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 bmr26731_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 -2.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.21 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 5.22 _LACS_plot.Y_axis_chem_shift_offset 0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 124 ARG 6.61 0.77 0 61 ARG 6.31 0.36 0 11 THR 0.19 -0.41 1 13 ARG 0.97 -0.16 1 14 THR 0.11 -0.51 1 15 SER 0.18 -0.46 1 16 ARG 1.06 -0.22 1 17 THR -0.03 -0.45 1 19 HIS 0.40 0.19 1 22 VAL -2.50 -2.13 1 23 ASN -0.52 -1.20 1 24 GLN 4.17 2.52 1 25 LEU 0.72 -0.73 1 28 VAL 0.28 -0.97 1 29 PHE -5.17 -2.83 1 30 VAL -0.00 -1.37 1 31 ASN 2.66 1.18 1 33 ARG -1.52 -2.56 1 37 ASP 5.30 3.70 1 38 VAL 4.90 2.44 1 39 VAL 4.88 2.94 1 41 GLN 4.21 2.15 1 42 ARG 4.09 1.67 1 43 ILE 6.68 4.59 1 44 VAL 5.96 3.34 1 45 GLU 1.81 2.31 1 46 LEU 3.83 2.18 1 47 ALA 4.03 2.43 1 48 HIS 3.74 2.83 1 49 GLN 1.28 -0.21 1 51 VAL 2.94 0.19 1 52 ARG 1.09 1.03 1 55 ASP 3.08 2.45 1 56 ILE 7.05 5.27 1 57 SER 3.54 2.18 1 58 ARG 4.14 4.00 1 59 GLN 4.05 2.91 1 60 LEU 0.83 -1.24 1 62 VAL -4.52 -2.27 1 63 SER 2.70 1.62 1 64 HIS 7.64 4.19 1 67 VAL 7.71 5.52 1 68 SER 4.28 3.32 1 69 LYS 4.33 2.62 1 70 ILE 5.77 3.65 1 71 LEU 5.23 2.40 1 73 ARG 4.32 2.43 1 74 TYR 4.81 3.12 1 75 TYR 4.56 1.72 1 76 GLU 1.49 1.80 1 77 THR -2.75 0.03 1 79 SER -3.09 -2.86 1 80 ILE -0.07 -0.93 1 81 LYS 2.32 0.45 1 84 VAL 3.85 1.34 1 85 ILE -1.45 -1.38 1 88 SER -3.50 -1.45 1 89 LYS 4.00 2.69 1 91 LYS -0.86 0.88 1 92 VAL -1.15 -2.07 1 93 ALA -0.74 -2.88 1 94 THR 2.90 -0.16 1 96 LYS 3.93 1.87 1 97 VAL 5.99 4.17 1 98 VAL 7.23 4.87 1 99 GLU 3.09 1.98 1 100 LYS 3.98 0.46 1 101 ILE 7.53 5.24 1 102 ALA 3.87 2.18 1 103 GLU 3.37 2.29 1 104 TYR 2.36 -0.91 1 105 LYS 1.88 -0.26 1 106 ARG 4.12 2.39 1 107 GLN 2.66 1.46 1 108 ASN -1.00 -1.25 1 110 THR 0.30 -1.55 1 111 MET 0.77 0.85 1 112 PHE -2.33 -1.91 1 113 ALA 5.28 3.84 1 114 TRP 5.17 2.03 1 115 GLU 2.43 1.69 1 116 ILE 6.91 4.34 1 117 ARG 6.40 4.11 1 118 ASP 4.44 2.80 1 119 ARG 5.60 3.27 1 120 LEU 3.18 2.48 1 121 LEU 2.50 1.44 1 122 ALA 3.84 2.40 1 123 GLU 0.80 -0.50 1 125 VAL 3.41 2.21 1 127 ASP -2.79 -2.01 1 128 ASN 4.34 3.29 1 129 ASP 1.39 0.83 1 130 THR -1.92 -1.52 1 131 VAL -1.39 -1.98 1 133 SER -1.84 -0.46 1 134 VAL 7.56 5.34 1 135 SER 4.03 2.65 1 136 SER 5.54 3.61 1 137 ILE 7.38 5.11 1 138 ASN 5.56 3.47 1 139 ARG 5.19 3.67 1 140 ILE 5.32 3.46 1 141 ILE 6.38 4.47 1 142 ARG 3.45 2.77 1 143 THR -0.31 0.84 1 144 LYS -1.00 -0.66 1 145 VAL 2.48 0.81 1 146 GLN 0.45 -0.62 1 147 GLN 0.10 -0.61 1 150 ASN 0.64 -0.05 1 151 GLN 0.84 1.14 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26731_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 2.