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 bmr25871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 5.69 _LACS_plot.Line_2_terminator_val_y_2 4.39 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ARG 5.44 0.98 0 128 TYR -5.50 -0.95 0 125 MET -4.75 -0.22 0 104 ILE -6.31 -1.64 0 10 ASN 3.85 2.86 1 11 GLU 3.41 2.92 1 12 PHE 3.06 0.94 1 13 ARG 1.34 0.80 1 14 ALA 4.01 2.92 1 15 SER 5.44 4.75 1 16 PHE 4.09 4.65 1 17 ASN 3.67 2.70 1 18 HIS 3.42 4.47 1 19 PHE 1.98 2.37 1 20 ASP 0.83 -1.59 1 21 ARG 3.46 2.63 1 22 ASP -0.12 -1.72 1 23 HIS 3.91 1.49 1 24 SER -0.02 1.41 1 26 THR -5.90 -2.68 1 27 LEU -5.16 -2.35 1 30 GLU 4.24 3.17 1 31 GLU 2.62 3.02 1 32 PHE 2.27 1.40 1 33 LYS 5.70 4.28 1 34 ALA 3.62 2.47 1 36 LEU 5.12 3.25 1 37 ILE 4.96 4.42 1 38 SER 4.39 3.54 1 39 LEU -0.24 -0.02 1 41 TYR 1.88 1.47 1 42 ASP 0.34 -0.64 1 43 ILE -1.23 -1.61 1 45 ASN 0.38 -1.05 1 46 ASP 1.33 0.17 1 48 GLN 5.46 3.73 1 50 GLU 3.09 2.83 1 51 ALA 3.65 2.45 1 52 GLU 3.19 1.87 1 53 PHE 5.05 3.92 1 54 ALA 3.98 2.52 1 55 ARG 4.28 3.64 1 56 ILE 5.55 5.08 1 57 MET 4.25 0.80 1 58 SER 3.71 2.93 1 59 ILE 2.75 2.84 1 60 VAL 1.47 0.98 1 61 ASP -0.90 -0.47 1 63 ASN 0.82 0.13 1 65 LEU 0.57 1.06 1 67 VAL -6.19 -2.79 1 68 VAL -0.52 -0.52 1 69 THR 0.82 0.73 1 70 PHE 5.24 4.08 1 71 GLN 3.85 2.85 1 72 ALA 2.45 2.59 1 73 PHE 3.37 2.80 1 74 ILE 4.09 1.08 1 75 ASP 4.56 3.70 1 76 PHE 3.73 3.42 1 77 MET 2.98 0.53 1 78 SER 2.58 2.11 1 79 ARG 1.98 1.47 1 80 GLU 0.24 0.87 1 81 THR 0.31 0.39 1 82 ALA -0.04 0.32 1 83 ASP 0.47 0.24 1 84 THR 0.54 0.48 1 85 ASP 0.34 0.39 1 86 THR 0.79 0.53 1 87 ALA 2.37 1.97 1 88 ASP 2.12 1.95 1 89 GLN 3.06 2.25 1 90 VAL 4.27 3.12 1 91 MET 3.40 2.61 1 92 ALA 3.09 2.12 1 93 SER 3.87 2.74 1 94 PHE 2.08 0.73 1 95 LYS 4.14 3.22 1 96 ILE 3.51 2.62 1 97 LEU 1.97 2.07 1 98 ALA 0.63 0.92 1 100 ASP 0.90 0.38 1 101 LYS -0.88 -0.23 1 102 ASN 0.24 0.60 1 103 TYR -4.60 -2.77 1 105 THR -3.09 -1.42 1 106 MET 4.78 4.99 1 107 ASP 3.72 3.29 1 108 GLU 3.29 3.15 1 109 LEU 3.46 3.58 1 110 ARG 3.36 2.60 1 111 ARG 2.17 2.38 1 112 GLU -1.39 