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 bmr17443_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.75 _LACS_plot.Line_1_terminator_val_y_1 -5.50 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.89 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 2.95 _LACS_plot.Y_axis_chem_shift_offset 2.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 HIS -3.53 -0.75 0 10 MET 3.84 -0.03 1 11 ARG 5.11 1.33 1 12 ASP 4.04 1.09 1 13 PHE 2.89 -0.90 1 14 LYS 4.40 0.87 1 15 ARG 4.25 0.80 1 16 LEU 2.63 0.15 1 17 GLN 1.99 -0.36 1 18 GLU 0.79 -1.18 1 19 ASP -0.49 -2.77 1 22 VAL 2.83 -0.73 1 24 VAL -5.46 -5.56 1 25 SER -2.53 -3.43 1 27 ALA -2.32 -2.38 1 29 SER -0.03 -2.24 1 30 GLU -3.17 -4.48 1 31 ASN -0.47 -0.60 1 33 ILE 0.99 -1.55 1 34 MET 0.85 -3.42 1 35 GLN -2.83 -2.98 1 36 TRP -3.90 -4.73 1 37 ASN -3.11 -3.14 1 38 ALA -6.75 -4.17 1 39 VAL -3.82 -3.96 1 40 ILE -5.11 -4.61 1 41 PHE -1.56 -5.17 1 44 GLU 1.02 -1.48 1 46 THR -1.70 -2.78 1 48 PHE 0.42 -1.62 1 49 GLU 1.67 -0.44 1 50 ASP 4.35 0.31 1 52 THR -3.24 -5.74 1 53 PHE -2.28 -3.58 1 54 LYS -1.62 -2.83 1 55 LEU -4.24 -2.70 1 56 VAL -4.66 -4.89 1 57 ILE -2.96 -3.86 1 58 GLU -3.47 -4.28 1 59 PHE -2.98 -2.88 1 60 SER -5.62 -4.51 1 61 GLU 2.14 -1.76 1 62 GLU -1.06 -2.69 1 63 TYR 0.94 -0.55 1 65 ASN 3.24 0.60 1 66 LYS -4.85 -4.86 1 69 THR -0.47 -2.86 1 70 VAL -2.81 -4.10 1 71 ARG -4.96 -4.24 1 72 PHE 2.65 0.01 1 73 LEU -0.40 -2.38 1 74 SER 0.39 -1.18 1 75 LYS 2.46 -1.29 1 76 MET -3.32 -5.77 1 77 PHE -0.38 -2.15 1 80 ASN -2.01 -2.17 1 81 VAL -1.60 -3.48 1 82 TYR 0.16 -1.27 1 83 ALA 3.15 -0.05 1 84 ASP 0.59 -3.20 1 86 SER 2.51 -0.57 1 87 ILE -2.10 -2.32 1 89 LEU -3.87 -3.59 1 90 ASP 5.54 1.44 1 91 ILE 3.62 0.41 1 92 LEU 0.25 -3.22 1 93 GLN 0.60 -1.84 1 94 ASN 2.15 -0.57 1 95 ARG -0.36 -3.95 1 96 TRP 1.09 -0.85 1 97 SER -4.55 -5.76 1 99 THR 1.74 -1.84 1 100 TYR -0.33 -4.03 1 101 ASP -5.22 -5.37 1 102 VAL 7.23 3.13 1 103 SER 5.57 1.97 1 104 SER 4.43 0.85 1 105 ILE 5.25 2.23 1 106 LEU 4.39 0.77 1 107 THR 5.53 1.56 1 108 SER 5.58 2.03 1 109 ILE 5.54 1.67 1 110 GLN 4.23 2.01 1 111 SER 4.12 0.81 1 112 LEU 1.10 -1.45 1 113 LEU 5.49 0.15 1 114 ASP -1.36 -1.51 1 115 GLU -2.97 -3.53 1 117 