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.21 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 -2.48 _LACS_plot.Y_axis_chem_shift_offset 0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 124 ARG 6.61 -5.84 0 61 ARG 6.31 -5.95 0 11 THR 0.19 -0.60 1 13 ARG 0.97 -1.13 1 14 THR 0.11 -0.62 1 15 SER 0.18 -0.64 1 16 ARG 1.06 -1.28 1 17 THR -0.03 -0.42 1 19 HIS 0.40 -0.21 1 22 VAL -2.50 0.37 1 23 ASN -0.52 -0.68 1 24 GLN 4.17 -1.65 1 25 LEU 0.72 -1.45 1 28 VAL 0.28 -1.25 1 29 PHE -5.17 2.34 1 30 VAL -0.00 -1.37 1 31 ASN 2.66 -1.48 1 33 ARG -1.52 -1.04 1 37 ASP 5.30 -1.60 1 38 VAL 4.90 -2.46 1 39 VAL 4.88 -1.94 1 41 GLN 4.21 -2.06 1 42 ARG 4.09 -2.42 1 43 ILE 6.68 -2.09 1 44 VAL 5.96 -2.62 1 45 GLU 1.81 0.50 1 46 LEU 3.83 -1.65 1 47 ALA 4.03 -1.60 1 48 HIS 3.74 -0.91 1 49 GLN 1.28 -1.49 1 51 VAL 2.94 -2.75 1 52 ARG 1.09 -0.06 1 55 ASP 3.08 -0.63 1 56 ILE 7.05 -1.78 1 57 SER 3.54 -1.36 1 58 ARG 4.14 -0.14 1 59 GLN 4.05 -1.14 1 60 LEU 0.83 -2.07 1 62 VAL -4.52 2.25 1 63 SER 2.70 -1.08 1 64 HIS 7.64 -3.45 1 67 VAL 7.71 -2.19 1 68 SER 4.28 -0.96 1 69 LYS 4.33 -1.71 1 70 ILE 5.77 -2.12 1 71 LEU 5.23 -2.83 1 73 ARG 4.32 -1.89 1 74 TYR 4.81 -1.69 1 75 TYR 4.56 -2.84 1 76 GLU 1.49 0.31 1 77 THR -2.75 2.78 1 79 SER -3.09 0.23 1 80 ILE -0.07 -0.86 1 81 LYS 2.32 -1.87 1 84 VAL 3.85 -2.51 1 85 ILE -1.45 0.07 1 88 SER -3.50 2.05 1 89 LYS 4.00 -1.31 1 91 LYS -0.86 1.74 1 92 VAL -1.15 -0.92 1 93 ALA -0.74 -2.14 1 94 THR 2.90 -3.06 1 96 LYS 3.93 -2.06 1 97 VAL 5.99 -1.82 1 98 VAL 7.23 -2.36 1 99 GLU 3.09 -1.11 1 100 LYS 3.98 -3.52 1 101 ILE 7.53 -2.29 1 102 ALA 3.87 -1.69 1 103 GLU 3.37 -1.08 1 104 TYR 2.36 -3.27 1 105 LYS 1.88 -2.14 1 106 ARG 4.12 -1.73 1 107 GLN 2.66 -1.20 1 108 ASN -1.00 -0.25 1 110 THR 0.30 -1.85 1 111 MET 0.77 0.08 1 112 PHE -2.33 0.42 1 113 ALA 5.28 -1.44 1 114 TRP 5.17 -3.14 1 115 GLU 2.43 -0.74 1 116 ILE 6.91 -2.57 1 117 ARG 6.40 -2.29 1 118 ASP 4.44 -1.64 1 119 ARG 5.60 -2.33 1 120 LEU 3.18 -0.70 1 121 LEU 2.50 -1.06 1 122 ALA 3.84 -1.44 1 123 GLU 0.80 -1.30 1 125 VAL 3.41 -1.20 1 127 ASP -2.79 0.78 1 128 ASN 4.34 -1.05 1 129 ASP 1.39 -0.56 1 130 THR -1.92 0.40 1 131 VAL -1.39 -0.59 1 133 SER -1.84 1.38 1 134 VAL 7.56 -2.22 1 135 SER 4.03 -1.38 1 136 SER 5.54 -1.93 1 137 ILE 7.38 -2.27 1 138 ASN 5.56 -2.09 1 139 ARG 5.19 -1.52 1 140 ILE 5.32 -1.86 1 141 ILE 6.38 -1.91 1 142 ARG 3.45 -0.68 1 143 THR -0.31 1.15 1 144 LYS -1.00 0.34 1 145 VAL 2.48 -1.67 1 146 GLN 0.45 -1.07 1 147 GLN 0.10 -0.71 1 150 ASN 0.64 -0.69 1 151 GLN 0.84 0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26731_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.17 _LACS_plot.Line_1_terminator_val_y_1 -1.