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 bmr17374_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 -2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.07 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 4.72 _LACS_plot.Y_axis_chem_shift_offset 0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ILE 4.79 -0.35 0 10 ALA -0.34 -0.57 1 11 MET 0.85 0.01 1 12 SER -0.18 -0.28 1 14 VAL -0.73 -0.97 1 15 SER -4.37 -2.56 1 16 VAL 0.61 -0.06 1 17 ALA 0.37 0.34 1 18 ASP 4.61 3.50 1 19 GLU 3.57 1.70 1 21 VAL 5.99 4.07 1 22 THR 5.10 3.61 1 23 ALA 3.36 2.37 1 24 LEU 4.46 2.75 1 25 ASN 4.50 2.96 1 27 LEU 4.30 3.07 1 28 ARG 4.46 3.39 1 29 HIS 1.18 0.50 1 30 LYS 6.73 1.65 1 31 LYS 0.91 0.12 1 32 SER -4.27 -3.15 1 33 ARG -2.66 -2.11 1 34 TYR -6.60 -3.22 1 35 VAL -3.97 -0.41 1 36 ILE 0.29 -1.53 1 37 MET -5.85 -1.03 1 38 HIS -7.22 -2.09 1 39 ILE 0.39 -0.66 1 40 VAL -2.01 -1.77 1 41 ASP 2.48 1.06 1 42 GLN 3.98 1.83 1 43 LYS -2.29 0.83 1 44 SER -4.26 -2.65 1 45 ILE 2.03 0.88 1 46 ALA -6.56 -2.48 1 47 VAL 2.82 2.06 1 48 LYS -0.07 1.45 1 49 THR -1.98 -0.49 1 50 ILE -2.38 -0.83 1 52 GLU 0.21 -0.71 1 53 ARG 3.14 1.42 1 55 ALA -0.36 -0.09 1 56 ASN -4.46 -3.09 1 57 PHE 4.98 4.51 1 58 ASP 4.64 3.11 1 59 GLN 4.00 3.07 1 60 PHE 2.21 0.58 1 62 GLU 2.65 1.63 1 63 ALA 1.25 -0.29 1 64 ILE 1.08 -0.01 1 65 ASP -0.05 -0.50 1 66 LYS 2.89 -0.08 1 67 ASN -0.93 0.34 1 68 VAL -3.65 -2.10 1 71 TYR -3.26 -2.05 1 72 ALA -4.01 -1.78 1 73 ALA -4.85 -2.54 1 74 PHE -6.31 -1.71 1 75 ASP 0.00 -1.35 1 76 PHE -1.37 0.48 1 77 GLU -2.47 -1.58 1 78 TYR -2.53 -2.60 1 79 THR -0.80 -0.24 1 81 ASN 3.71 2.06 1 82 ASP -0.92 -0.51 1 85 ARG -5.72 -2.79 1 86 ASP -4.04 -1.69 1 87 LYS -4.57 -1.20 1 88 LEU 1.65 -0.64 1 89 ILE -4.37 -2.55 1 90 LEU -3.47 -2.18 1 91 ILE -1.35 -0.87 1 92 SER 1.33 -0.07 1 93 TRP -2.18 -1.14 1 96 ASP 3.30 2.52 1 97 SER 0.45 -0.27 1 99 ALA -0.40 -1.08 1 101 ARG 5.31 3.30 1 102 THR 5.41 3.73 1 103 LYS 4.22 3.01 1 104 MET 3.60 2.08 1 105 LEU 4.02 2.84 1 106 TYR 5.05 3.24 1 107 SER -0.97 -2.74 1 108 SER 3.28 2.53 1 109 SER 2.03 1.24 1 110 ARG 3.69 2.45 1 111 ASP 3.72 2.23 1 112 ALA 2.97 1.57 