ASN -2.23 -4.16 1 119 ASN 0.74 -1.75 1 120 SER -1.80 -3.87 1 122 ALA 1.97 -1.53 1 123 ASN -1.12 -4.36 1 124 SER 1.59 1.57 1 125 GLN 4.22 0.93 1 126 ALA 4.92 -0.27 1 127 ALA 3.62 0.49 1 128 GLN 4.80 0.88 1 129 LEU 2.33 0.28 1 130 TYR 4.63 1.55 1 131 GLN 0.95 -0.54 1 132 GLU -1.32 -1.77 1 133 ASN -0.03 -3.64 1 134 LYS 4.12 0.85 1 135 ARG 4.34 0.62 1 136 GLU 1.85 -1.01 1 137 TYR 5.62 2.30 1 138 GLU 4.47 1.09 1 139 LYS 4.03 0.80 1 140 ARG 3.96 -0.69 1 141 VAL 6.19 1.94 1 143 ALA 3.35 -0.24 1 144 ILE 2.47 -1.54 1 145 VAL 6.51 2.47 1 146 GLU 2.86 -1.04 1 147 GLN 2.91 -0.12 1 148 SER 3.75 0.17 1 149 TRP -0.47 -3.73 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17443_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.75 _LACS_plot.Line_1_terminator_val_y_1 1.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.89 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 -4.27 _LACS_plot.Y_axis_chem_shift_offset 2.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 HIS -3.53 2.78 0 10 MET 3.84 -3.87 1 11 ARG 5.11 -3.78 1 12 ASP 4.04 -2.95 1 13 PHE 2.89 -3.79 1 14 LYS 4.40 -3.53 1 15 ARG 4.25 -3.45 1 16 LEU 2.63 -2.48 1 17 GLN 1.99 -2.35 1 18 GLU 0.79 -1.97 1 19 ASP -0.49 -2.28 1 22 VAL 2.83 -3.56 1 24 VAL -5.46 -0.10 1 25 SER -2.53 -0.90 1 27 ALA -2.32 -0.06 1 29 SER -0.03 -2.21 1 30 GLU -3.17 -1.31 1 31 ASN -0.47 -0.13 1 33 ILE 0.99 -2.54 1 34 MET 0.85 -4.27 1 35 GLN -2.83 -0.15 1 36 TRP -3.90 -0.83 1 37 ASN -3.11 -0.03 1 38 ALA -6.75 2.58 1 39 VAL -3.82 -0.14 1 40 ILE -5.11 0.50 1 41 PHE -1.56 -3.61 1 44 GLU 1.02 -2.50 1 46 THR -1.70 -1.08 1 48 PHE 0.42 -2.04 1 49 GLU 1.67 -2.11 1 50 ASP 4.35 -4.04 1 52 THR -3.24 -2.50 1 53 PHE -2.28 -1.30 1 54 LYS -1.62 -1.21 1 55 LEU -4.24 1.54 1 56 VAL -4.66 -0.23 1 57 ILE -2.96 -0.90 1 58 GLU -3.47 -0.81 1 59 PHE -2.98 0.10 1 60 SER -5.62 1.11 1 61 GLU 2.14 -3.90 1 62 GLU -1.06 -1.63 1 63 TYR 0.94 -1.49 1 65 ASN 3.24 -2.64 1 66 LYS -4.85 -0.01 1 69 THR -0.47 -2.39 1 70 VAL -2.81 -1.29 1 71 ARG -4.96 0.72 1 72 PHE 2.65 -2.64 1 73 LEU -0.40 -1.98 1 74 SER 0.39 -1.57 1 75 LYS 2.46 -3.75 1 76 MET -3.32 -2.45 1 77 PHE -0.38 -1.77 1 80 ASN -2.01 -0.16 1 81 VAL -1.60 -1.88 1 82 TYR 0.16 -1.43 1 83 