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 bmr27264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 -2.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.87 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 6.62 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 TYR 0.65 -3.36 0 10 TRP -0.35 -0.65 1 11 ASN -0.46 -0.66 1 12 LYS -0.27 -0.46 1 14 SER -0.14 -0.22 1 15 LYS -0.27 -0.46 1 17 LYS 0.69 0.00 1 18 THR -0.17 -0.61 1 19 ASN 0.19 -0.01 1 20 MET 0.71 0.22 1 21 LYS 0.69 0.00 1 22 HIS 0.32 -0.03 1 23 MET -0.02 -0.43 1 24 ALA 0.36 -0.06 1 26 ALA -0.29 -0.06 1 27 ALA 0.36 -0.06 1 28 ALA 0.36 -0.06 1 29 ALA 0.36 -0.06 1 31 ALA -0.87 -0.64 1 32 VAL 0.13 -0.36 1 33 VAL 0.78 0.29 1 36 LEU -0.52 -0.54 1 39 TYR -1.44 -0.31 1 40 MET -3.21 -1.82 1 41 LEU -2.64 -2.01 1 43 SER -0.14 -0.22 1 44 ALA 1.02 -0.06 1 45 MET -4.93 -1.66 1 46 SER -0.05 -0.22 1 47 ARG 1.22 0.32 1 49 ILE 2.14 -0.49 1 50 ILE -2.93 -2.37 1 51 HIS -1.56 -1.26 1 52 PHE -0.04 1.60 1 54 SER -3.90 -2.10 1 55 ASP 3.82 3.30 1 56 TYR 4.04 3.29 1 57 GLU 2.72 2.78 1 58 ASP 5.05 3.88 1 59 ARG 4.90 3.30 1 60 TYR 4.69 3.94 1 61 TYR 5.34 4.59 1 62 ARG 5.56 3.96 1 63 GLU 2.08 1.48 1 64 ASN 0.19 1.87 1 65 MET 7.17 3.90 1 66 HIS 4.00 2.43 1 67 ARG 0.57 0.20 1 70 ASN -0.38 -1.23 1 71 GLN -5.62 -1.96 1 72 VAL -4.20 -3.47 1 73 TYR -4.06 -1.05 1 74 TYR -1.81 -0.18 1 77 MET 2.59 2.10 1 81 SER -0.14 -0.22 1 82 ASN -1.12 -0.66 1 83 GLN 4.35 3.60 1 84 ASN 4.52 3.10 1 85 ASN 3.87 2.45 1 87 VAL 6.34 5.28 1 88 HIS 5.22 4.30 1 89 ASP 3.25 2.81 1 91 VAL 5.11 4.05 1 92 ASN 3.30 3.10 1 93 ILE 3.37 0.74 1 94 THR 8.65 6.98 1 95 ILE 7.05 4.50 1 96 LYS 5.02 3.76 1 97 GLN 3.12 1.80 1 98 HIS 2.20 3.73 1 99 THR 4.90 3.80 1 100 VAL 3.80 2.74 1 101 THR 3.01 2.57 1 102 THR 3.66 2.57 1 103 THR 3.67 2.57 1 104 THR 3.02 1.92 1 105 LYS 0.69 0.00 1 107 GLU -1.61 -0.98 1 108 ASN -1.69 -0.66 1 109 PHE -1.83 -1.50 1 110 THR -3.93 -1.84 1 111 GLU 4.61 3.36 1 112 THR 6.69 5.02 1 113 ASP 3.16 3.30 1 114 VAL 7.00 5.28 1 115 LYS 4.36 3.10 1 116 MET 5.05 4.56 1 117 MET 3.83 3.99 1 118 GLU 5.83 4.01 1 119 ARG 3.02 2.08 1 120 VAL 4.46 3.40 1 121 VAL 6.42 4.05 1 122 GLU 5.26 4.01 1 123 GLN 5.01 3.03 1 124 MET 2.51 3.90 1 126 ILE 6.39 5.15 1 127 THR 6.69 5.02 1 128 GLN 4.36 2.38 1 129 TYR 5.91 3.77 1 130 GLU 4.52 2.70 1 131 ARG 3.67 2.73 1 132 GLU 2.08 0.83 1 133 SER 4.19 2.80 1 134 GLN 3.70 2.38 1 135 ALA 2.32 1.24 1 136 TYR 2.16 2.06 1 137 TYR 1.58 0.83 1 138 GLN 1.25 0.50 1 139 ARG 1.22 0.85 1 141 SER -0.14 -0.22 1 142 SER 1.09 1.