1 113 LEU -1.16 -0.83 1 114 VAL -1.97 -0.55 1 116 LEU -0.60 -2.68 1 117 THR 4.13 2.13 1 118 GLN -1.22 -1.84 1 120 PHE 0.15 -0.55 1 121 GLN -4.21 -1.28 1 123 ILE -1.39 -0.80 1 124 GLN -3.11 -0.86 1 125 ALA -2.30 -1.05 1 126 ASN -3.08 -1.60 1 127 ASP 4.36 2.99 1 128 ALA 4.86 3.12 1 129 SER -1.00 -2.55 1 131 LEU -2.09 0.22 1 132 ASP 4.93 4.49 1 133 PHE 3.53 2.08 1 134 GLU 2.49 1.43 1 135 GLU 6.16 3.06 1 136 ILE 5.13 3.75 1 137 SER 4.49 3.39 1 138 ARG 3.85 2.92 1 139 LYS 4.26 2.58 1 140 VAL 3.12 2.15 1 141 LYS 0.65 0.56 1 142 SER 0.14 0.14 1 143 ASN 1.29 1.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17374_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 4.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.07 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -2.01 _LACS_plot.Y_axis_chem_shift_offset 0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ILE 4.79 -5.14 0 10 ALA -0.34 -0.23 1 11 MET 0.85 -0.84 1 12 SER -0.18 -0.10 1 14 VAL -0.73 -0.24 1 15 SER -4.37 1.81 1 16 VAL 0.61 -0.67 1 17 ALA 0.37 -0.03 1 18 ASP 4.61 -1.11 1 19 GLU 3.57 -1.87 1 21 VAL 5.99 -1.92 1 22 THR 5.10 -1.49 1 23 ALA 3.36 -0.99 1 24 LEU 4.46 -1.71 1 25 ASN 4.50 -1.54 1 27 LEU 4.30 -1.23 1 28 ARG 4.46 -1.07 1 29 HIS 1.18 -0.68 1 30 LYS 6.73 -5.08 1 31 LYS 0.91 -0.79 1 32 SER -4.27 1.12 1 33 ARG -2.66 0.55 1 34 TYR -6.60 3.38 1 35 VAL -3.97 3.56 1 36 ILE 0.29 -1.82 1 37 MET -5.85 4.82 1 38 HIS -7.22 5.13 1 39 ILE 0.39 -1.05 1 40 VAL -2.01 0.24 1 41 ASP 2.48 -1.42 1 42 GLN 3.98 -2.15 1 43 LYS -2.29 3.12 1 44 SER -4.26 1.61 1 45 ILE 2.03 -1.15 1 46 ALA -6.56 4.08 1 47 VAL 2.82 -0.76 1 48 LYS -0.07 1.52 1 49 THR -1.98 1.49 1 50 ILE -2.38 1.55 1 52 GLU 0.21 -0.92 1 53 ARG 3.14 -1.72 1 55 ALA -0.36 0.27 1 56 ASN -4.46 1.37 1 57 PHE 4.98 -0.47 1 58 ASP 4.64 -1.53 1 59 GLN 4.00 -0.93 1 60 PHE 2.21 -1.63 1 62 GLU 2.65 -1.02 1 63 ALA 1.25 -1.54 1 64 ILE 1.08 -1.09 1 65 ASP -0.05 -0.45 1 66 LYS 2.89 -2.97 1 67 ASN -0.93 1.27 1 68 VAL -3.65 1.55 1 71 TYR -3.26 1.21 1 72 ALA -4.01 2.23 1 73 ALA -4.85 2.31 1 74 PHE -6.31 4.60 1 75 ASP 0.00 -1.35 1 76 PHE -1.37 1.85 1 77 GLU -2.47 0.89 1 78 TYR -2.53 -0.07 1 79 THR -0.80 0.56 1 81 ASN 3.71 -1.65 1 82 ASP -0.92 0.41 1 85 ARG -5.72 2.93 1 86 ASP -4.04 2.35 1 87 LYS -4.57 3.37 1 88 LEU 1.65 -2.29 1 89 ILE -4.37 1.82 1 90 LEU -3.47 1.29 1 91 ILE -1.35 0.48 1 92 SER 1.33 -1.40 1 93 TRP -2.18 1.04 1 96 ASP 3.30 -0.78 1 97 SER 0.45 -0.72 1 99 ALA -0.40 -0.68 1 101 ARG 5.31 -2.01 1 102 THR 5.41 -1.68 1 103 LYS 4.22 -1.21 1 104 MET 3.60 -1.52 1 105 LEU 4.02 -1.18 1 106 TYR 5.05 -1.81 1 107 SER -0.97 -1.77 1 108 SER 3.28 -0.75 1 109 SER 2.03 -0.79 1 110 ARG 3.69 -1.24 1 111 ASP 3.72 -1.49 1 112 ALA 2.97 -1.40 1 113 LEU -1.16 0.33 1 114 VAL -1.97 1.42 1 116 LEU -0.60 -2.08 1 117 THR 4.13 -2.00 1 118 GLN -1.22 -0.62 1 120 PHE 0.15 -0.70 1 121 GLN -4.21 2.93 1 123 ILE -1.39 0.59 1 124 GLN -3.11 2.25 1 125 ALA -2.30 1.25 1 126 ASN -3.08 1.48 1 127 ASP 4.36 -1.37 1 128 ALA 4.86 -1.74 1 129 SER -1.00 -1.55 1 131 LEU -2.09 2.31 1 132 ASP 4.93 -0.44 1 133 PHE 3.53 -1.45 1 134 GLU 2.49 -1.06 1 135 GLU 6.16 -3.10 1 136 ILE 5.13 -1.38 1 137 SER 4.49 -1.10 1 138 ARG 3.85 -0.93 1 139 LYS 4.26 -1.68 1 140 VAL 3.12 -0.97 1 141 LYS 0.65 -0.09 1 142 SER 0.14 0.00 1 143 ASN 1.29 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17374_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 0.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 ILE 4.79 -1.46 0 60 PHE 2.21 -1.31 0 73 ALA -4.85 1.63 0 10 ALA -0.34 -0.01 1 11 MET 0.85 -0.04 1 12 SER -0.18 -0.09 1 14 VAL -0.73 0.22 1 15 SER -4.37 0.33 1 16 VAL 0.61 0.04 1 17 ALA 0.37 0.07 1 18 ASP 4.61 -0.28 1 19 GLU 3.57 -0.06 1 21 VAL 5.99 -0.63 1 22 THR 5.10 -0.40 1 23 ALA 3.36 -0.17 1 24 LEU 4.46 -0.18 1 25 ASN 4.50 -0.26 1 27 LEU 4.30 -0.18 1 28 ARG 4.46 -0.51 1 29 HIS 1.18 -0.11 1 30 LYS 6.73 -0.51 1 31 LYS 0.91 -0.07 1 32 SER -4.27 -0.11 1 33 ARG -2.66 0.03 1 34 TYR -6.60 0.83 1 35 VAL -3.97 0.64 1 36 ILE 0.29 0.90 1 37 MET -5.85 0.99 1 38 HIS -7.22 0.69 1 39 ILE 0.39 0.66 1 40 VAL -2.01 0.05 1 41 ASP 2.48 -0.34 1 42 GLN 3.98 -0.99 1 43 LYS -2.29 0.42 1 44 SER -4.26 0.99 1 45 ILE 2.03 0.33 1 46 ALA -6.56 0.43 1 47 VAL 2.82 -0.37 1 48 LYS -0.07 -0.20 1 49 THR -1.98 0.23 1 50 ILE -2.38 