ALA 3.15 -3.20 1 84 ASP 0.59 -3.79 1 86 SER 2.51 -3.08 1 87 ILE -2.10 -0.22 1 89 LEU -3.87 0.28 1 90 ASP 5.54 -4.10 1 91 ILE 3.62 -3.21 1 92 LEU 0.25 -3.47 1 93 GLN 0.60 -2.44 1 94 ASN 2.15 -2.72 1 95 ARG -0.36 -3.59 1 96 TRP 1.09 -1.94 1 97 SER -4.55 -1.21 1 99 THR 1.74 -3.58 1 100 TYR -0.33 -3.70 1 101 ASP -5.22 -0.15 1 102 VAL 7.23 -4.10 1 103 SER 5.57 -3.60 1 104 SER 4.43 -3.58 1 105 ILE 5.25 -3.02 1 106 LEU 4.39 -3.62 1 107 THR 5.53 -3.97 1 108 SER 5.58 -3.55 1 109 ILE 5.54 -3.87 1 110 GLN 4.23 -2.22 1 111 SER 4.12 -3.31 1 112 LEU 1.10 -2.55 1 113 LEU 5.49 -5.34 1 114 ASP -1.36 -0.15 1 115 GLU -2.97 -0.56 1 117 ASN -2.23 -1.93 1 119 ASN 0.74 -2.49 1 120 SER -1.80 -2.07 1 122 ALA 1.97 -3.50 1 123 ASN -1.12 -3.24 1 124 SER 1.59 -0.02 1 125 GLN 4.22 -3.29 1 126 ALA 4.92 -5.19 1 127 ALA 3.62 -3.13 1 128 GLN 4.80 -3.92 1 129 LEU 2.33 -2.05 1 130 TYR 4.63 -3.08 1 131 GLN 0.95 -1.49 1 132 GLU -1.32 -0.45 1 133 ASN -0.03 -3.61 1 134 LYS 4.12 -3.27 1 135 ARG 4.34 -3.72 1 136 GLU 1.85 -2.86 1 137 TYR 5.62 -3.32 1 138 GLU 4.47 -3.38 1 139 LYS 4.03 -3.23 1 140 ARG 3.96 -4.65 1 141 VAL 6.19 -4.25 1 143 ALA 3.35 -3.59 1 144 ILE 2.47 -4.01 1 145 VAL 6.51 -4.04 1 146 GLU 2.86 -3.90 1 147 GLN 2.91 -3.03 1 148 SER 3.75 -3.58 1 149 TRP -0.47 -3.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17443_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.75 _LACS_plot.Line_1_terminator_val_y_1 0.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 -0.58 _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 147 GLN 2.91 -1.76 0 10 MET 3.84 0.22 1 11 ARG 5.11 -0.06 1 12 ASP 4.04 -0.10 1 13 PHE 2.89 0.23 1 14 LYS 4.40 -0.43 1 15 ARG 4.25 -0.16 1 16 LEU 2.63 -0.22 1 17 GLN 1.99 -0.24 1 18 GLU 0.79 -0.18 1 19 ASP -0.49 0.15 1 22 VAL 2.83 -0.18 1 24 VAL -5.46 1.16 1 25 SER -2.53 0.31 1 27 ALA -2.32 -0.52 1 29 SER -0.03 -0.14 1 30 GLU -3.17 -0.45 1 31 ASN -0.47 -0.10 1 33 ILE 0.99 -0.06 1 34 MET 0.85 0.25 1 35 GLN -2.83 1.14 1 36 TRP -3.90 0.83 1 37 ASN -3.11 0.78 1 38 ALA -6.75 1.17 1 39 VAL -3.82 1.03 1 40 ILE -5.11 0.82 1 41 PHE -1.56 0.88 1 44 GLU 1.02 -0.22 1 46 THR -1.70 0.73 1 48 PHE 0.42 -0.39 1 49 GLU 1.67 -0.65 1 50 ASP 4.35 -0.07 1 52 