 21 ARG -0.15 -0.35 1 22 ALA -0.44 -0.03 1 23 GLN 0.01 0.46 1 25 ALA -0.23 0.64 1 28 GLN 0.62 -1.58 1 29 HIS -0.26 1.29 1 30 VAL 0.45 -0.54 1 31 ASN 0.22 0.11 1 32 LYS 0.28 0.07 1 33 THR -0.19 -0.18 1 34 SER -0.52 -0.29 1 35 SER -0.21 -1.01 1 36 ALA -2.38 -1.03 1 37 ILE -6.33 -2.61 1 38 HIS -4.27 -1.24 1 39 LEU -4.16 -3.76 1 40 ARG -4.99 -1.24 1 41 PHE -4.64 -3.09 1 42 ASP -0.21 -0.75 1 43 ILE 5.34 1.32 1 44 ARG -0.28 -0.52 1 45 ALA -2.32 -0.82 1 46 SER 4.16 1.47 1 50 GLU 3.51 2.30 1 51 TYR 2.51 1.87 1 52 TYR 5.49 0.28 1 53 LYS 4.70 3.14 1 54 GLN 3.13 2.08 1 55 ARG 1.98 0.35 1 56 LEU 2.06 0.84 1 57 LEU -0.78 -0.34 1 58 THR -2.14 -0.06 1 59 ALA -0.48 -1.01 1 60 SER -2.75 0.50 1 61 HIS 0.42 2.52 1 62 HIS 0.95 -1.74 1 63 LEU 0.72 -0.15 1 64 ILE -2.18 1.93 1 65 SER 3.25 0.20 1 66 ASP -0.10 -0.12 1 67 ASP -3.14 -0.87 1 69 VAL 0.88 -1.43 1 70 ILE -2.11 -1.10 1 71 ILE -5.45 -2.56 1 72 ILE -2.40 -1.26 1 73 LYS -4.03 -2.46 1 74 ALA -2.96 -1.15 1 75 GLN 2.14 0.25 1 77 PHE 1.19 1.89 1 78 ARG -4.79 -0.15 1 79 SER 3.70 2.17 1 80 GLN 4.38 2.64 1 81 GLU 3.07 3.09 1 82 LEU 4.58 1.66 1 83 ASN 5.61 0.93 1 84 ARG 2.98 2.79 1 85 GLU 2.54 2.37 1 86 ALA 3.50 1.07 1 87 ALA 5.16 0.82 1 88 ILE 4.00 3.66 1 89 ALA 3.74 1.38 1 90 ARG 4.33 -0.05 1 91 LEU 6.10 1.10 1 92 VAL 3.75 3.20 1 93 ALA 4.86 0.68 1 94 VAL 6.47 3.45 1 95 ILE 4.94 2.09 1 96 LYS 2.67 2.70 1 97 GLU 0.22 0.14 1 98 LEU -0.17 -0.70 1 99 THR 0.08 0.01 1 100 ALA -0.23 -0.16 1 101 GLU -0.36 -2.06 1 102 GLN 3.79 -0.91 1 103 LYS -1.65 0.07 1 106 ARG -0.19 -1.13 1 107 ALA -0.49 -0.39 1 108 THR -0.27 -0.03 1 111 THR 0.29 -0.24 1 112 ARG -0.09 0.10 1 113 ALA 0.05 -0.08 1 119 LEU -0.87 -0.54 1 123 ALA -0.04 -0.30 1 126 SER -0.11 0.07 1 127 SER 0.83 0.11 1 128 VAL 0.41 -0.02 1 129 LYS -0.34 -0.15 1 130 ALA 0.11 -0.11 1 131 LEU 0.63 0.44 1 132 ARG 0.01 -0.02 1 134 LYS 0.23 -0.35 1 135 VAL -0.09 -0.51 1 136 ARG 0.57 -0.40 1 139 LEU 0.15 0.02 1 140 ASP 0.51 0.08 1 141 LEU 0.14 -0.02 1 stop_ save_