0.39 1 113 LEU -1.75 -0.81 1 116 ASP 4.72 2.86 1 117 GLN 2.74 2.68 1 118 ALA 5.03 3.91 1 119 GLU 3.41 2.18 1 120 TYR 3.31 3.25 1 122 ILE 4.71 4.63 1 123 ALA 0.96 0.93 1 124 ARG -0.12 0.44 1 126 ALA -1.77 -1.22 1 132 ASP 0.70 -1.25 1 133 SER 1.39 0.88 1 134 VAL -2.05 -1.73 1 137 ALA -0.69 0.76 1 138 LEU -3.25 -0.81 1 139 ASP -1.77 -2.07 1 140 TYR 2.94 1.66 1 141 MET 1.36 0.80 1 142 SER 0.18 0.66 1 143 PHE 1.05 1.75 1 144 SER -1.73 -0.85 1 145 THR 2.28 1.57 1 146 ALA -0.55 -0.34 1 147 LEU 0.46 0.40 1 148 TYR 1.07 0.89 1 150 GLU -0.71 -0.01 1 151 SER -0.34 0.03 1 152 ASP 0.45 0.33 1 153 LEU 0.74 1.82 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 3.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.71 _LACS_plot.Line_2_terminator_val_x_2 5.69 _LACS_plot.Line_2_terminator_val_y_2 -1.30 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 ARG 5.44 -4.46 0 128 TYR -5.50 4.55 0 125 MET -4.75 4.53 0 104 ILE -6.31 4.67 0 10 ASN 3.85 -0.99 1 11 GLU 3.41 -0.49 1 12 PHE 3.06 -2.12 1 13 ARG 1.34 -0.54 1 14 ALA 4.01 -1.09 1 15 SER 5.44 -0.69 1 16 PHE 4.09 0.56 1 17 ASN 3.67 -0.97 1 18 HIS 3.42 1.05 1 19 PHE 1.98 0.39 1 20 ASP 0.83 -2.42 1 21 ARG 3.46 -0.83 1 22 ASP -0.12 -1.60 1 23 HIS 3.91 -2.42 1 24 SER -0.02 1.43 1 26 THR -5.90 3.22 1 27 LEU -5.16 2.81 1 30 GLU 4.24 -1.07 1 31 GLU 2.62 0.40 1 32 PHE 2.27 -0.87 1 33 LYS 5.70 -1.42 1 34 ALA 3.62 -1.15 1 36 LEU 5.12 -1.87 1 37 ILE 4.96 -0.54 1 38 SER 4.39 -0.85 1 39 LEU -0.24 0.22 1 41 TYR 1.88 -0.41 1 42 ASP 0.34 -0.98 1 43 ILE -1.23 -0.38 1 45 ASN 0.38 -1.43 1 46 ASP 1.33 -1.16 1 48 GLN 5.46 -1.73 1 50 GLU 3.09 -0.26 1 51 ALA 3.65 -1.20 1 52 GLU 3.19 -1.32 1 53 PHE 5.05 -1.13 1 54 ALA 3.98 -1.46 1 55 ARG 4.28 -0.64 1 56 ILE 5.55 -0.47 1 57 MET 4.25 -3.45 1 58 SER 3.71 -0.78 1 59 ILE 2.75 0.09 1 60 VAL 1.47 -0.49 1 61 ASP -0.90 0.43 1 63 ASN 0.82 -0.69 1 65 LEU 0.57 0.49 1 67 VAL -6.19 3.40 1 68 VAL -0.52 0.00 1 69 THR 0.82 -0.09 1 70 PHE 5.24 -1.16 1 71 GLN 3.85 -1.00 1 72 ALA 2.45 0.14 1 73 PHE 3.37 -0.57 1 74 ILE 4.09 -3.01 1 75 ASP 4.56 -0.86 1 76 PHE 3.73 -0.31 1 77 MET 2.98 -2.45 1 78 SER 2.58 -0.47 1 79 ARG 1.98 -0.51 1 80 GLU 0.24 0.63 1 81 THR 0.31 0.08 1 82 ALA -0.04 0.36 1 83 ASP 0.47 -0.23 1 84 THR 0.54 -0.06 1 85 ASP 0.34 0.05 1 86 THR 0.79 -0.26 1 87 ALA 2.37 -0.40 1 88 ASP 2.12 -0.17 1 89 GLN 3.06 -0.81 1 90 VAL 4.27 -1.15 1 91 MET 3.40 -0.79 1 92 ALA 3.09 -0.97 1 93 SER 3.87 -1.13 1 94 PHE 2.08 -1.35 1 95 LYS 4.14 -0.92 1 96 ILE 3.51 -0.89 1 97 LEU 1.97 0.10 1 98 ALA 0.63 0.29 1 100 ASP 0.90 -0.52 1 101 LYS -0.88 0.65 1 102 ASN 0.24 0.36 1 103 TYR -4.60 1.83 1 105 THR -3.09 1.67 1 106 MET 4.78 0.21 1 107 ASP 3.72 -0.43 1 108 GLU 3.29 -0.14 1 109 LEU 3.46 0.12 1 110 ARG 3.36 -0.76 1 111 ARG 2.17 0.21 1 112 GLU -1.39 1.78 1 113 LEU -1.75 0.94 1 116 ASP 4.72 -1.86 1 117 GLN 2.74 -0.06 1 118 ALA 5.03 -1.12 1 119 GLU 3.41 -1.23 1 120 TYR 3.31 -0.06 1 122 ILE 4.71 -0.08 1 123 ALA 0.96 -0.03 1 124 ARG -0.12 0.56 1 126 ALA -1.77 0.55 1 132 ASP 0.70 -1.95 1 133 SER 1.39 -0.51 1 134 VAL -2.05 0.32 1 137 ALA -0.69 1.45 1 138 LEU -3.25 2.44 1 139 ASP -1.77 -0.30 1 140 TYR 2.94 -1.28 1 141 MET 1.36 -0.56 1 142 SER 0.18 0.48 1 143 PHE 1.05 0.70 1 144 SER -1.73 0.88 1 145 THR 2.28 -0.71 1 146 ALA -0.55 0.21 1 147 LEU 0.46 -0.06 1 148 TYR 1.07 -0.18 1 150 GLU -0.71 0.70 1 151 SER -0.34 0.37 1 152 ASP 0.45 -0.12 1 153 LEU 0.74 1.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25871_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 0.61 _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 5.69 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _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 128 TYR -5.50 -0.39 0 10 ASN 3.85 -0.24 1 11 GLU 3.41 -0.10 1 12 PHE 3.06 0.36 1 13 ARG 1.34 -0.19 1 14 ALA 4.01 -0.07 1 15 SER 5.44 -0.02 1 16 PHE 4.09 -0.63 1 17 ASN 3.67 -0.21 1 18 HIS 3.42 -0.61 1 19 PHE 1.98 -0.51 1 20 ASP 0.83 -0.02 1 21 ARG 3.46 -0.51 1 22 ASP -0.12 -0.16 1 23 HIS 3.91 -0.49 1 24 SER -0.02 -0.03 1 26 THR -5.90 0.85 1 27 LEU -5.16 0.48 1 30 GLU 4.24 -0.42 1 31 GLU 2.62 -0.24 1 32 PHE 2.27 -0.38 1 33 LYS 5.70 -1.14 1 34 ALA 3.62 -0.53 1 36 