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 3.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 -2.03 _LACS_plot.Y_axis_chem_shift_offset 0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 TYR 0.65 -4.01 0 10 TRP -0.35 -0.30 1 11 ASN -0.46 -0.20 1 12 LYS -0.27 -0.19 1 14 SER -0.14 -0.08 1 15 LYS -0.27 -0.19 1 17 LYS 0.69 -0.69 1 18 THR -0.17 -0.44 1 19 ASN 0.19 -0.20 1 20 MET 0.71 -0.49 1 21 LYS 0.69 -0.69 1 22 HIS 0.32 -0.35 1 23 MET -0.02 -0.41 1 24 ALA 0.36 -0.42 1 26 ALA -0.29 0.23 1 27 ALA 0.36 -0.42 1 28 ALA 0.36 -0.42 1 29 ALA 0.36 -0.42 1 31 ALA -0.87 0.23 1 32 VAL 0.13 -0.49 1 33 VAL 0.78 -0.49 1 36 LEU -0.52 -0.02 1 39 TYR -1.44 1.13 1 40 MET -3.21 1.39 1 41 LEU -2.64 0.63 1 43 SER -0.14 -0.08 1 44 ALA 1.02 -1.08 1 45 MET -4.93 3.27 1 46 SER -0.05 -0.17 1 47 ARG 1.22 -0.90 1 49 ILE 2.14 -2.63 1 50 ILE -2.93 0.56 1 51 HIS -1.56 0.30 1 52 PHE -0.04 1.64 1 54 SER -3.90 1.80 1 55 ASP 3.82 -0.52 1 56 TYR 4.04 -0.75 1 57 GLU 2.72 0.06 1 58 ASP 5.05 -1.17 1 59 ARG 4.90 -1.60 1 60 TYR 4.69 -0.75 1 61 TYR 5.34 -0.75 1 62 ARG 5.56 -1.60 1 63 GLU 2.08 -0.60 1 64 ASN 0.19 1.68 1 65 MET 7.17 -3.27 1 66 HIS 4.00 -1.57 1 67 ARG 0.57 -0.37 1 70 ASN -0.38 -0.85 1 71 GLN -5.62 3.66 1 72 VAL -4.20 0.73 1 73 TYR -4.06 3.01 1 74 TYR -1.81 1.63 1 77 MET 2.59 -0.49 1 81 SER -0.14 -0.08 1 82 ASN -1.12 0.46 1 83 GLN 4.35 -0.75 1 84 ASN 4.52 -1.42 1 85 ASN 3.87 -1.42 1 87 VAL 6.34 -1.06 1 88 HIS 5.22 -0.92 1 89 ASP 3.25 -0.44 1 91 VAL 5.11 -1.06 1 92 ASN 3.30 -0.20 1 93 ILE 3.37 -2.63 1 94 THR 8.65 -1.67 1 95 ILE 7.05 -2.55 1 96 LYS 5.02 -1.26 1 97 GLN 3.12 -1.32 1 98 HIS 2.20 1.53 1 99 THR 4.90 -1.10 1 100 VAL 3.80 -1.06 1 101 THR 3.01 -0.44 1 102 THR 3.66 -1.09 1 103 THR 3.67 -1.10 1 104 THR 3.02 -1.10 1 105 LYS 0.69 -0.69 1 107 GLU -1.61 0.63 1 108 ASN -1.69 1.03 1 109 PHE -1.83 0.33 1 110 THR -3.93 2.09 1 111 GLU 4.61 -1.25 1 112 THR 6.69 -1.67 1 113 ASP 3.16 0.14 1 114 VAL 7.00 -1.72 1 115 LYS 4.36 -1.26 1 116 MET 5.05 -0.49 1 117 MET 3.83 0.16 1 118 GLU 5.83 -1.82 1 119 ARG 3.02 -0.94 1 120 VAL 4.46 -1.06 1 121 VAL 6.42 -2.37 1 122 GLU 5.26 -1.25 1 123 GLN 5.01 -1.98 1 124 MET 2.51 1.39 1 126 ILE 6.39 -1.24 1 127 THR 6.69 -1.67 1 128 GLN 4.36 -1.98 1 129 TYR 5.91 -2.14 1 130 GLU 4.52 -1.82 1 131 ARG 3.67 -0.94 1 132 GLU 2.08 -1.25 1 133 SER 4.19 -1.39 1 134 GLN 3.70 -1.32 1 135 ALA 2.32 -1.08 1 136 TYR 2.16 -0.10 1 137 TYR 1.58 -0.75 1 138 GLN 1.25 -0.75 1 139 ARG 1.22 -0.37 1 141 SER -0.14 -0.08 1 142 SER 1.09 0.57 