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.01 _LACS_plot.Line_2_terminator_val_x_2 7.70 _LACS_plot.Line_2_terminator_val_y_2 2.32 _LACS_plot.Y_axis_chem_shift_offset -0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 PHE -5.17 -2.80 0 61 ARG 6.31 -2.00 0 11 THR 0.19 -0.30 1 13 ARG 0.97 0.40 1 14 THR 0.11 -0.20 1 15 SER 0.18 -0.10 1 16 ARG 1.06 0.10 1 17 THR -0.03 0.60 1 19 HIS 0.40 1.10 1 22 VAL -2.50 0.70 1 23 ASN -0.52 3.00 1 24 GLN 4.17 1.20 1 25 LEU 0.72 -0.70 1 28 VAL 0.28 0.10 1 30 VAL -0.00 -0.30 1 31 ASN 2.66 0.70 1 33 ARG -1.52 -1.30 1 37 ASP 5.30 1.50 1 38 VAL 4.90 1.50 1 39 VAL 4.88 1.30 1 41 GLN 4.21 2.20 1 42 ARG 4.09 1.50 1 43 ILE 6.68 0.30 1 44 VAL 5.96 1.60 1 45 GLU 1.81 3.30 1 46 LEU 3.83 2.10 1 47 ALA 4.03 5.00 1 48 HIS 3.74 2.70 1 49 GLN 1.28 0.10 1 51 VAL 2.94 -0.50 1 52 ARG 1.09 1.90 1 55 ASP 3.08 2.10 1 56 ILE 7.05 1.10 1 57 SER 3.54 2.30 1 58 ARG 4.14 2.80 1 59 GLN 4.05 2.30 1 60 LEU 0.83 -1.70 1 62 VAL -4.52 -1.60 1 63 SER 2.70 2.20 1 64 HIS 7.64 3.90 1 67 VAL 7.71 0.80 1 68 SER 4.28 3.10 1 69 LYS 4.33 2.40 1 70 ILE 5.77 3.40 1 71 LEU 5.23 0.40 1 73 ARG 4.32 3.90 1 74 TYR 4.81 3.20 1 75 TYR 4.56 2.00 1 76 GLU 1.49 1.60 1 77 THR -2.75 1.60 1 79 SER -3.09 1.00 1 80 ILE -0.07 -0.30 1 81 LYS 2.32 0.90 1 84 VAL 3.85 -0.40 1 85 ILE -1.45 0.30 1 88 SER -3.50 -1.30 1 89 LYS 4.00 1.90 1 91 LYS -0.86 -0.20 1 92 VAL -1.15 1.00 1 93 ALA -0.74 -1.70 1 94 THR 2.90 -0.10 1 96 LYS 3.93 1.70 1 97 VAL 5.99 1.30 1 98 VAL 7.23 0.90 1 99 GLU 3.09 2.90 1 100 LYS 3.98 0.10 1 101 ILE 7.53 0.80 1 102 ALA 3.87 2.00 1 103 GLU 3.37 2.90 1 104 TYR 2.36 3.30 1 105 LYS 1.88 1.70 1 106 ARG 4.12 2.30 1 107 GLN 2.66 0.70 1 108 ASN -1.00 -1.60 1 110 THR 0.30 0.10 1 111 MET 0.77 -1.00 1 112 PHE -2.33 2.60 1 113 ALA 5.28 3.50 1 114 TRP 5.17 2.00 1 115 GLU 2.43 3.60 1 116 ILE 6.91 0.20 1 117 ARG 6.40 1.00 1 118 ASP 4.44 2.90 1 119 ARG 5.60 1.20 1 120 LEU 3.18 3.00 1 121 LEU 2.50 3.50 1 122 ALA 3.84 2.70 1 123 GLU 0.80 -0.90 1 124 ARG 6.61 -0.20 1 125 VAL 3.41 0.40 1 127 ASP -2.79 0.10 1 128 ASN 4.34 0.80 1 129 ASP 1.39 0.80 1 130 THR -1.92 -0.50 1 131 VAL -1.39 -2.20 1 133 SER -1.84 0.80 1 134 VAL 7.56 1.30 1 135 SER 4.03 4.20 1 136 SER 5.54 0.80 1 137 ILE 7.38 0.80 1 138 ASN 5.56 2.50 1 139 ARG 5.19 3.10 1 140 ILE 5.32 2.00 1 141 ILE 6.38 1.30 1 142 ARG 3.45 1.90 1 143 THR -0.31 1.40 1 144 LYS -1.00 0.20 1 145 VAL 2.48 -0.40 1 146 GLN 0.45 -0.50 1 147 GLN 0.10 -0.70 1 150 ASN 0.64 -1.00 1 151 GLN 0.84 4.30 1 stop_ save_