LEU 5.12 -0.50 1 37 ILE 4.96 0.06 1 38 SER 4.39 -0.04 1 39 LEU -0.24 0.30 1 41 TYR 1.88 -0.38 1 42 ASP 0.34 0.05 1 43 ILE -1.23 0.08 1 45 ASN 0.38 0.19 1 46 ASP 1.33 -0.11 1 48 GLN 5.46 -0.16 1 50 GLU 3.09 -0.19 1 51 ALA 3.65 -0.05 1 52 GLU 3.19 0.40 1 53 PHE 5.05 -0.42 1 54 ALA 3.98 -0.41 1 55 ARG 4.28 -0.40 1 56 ILE 5.55 -0.86 1 57 MET 4.25 -0.21 1 58 SER 3.71 -0.34 1 59 ILE 2.75 -0.30 1 60 VAL 1.47 0.09 1 61 ASP -0.90 0.33 1 63 ASN 0.82 0.04 1 64 ARG 5.44 -0.49 1 65 LEU 0.57 -0.13 1 67 VAL -6.19 0.46 1 68 VAL -0.52 0.07 1 69 THR 0.82 0.43 1 70 PHE 5.24 -1.12 1 71 GLN 3.85 -0.72 1 72 ALA 2.45 -0.17 1 73 PHE 3.37 -0.44 1 74 ILE 4.09 -1.02 1 75 ASP 4.56 -0.40 1 76 PHE 3.73 -0.45 1 77 MET 2.98 -0.62 1 78 SER 2.58 -0.26 1 79 ARG 1.98 -0.18 1 80 GLU 0.24 -0.19 1 81 THR 0.31 -0.04 1 82 ALA -0.04 0.01 1 83 ASP 0.47 0.00 1 84 THR 0.54 -0.05 1 85 ASP 0.34 0.01 1 86 THR 0.79 -0.04 1 87 ALA 2.37 -0.12 1 88 ASP 2.12 -0.18 1 89 GLN 3.06 -0.22 1 90 VAL 4.27 -0.57 1 91 MET 3.40 -0.45 1 92 ALA 3.09 -0.24 1 93 SER 3.87 -0.29 1 94 PHE 2.08 -0.39 1 95 LYS 4.14 -0.70 1 96 ILE 3.51 -0.40 1 97 LEU 1.97 -0.35 1 98 ALA 0.63 -0.40 1 100 ASP 0.90 -0.12 1 101 LYS -0.88 0.01 1 102 ASN 0.24 -0.10 1 103 TYR -4.60 0.46 1 104 ILE -6.31 0.63 1 105 THR -3.09 1.04 1 106 MET 4.78 -0.63 1 107 ASP 3.72 -0.33 1 108 GLU 3.29 -0.46 1 109 LEU 3.46 -0.48 1 110 ARG 3.36 -0.38 1 111 ARG 2.17 -0.11 1 112 GLU -1.39 0.03 1 113 LEU -1.75 0.25 1 116 ASP 4.72 -0.26 1 117 GLN 2.74 -0.10 1 118 ALA 5.03 -0.49 1 119 GLU 3.41 -0.29 1 120 TYR 3.31 -0.42 1 122 ILE 4.71 -0.81 1 123 ALA 0.96 -0.07 1 124 ARG -0.12 -0.05 1 125 MET -4.75 0.12 1 126 ALA -1.77 -0.69 1 132 ASP 0.70 0.00 1 133 SER 1.39 -0.94 1 134 VAL -2.05 0.31 1 137 ALA -0.69 -0.18 1 138 LEU -3.25 0.46 1 139 ASP -1.77 0.28 1 140 TYR 2.94 0.07 1 141 MET 1.36 0.14 1 142 SER 0.18 0.03 1 143 PHE 1.05 0.13 1 144 SER -1.73 -0.13 1 145 THR 2.28 -0.34 1 146 ALA -0.55 -0.05 1 147 LEU 0.46 -0.29 1 148 TYR 1.07 -0.15 1 150 GLU -0.71 -0.06 1 151 SER -0.34 -0.02 1 152 ASP 0.45 0.01 1 153 LEU 0.74 -0.19 1 stop_ save_