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 0.25 _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 8.65 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 83 GLN 4.35 -1.48 0 129 TYR 5.91 -1.65 0 10 TRP -0.35 -0.04 1 11 ASN -0.46 -0.19 1 12 LYS -0.27 -0.24 1 14 SER -0.14 -0.10 1 15 LYS -0.27 -0.05 1 17 LYS 0.69 -0.03 1 18 THR -0.17 -0.09 1 19 ASN 0.19 -0.08 1 20 MET 0.71 -0.11 1 21 LYS 0.69 -0.14 1 22 HIS 0.32 -0.13 1 23 MET -0.02 -0.08 1 24 ALA 0.36 -0.08 1 26 ALA -0.29 -0.08 1 27 ALA 0.36 -0.08 1 28 ALA 0.36 -0.08 1 29 ALA 0.36 -0.08 1 31 ALA -0.87 -0.01 1 32 VAL 0.13 -0.05 1 33 VAL 0.78 -0.09 1 36 LEU -0.52 -0.03 1 39 TYR -1.44 -0.12 1 40 MET -3.21 -0.01 1 41 LEU -2.64 0.09 1 43 SER -0.14 -0.10 1 44 ALA 1.02 0.05 1 45 MET -4.93 0.20 1 46 SER -0.05 -0.16 1 47 ARG 1.22 -0.28 1 49 ILE 2.14 -0.08 1 50 ILE -2.93 -0.31 1 51 HIS -1.56 0.13 1 52 PHE -0.04 -0.31 1 54 SER -3.90 0.27 1 55 ASP 3.82 -0.20 1 56 TYR 4.04 -0.42 1 57 GLU 2.72 -0.83 1 58 ASP 5.05 -0.02 1 59 ARG 4.90 -0.41 1 60 TYR 4.69 -0.75 1 61 TYR 5.34 -0.50 1 62 ARG 5.56 -0.48 1 63 GLU 2.08 -0.36 1 64 ASN 0.19 -0.51 1 65 MET 7.17 -1.11 1 66 HIS 4.00 -0.57 1 67 ARG 0.57 -0.29 1 68 TYR 0.65 0.10 1 70 ASN -0.38 -0.10 1 71 GLN -5.62 0.15 1 72 VAL -4.20 0.73 1 73 TYR -4.06 0.92 1 74 TYR -1.81 -0.10 1 77 MET 2.59 -0.09 1 81 SER -0.14 -0.18 1 82 ASN -1.12 -0.04 1 84 ASN 4.52 -0.56 1 85 ASN 3.87 -0.24 1 87 VAL 6.34 -0.66 1 88 HIS 5.22 -0.47 1 89 ASP 3.25 -0.15 1 91 VAL 5.11 -0.53 1 92 ASN 3.30 -0.48 1 93 ILE 3.37 -0.48 1 94 THR 8.65 -0.35 1 95 ILE 7.05 -0.54 1 96 LYS 5.02 -0.32 1 97 GLN 3.12 -0.37 1 98 HIS 2.20 -0.20 1 99 THR 4.90 -0.25 1 100 VAL 3.80 -0.20 1 101 THR 3.01 -0.21 1 102 THR 3.66 -0.25 1 103 THR 3.67 -0.03 1 104 THR 3.02 -0.19 1 105 LYS 0.69 -0.03 1 107 GLU -1.61 -0.15 1 108 ASN -1.69 -0.14 1 109 PHE -1.83 0.59 1 110 THR -3.93 0.21 1 111 GLU 4.61 -0.33 1 112 THR 6.69 -0.62 1 113 ASP 3.16 -0.12 1 114 VAL 7.00 -0.88 1 115 LYS 4.36 -0.30 1 116 MET 5.05 -0.39 1 117 MET 3.83 -0.98 1 118 GLU 5.83 -0.74 1 119 ARG 3.02 -0.20 1 120 VAL 4.46 -0.37 1 121 VAL 6.42 -0.52 1 122 GLU 5.26 -0.81 1 123 GLN 5.01 -0.42 1 124 MET 2.51 -0.38 1 126 ILE 6.39 -0.65 1 127 THR 6.69 -0.46 1 128 GLN 4.36 -0.75 1 130 GLU 4.52 -0.67 1 131 ARG 3.67 -0.41 1 132 GLU 2.08 -0.38 1 133 SER 4.19 -0.63 1 134 GLN 3.70 -0.29 1 135 ALA 2.32 -0.21 1 136 TYR 2.16 -0.44 1 137 TYR 1.58 -0.24 1 138 GLN 1.25 -0.16 1 139 ARG 1.22 -0.15 1 141 SER -0.14 -0.04 1 142 SER 1.09 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27264_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.62 _LACS_plot.Line_1_terminator_val_y_1 -2.