0.41 1 52 GLU 0.21 -0.14 1 53 ARG 3.14 -0.64 1 55 ALA -0.36 0.14 1 56 ASN -4.46 0.43 1 57 PHE 4.98 -0.55 1 58 ASP 4.64 -0.38 1 59 GLN 4.00 -0.42 1 62 GLU 2.65 -0.60 1 63 ALA 1.25 -0.31 1 64 ILE 1.08 -0.86 1 65 ASP -0.05 -0.21 1 66 LYS 2.89 -0.10 1 67 ASN -0.93 -0.02 1 68 VAL -3.65 0.33 1 71 TYR -3.26 1.12 1 72 ALA -4.01 1.18 1 74 PHE -6.31 0.47 1 75 ASP 0.00 0.19 1 76 PHE -1.37 -0.29 1 77 GLU -2.47 0.65 1 78 TYR -2.53 0.41 1 79 THR -0.80 0.19 1 81 ASN 3.71 -0.27 1 82 ASP -0.92 0.16 1 85 ARG -5.72 0.16 1 86 ASP -4.04 1.07 1 87 LYS -4.57 0.25 1 88 LEU 1.65 0.34 1 89 ILE -4.37 1.32 1 90 LEU -3.47 0.84 1 91 ILE -1.35 0.91 1 92 SER 1.33 0.51 1 93 TRP -2.18 0.34 1 96 ASP 3.30 -0.45 1 97 SER 0.45 -0.19 1 99 ALA -0.40 -0.04 1 101 ARG 5.31 -0.22 1 102 THR 5.41 -0.06 1 103 LYS 4.22 0.04 1 104 MET 3.60 -0.16 1 105 LEU 4.02 -0.21 1 106 TYR 5.05 -0.38 1 107 SER -0.97 -0.07 1 108 SER 3.28 -0.49 1 109 SER 2.03 0.04 1 110 ARG 3.69 -0.81 1 111 ASP 3.72 -0.24 1 112 ALA 2.97 -0.29 1 113 LEU -1.16 -0.30 1 114 VAL -1.97 0.16 1 116 LEU -0.60 -0.28 1 117 THR 4.13 -0.05 1 118 GLN -1.22 0.16 1 120 PHE 0.15 0.16 1 121 GLN -4.21 0.21 1 123 ILE -1.39 0.44 1 124 GLN -3.11 0.49 1 125 ALA -2.30 -0.39 1 126 ASN -3.08 0.10 1 127 ASP 4.36 -0.37 1 128 ALA 4.86 -0.20 1 129 SER -1.00 0.04 1 131 LEU -2.09 -0.13 1 132 ASP 4.93 -1.10 1 133 PHE 3.53 -0.48 1 134 GLU 2.49 -0.12 1 135 GLU 6.16 -0.77 1 136 ILE 4.49 -0.50 1 138 ARG 3.85 -0.41 1 139 LYS 4.26 -0.19 1 140 VAL 3.12 -0.44 1 141 LYS 0.65 -0.11 1 142 SER 0.14 -0.05 1 143 ASN 1.29 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17374_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.22 _LACS_plot.Line_1_terminator_val_y_1 -3.26 _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 -1.12 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 2.66 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 30 LYS 6.73 -1.01 0 45 ILE 2.03 -3.83 0 10 ALA -0.34 0.08 1 11 MET 0.85 0.07 1 12 SER -0.18 0.37 1 14 VAL -0.73 -1.21 1 15 SER -4.37 -1.78 1 16 VAL 0.61 -0.63 1 17 ALA 0.37 1.42 1 18 ASP 4.61 2.43 1 19 GLU 3.57 2.25 1 21 VAL 5.99 2.95 1 22 THR 5.10 1.60 1 23 