THR -3.24 -0.05 1 53 PHE -2.28 0.45 1 54 LYS -1.62 0.90 1 55 LEU -4.24 0.95 1 56 VAL -4.66 1.12 1 57 ILE -2.96 0.45 1 58 GLU -3.47 0.79 1 59 PHE -2.98 -0.24 1 60 SER -5.62 0.54 1 61 GLU 2.14 0.03 1 62 GLU -1.06 0.18 1 63 TYR 0.94 0.01 1 65 ASN 3.24 -0.02 1 66 LYS -4.85 0.01 1 69 THR -0.47 0.04 1 70 VAL -2.81 0.61 1 71 ARG -4.96 0.54 1 72 PHE 2.65 0.06 1 73 LEU -0.40 0.19 1 74 SER 0.39 0.21 1 75 LYS 2.46 -0.21 1 76 MET -3.32 0.38 1 77 PHE -0.38 -0.13 1 78 HIS -3.53 -0.13 1 80 ASN -2.01 0.14 1 81 VAL -1.60 0.56 1 82 TYR 0.16 -0.25 1 83 ALA 3.15 0.04 1 84 ASP 0.59 0.01 1 86 SER 2.51 0.25 1 87 ILE -2.10 0.42 1 89 LEU -3.87 0.32 1 90 ASP 5.54 -0.22 1 91 ILE 3.62 -0.29 1 92 LEU 0.25 0.29 1 93 GLN 0.60 0.18 1 94 ASN 2.15 0.15 1 95 ARG -0.36 0.44 1 96 TRP 1.09 0.16 1 97 SER -4.55 -0.17 1 99 THR 1.74 -0.32 1 100 TYR -0.33 -0.01 1 101 ASP -5.22 0.49 1 102 VAL 7.23 -0.58 1 103 SER 5.57 -0.47 1 104 SER 4.43 -0.08 1 105 ILE 5.25 -0.58 1 106 LEU 4.39 -0.38 1 107 THR 5.53 -0.15 1 108 SER 5.58 -0.08 1 109 ILE 5.54 -0.63 1 110 GLN 4.23 -0.59 1 111 SER 4.12 -0.09 1 112 LEU 1.10 -0.12 1 113 LEU 5.49 -0.79 1 114 ASP -1.36 0.26 1 115 GLU -2.97 0.20 1 117 ASN -2.23 0.20 1 119 ASN 0.74 -0.06 1 120 SER -1.80 0.03 1 122 ALA 1.97 -0.45 1 123 ASN -1.12 0.13 1 125 GLN 4.22 -0.01 1 126 ALA 4.92 -0.45 1 127 ALA 3.62 -0.55 1 128 GLN 4.80 -0.19 1 129 LEU 2.33 -0.21 1 130 TYR 4.63 -1.32 1 131 GLN 0.95 -0.28 1 132 GLU -1.32 0.11 1 133 ASN -0.03 0.13 1 134 LYS 4.12 -0.33 1 135 ARG 4.34 -0.08 1 136 GLU 1.85 -0.13 1 137 TYR 5.62 -0.45 1 138 GLU 4.47 -0.75 1 139 LYS 4.03 -0.25 1 140 ARG 3.96 -0.49 1 141 VAL 6.19 -0.71 1 143 ALA 3.35 -0.07 1 144 ILE 2.47 -0.06 1 145 VAL 6.51 -0.64 1 146 GLU 2.86 -0.27 1 148 SER 3.75 -0.03 1 149 TRP -0.47 0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17443_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.75 _LACS_plot.Line_1_terminator_val_y_1 -5.