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.67 _LACS_plot.Line_2_terminator_val_x_2 8.65 _LACS_plot.Line_2_terminator_val_y_2 2.59 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 12 LYS -0.27 4.00 0 58 ASP 5.05 -2.65 0 10 TRP -0.35 -0.58 1 11 ASN -0.46 -1.19 1 14 SER -0.14 -0.61 1 15 LYS -0.27 -0.47 1 17 LYS 0.69 0.13 1 18 THR -0.17 -0.89 1 19 ASN 0.19 -0.20 1 20 MET 0.71 -0.27 1 21 LYS 0.69 -0.57 1 22 HIS 0.32 0.05 1 23 MET -0.02 -0.78 1 24 ALA 0.36 0.14 1 26 ALA -0.29 -0.22 1 27 ALA 0.36 -0.37 1 28 ALA 0.36 -0.37 1 29 ALA 0.36 0.30 1 31 ALA -0.87 -0.37 1 32 VAL 0.13 -0.09 1 33 VAL 0.78 0.25 1 36 LEU -0.52 0.16 1 39 TYR -1.44 -0.54 1 40 MET -3.21 -3.34 1 41 LEU -2.64 -0.17 1 43 SER -0.14 0.40 1 44 ALA 1.02 -0.55 1 45 MET -4.93 -0.94 1 46 SER -0.05 -0.29 1 47 ARG 1.22 -0.01 1 49 ILE 2.14 -1.40 1 50 ILE -2.93 -3.28 1 51 HIS -1.56 0.39 1 52 PHE -0.04 0.75 1 54 SER -3.90 -0.79 1 55 ASP 3.82 2.16 1 56 TYR 4.04 2.04 1 57 GLU 2.72 0.83 1 59 ARG 4.90 1.28 1 60 TYR 4.69 3.57 1 61 TYR 5.34 1.01 1 62 ARG 5.56 3.17 1 63 GLU 2.08 0.65 1 64 ASN 0.19 0.16 1 65 MET 7.17 -0.09 1 66 HIS 4.00 0.74 1 67 ARG 0.57 0.09 1 68 TYR 0.65 -2.02 1 70 ASN -0.38 -2.42 1 71 GLN -5.62 -1.16 1 72 VAL -4.20 -2.31 1 73 TYR -4.06 -0.38 1 74 TYR -1.81 -1.84 1 77 MET 2.59 -0.78 1 81 SER -0.14 1.46 1 82 ASN -1.12 -1.05 1 83 GLN 4.35 0.73 1 84 ASN 4.52 2.56 1 85 ASN 3.87 1.87 1 87 VAL 6.34 0.61 1 89 ASP 3.25 -0.40 1 91 VAL 5.11 0.77 1 92 ASN 3.30 3.26 1 93 ILE 3.37 1.18 1 94 THR 8.65 1.33 1 95 ILE 7.05 2.22 1 96 LYS 5.02 2.17 1 97 GLN 3.12 2.10 1 98 HIS 2.20 3.17 1 99 THR 4.90 1.15 1 100 VAL 3.80 1.48 1 101 THR 3.01 1.33 1 102 THR 3.66 1.69 1 103 THR 3.67 2.21 1 104 THR 3.02 0.28 1 105 LYS 0.69 0.13 1 107 GLU -1.61 -1.60 1 108 ASN -1.69 -1.39 1 109 PHE -1.83 0.59 1 110 THR -3.93 0.48 1 111 GLU 4.61 2.35 1 112 THR 6.69 0.82 1 113 ASP 3.16 1.13 1 114 VAL 7.00 1.28 1 115 LYS 4.36 3.39 1 116 MET 5.05 1.80 1 117 MET 3.83 1.44 1 118 GLU 5.83 1.68 1 119 ARG 3.02 2.83 1 120 VAL 4.46 0.77 1 121 VAL 6.42 1.13 1 122 GLU 5.26 0.83 1 123 GLN 5.01 2.80 1 124 MET 2.51 2.16 1 126 ILE 6.39 1.59 1 127 THR 6.69 1.51 1 128 GLN 4.36 1.07 1 129 TYR 5.91 1.53 1 130 GLU 4.52 2.35 1 131 ARG 3.67 3.35 1 132 GLU 2.08 2.02 1 133 SER 4.19 -0.61 1 134 GLN 3.70 1.43 1 135 ALA 2.32 1.00 1 136 TYR 2.16 1.17 1 137 TYR 1.58 0.65 1 138 GLN 1.25 0.21 1 139 ARG 1.22 0.61 1 141 SER -0.14 -0.97 1 142 SER 1.09 -0.45 1 stop_ save_