ALA 3.36 3.55 1 24 LEU 4.46 1.04 1 25 ASN 4.50 3.00 1 27 LEU 4.30 2.47 1 28 ARG 4.46 1.80 1 29 HIS 1.18 -0.93 1 31 LYS 0.91 -1.08 1 32 SER -4.27 -1.99 1 33 ARG -2.66 -2.78 1 34 TYR -6.60 -2.34 1 35 VAL -3.97 -1.80 1 36 ILE 0.29 -0.75 1 37 MET -5.85 -2.21 1 38 HIS -7.22 -1.98 1 39 ILE 0.39 -0.23 1 40 VAL -2.01 -0.14 1 41 ASP 2.48 -2.30 1 42 GLN 3.98 -1.28 1 43 LYS -2.29 -1.35 1 44 SER -4.26 -1.05 1 46 ALA -6.56 -0.91 1 47 VAL 2.82 -0.84 1 48 LYS -0.07 -0.12 1 49 THR -1.98 -3.44 1 50 ILE -2.38 -1.03 1 52 GLU 0.21 -0.44 1 53 ARG 3.14 -0.34 1 55 ALA -0.36 -1.15 1 56 ASN -4.46 0.37 1 57 PHE 4.98 0.16 1 58 ASP 4.64 3.13 1 59 GLN 4.00 2.35 1 60 PHE 2.21 -0.93 1 61 ILE 4.79 4.10 1 62 GLU 2.65 0.24 1 63 ALA 1.25 -1.03 1 64 ILE 1.08 -1.97 1 65 ASP -0.05 2.05 1 66 LYS 2.89 0.11 1 67 ASN -0.93 -0.29 1 68 VAL -3.65 -2.80 1 71 TYR -3.26 -1.63 1 72 ALA -4.01 -3.54 1 73 ALA -4.85 -1.54 1 74 PHE -6.31 -3.39 1 75 ASP 0.00 -3.59 1 76 PHE -1.37 -2.52 1 77 GLU -2.47 -1.38 1 78 TYR -2.53 -2.99 1 79 THR -0.80 -1.03 1 81 ASN 3.71 0.17 1 82 ASP -0.92 -1.04 1 85 ARG -5.72 -2.65 1 86 ASP -4.04 -1.72 1 87 LYS -4.57 -2.22 1 88 LEU 1.65 -0.80 1 89 ILE -4.37 -2.07 1 90 LEU -3.47 -1.75 1 91 ILE -1.35 0.45 1 92 SER 1.33 -1.54 1 93 TRP -2.18 0.37 1 96 ASP 3.30 0.38 1 97 SER 0.45 0.52 1 99 ALA -0.40 1.76 1 101 ARG 5.31 2.90 1 102 THR 5.41 1.01 1 103 LYS 4.22 3.70 1 104 MET 3.60 2.28 1 105 LEU 4.02 2.34 1 106 TYR 5.05 4.89 1 107 SER -0.97 2.76 1 108 SER 3.28 1.77 1 109 SER 2.03 -1.40 1 110 ARG 3.69 1.75 1 111 ASP 3.72 2.05 1 112 ALA 2.97 0.53 1 113 LEU -1.16 2.21 1 114 VAL -1.97 -0.04 1 116 LEU -0.60 -0.10 1 117 THR 4.13 2.46 1 118 GLN -1.22 0.82 1 120 PHE 0.15 -0.23 1 121 GLN -4.21 -2.44 1 123 ILE -1.39 -1.13 1 124 GLN -3.11 -3.91 1 125 ALA -2.30 -2.34 1 126 ASN -3.08 -0.41 1 127 ASP 4.36 2.46 1 128 ALA 4.86 2.02 1 129 SER -1.00 -1.89 1 131 LEU -2.09 0.32 1 132 ASP 4.93 2.19 1 133 PHE 3.53 2.56 1 134 GLU 2.49 2.01 1 135 GLU 6.16 1.18 1 136 ILE 5.13 0.89 1 137 SER 4.49 3.23 1 138 ARG 3.85 3.23 1 139 LYS 4.26 1.87 1 140 VAL 3.12 1.09 1 141 LYS 0.65 -0.63 1 142 SER 0.14 -1.39 1 143 ASN 1.29 0.35 1 stop_ save_