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.54 _LACS_plot.Line_2_terminator_val_x_2 7.22 _LACS_plot.Line_2_terminator_val_y_2 0.17 _LACS_plot.Y_axis_chem_shift_offset 2.72 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 SER -5.62 -2.00 0 77 PHE -0.38 -7.45 0 10 MET 3.84 0.74 1 11 ARG 5.11 0.54 1 12 ASP 4.04 1.49 1 13 PHE 2.89 -1.87 1 14 LYS 4.40 -0.19 1 15 ARG 4.25 -0.25 1 16 LEU 2.63 -2.44 1 17 GLN 1.99 -0.21 1 18 GLU 0.79 -2.40 1 19 ASP -0.49 -6.04 1 22 VAL 2.83 -0.61 1 24 VAL -5.46 -4.65 1 25 SER -2.53 -4.17 1 27 ALA -2.32 -5.13 1 29 SER -0.03 -2.46 1 31 ASN -0.47 -2.07 1 33 ILE 0.99 -5.59 1 34 MET 0.85 -2.79 1 35 GLN -2.83 -4.62 1 36 TRP -3.90 -3.42 1 37 ASN -3.11 -4.03 1 38 ALA -6.75 -4.94 1 39 VAL -3.82 -4.02 1 40 ILE -5.11 -3.92 1 44 GLU 1.02 -1.56 1 46 THR -1.70 -0.51 1 48 PHE 0.42 -3.87 1 49 GLU 1.67 -3.86 1 50 ASP 4.35 -1.53 1 52 THR -3.24 -3.16 1 53 PHE -2.28 -4.26 1 54 LYS -1.62 -1.94 1 55 LEU -4.24 -5.23 1 56 VAL -4.66 -5.37 1 57 ILE -2.96 -4.64 1 58 GLU -3.47 -3.89 1 59 PHE -2.98 -5.12 1 61 GLU 2.14 -2.50 1 62 GLU -1.06 -1.72 1 63 TYR 0.94 -2.89 1 65 ASN 3.24 -2.91 1 69 THR -0.47 -3.48 1 70 VAL -2.81 -4.82 1 71 ARG -4.96 -2.88 1 72 PHE 2.65 -1.98 1 73 LEU -0.40 -0.95 1 74 SER 0.39 -4.03 1 75 LYS 2.46 -3.48 1 76 MET -3.32 -5.65 1 80 ASN -2.01 -5.89 1 81 VAL -1.60 -3.40 1 82 TYR 0.16 0.49 1 83 ALA 3.15 -2.20 1 84 ASP 0.59 -2.23 1 86 SER 2.51 -4.08 1 87 ILE -2.10 -3.62 1 89 LEU -3.87 -7.52 1 90 ASP 5.54 1.14 1 91 ILE 3.62 -4.89 1 92 LEU 0.25 -3.36 1 93 GLN 0.60 -2.36 1 94 ASN 2.15 -1.90 1 95 ARG -0.36 -3.88 1 96 TRP 1.09 -3.04 1 99 THR 1.74 -1.34 1 100 TYR -0.33 -5.25 1 101 ASP -5.22 -2.04 1 102 VAL 7.23 -1.56 1 103 SER 5.57 -1.16 1 104 SER 4.43 0.48 1 106 LEU 4.39 -0.78 1 107 THR 5.53 0.83 1 108 SER 5.58 -0.28 1 109 ILE 5.54 -2.19 1 110 GLN 4.23 -0.46 1 111 SER 4.12 -1.27 1 112 LEU 1.10 -0.56 1 113 LEU 5.49 -3.85 1 114 ASP -1.36 -3.62 1 119 ASN 0.74 -3.01 1 122 ALA 1.97 -3.51 1 125 GLN 4.22 -0.19 1 126 ALA 4.92 -1.64 1 127 ALA 3.62 -1.53 1 128 GLN 4.80 -0.01 1 129 LEU 2.33 -1.94 1 130 TYR 4.63 -2.70 1 131 GLN 0.95 -0.42 1 132 GLU -1.32 -2.08 1 133 ASN -0.03 -4.22 1 134 LYS 4.12 -0.67 1 135 ARG 4.34 0.48 1 136 GLU 1.85 -0.24 1 137 TYR 5.62 -2.14 1 138 GLU 4.47 -0.09 1 139 LYS 4.03 0.70 1 140 ARG 3.96 0.94 1 141 VAL 6.19 -0.80 1 143 ALA 3.35 -0.08 1 144 ILE 2.47 0.81 1 145 VAL 6.51 -0.82 1 146 GLU 2.86 0.00 1 147 GLN 2.91 -0.67 1 148 SER 3.75 -1.89 1 149 TRP -0.47 -2.75 1 stop_ save_