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 bmr15740_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.52 _LACS_plot.Line_1_terminator_val_y_1 -1.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.30 _LACS_plot.Line_2_terminator_val_x_2 7.91 _LACS_plot.Line_2_terminator_val_y_2 5.91 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 MET 1.23 -3.91 0 10 PHE -0.94 0.03 1 11 VAL 2.10 0.76 1 12 ASP -0.94 -0.20 1 13 ASP 1.99 1.89 1 14 ASP -1.49 0.07 1 15 LYS -4.52 -2.27 1 16 ILE -0.94 -0.27 1 18 SER -0.52 -0.35 1 19 ARG 4.92 3.74 1 20 ASP 2.74 1.79 1 21 SER -0.86 1.05 1 22 ILE 4.65 1.00 1 23 ILE 7.92 5.96 1 24 ASP 4.39 3.38 1 25 LEU 5.41 3.33 1 26 ILE 4.98 1.41 1 27 ASP 2.16 3.69 1 28 GLU 3.45 3.15 1 29 TYR 2.91 2.89 1 30 ILE 4.64 3.17 1 31 THR 7.52 5.63 1 32 TRP 7.27 5.10 1 33 ARG 3.65 -0.30 1 34 ASN 1.68 4.21 1 35 HIS 3.35 5.69 1 36 VAL 4.95 3.02 1 37 ILE 1.66 -0.67 1 38 VAL 5.12 4.23 1 39 PHE 1.81 0.20 1 40 ASN 2.98 1.18 1 41 LYS -2.57 -1.74 1 42 ASP -0.79 -0.72 1 43 ILE 1.83 1.96 1 44 THR 1.16 0.76 1 45 SER 0.31 -1.42 1 48 ARG 3.62 3.76 1 49 LEU 5.28 3.84 1 50 TYR 4.18 2.91 1 51 LYS 5.10 4.48 1 52 GLU 3.30 1.98 1 53 LEU 4.94 1.58 1 54 MET 3.18 4.13 1 55 LYS 4.30 2.46 1 56 PHE 3.30 -1.60 1 57 ASP 5.69 4.40 1 58 ASP 3.21 2.88 1 59 VAL 5.72 3.95 1 60 ALA 5.01 3.58 1 61 ILE 5.61 4.82 1 62 ARG 3.72 3.04 1 63 TYR 1.41 3.30 1 64 TYR 1.61 2.62 1 66 ILE 2.49 2.21 1 67 ASP 3.64 2.46 1 68 LYS 1.99 0.61 1 69 ILE 6.04 4.09 1 70 ASN 4.57 3.08 1 71 GLU 2.71 2.65 1 72 ILE 4.75 4.08 1 73 VAL 6.20 4.54 1 74 GLU 2.75 2.55 1 75 ALA 2.90 2.09 1 76 MET 1.17 1.02 1 77 SER 2.50 2.29 1 78 GLU -0.82 -0.18 1 80 ASP -0.16 0.01 1 81 HIS -1.50 0.72 1 82 TYR -1.26 -0.06 1 83 ILE -0.44 -0.68 1 84 ASN -0.89 -1.18 1 85 PHE 0.89 0.09 1 86 THR 1.83 1.56 1 87 LYS 0.38 -0.55 1 88 VAL 2.64 1.56 1 89 HIS -2.93 0.20 1 90 ASP -2.72 -1.86 1 91 GLN 4.34 4.18 1 92 GLU 3.75 3.21 1 93 SER 4.75 3.29 1 94 LEU 5.62 3.66 1 95 PHE 3.41 -0.82 1 96 ALA 2.13 2.59 1 97 THR 7.51 5.43 1 98 ILE 7.15 6.32 1 100 ILE 4.67 3.04 1 102 ALA 2.64 2.37 1 103 LYS 4.33 2.35 1 104 ILE 5.74 4.41 1 105 THR 5.85 3.93 1 106 GLU 2.44 3.59 1 107 HIS 4.46 5.33 1 108 TRP 2.53 1.13 1 110 TYR 4.26 3.49 1 111 LYS 0.45 -0.21 1 112 LYS 4.20 0.88 1 113 ILE -0.04 -0.27 1 114 SER -0.61 -0.17 1 116 SER 0.17 0.40 1 125 THR 5.33 3.60 1 126 ASP 2.07 2.02 1 127 LEU 0.76 1.02 1 129 THR -2.27 -1.21 1 130 ASP 5.21 4.54 1 131 ASP 3.54 2.99 1 132 ASN 3.95 2.21 1 133 ILE 6.27 5.70 1 134 ASN 4.40 3.32 1 135 ILE 5.09 4.35 1 136 LEU 3.63 3.67 1 137 ILE 5.61 4.57 1 138 LEU 3.48 2.91 1 139 PHE 2.81 3.80 1 140 LEU 2.82 2.55 1 141 GLU 3.45 3.12 1 142 LYS 2.81 1.83 1 143 LYS 0.32 -0.41 1 144 LEU 0.06 -0.57 1 145 ASN 0.75 1.88 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15740_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.52 _LACS_plot.Line_1_terminator_val_y_1 2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.70 _LACS_plot.Line_2_terminator_val_x_2 7.91 _LACS_plot.Line_2_terminator_val_y_2 -2.00 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 MET 1.23 -5.14 0 10 PHE -0.94 0.97 1 11 VAL 2.10 -1.34 1 12 ASP -0.94 0.74 1 13 ASP 1.99 -0.10 1 14 ASP -1.49 1.56 1 15 LYS -4.52 2.25 1 16 ILE -0.94 0.67 1 18 SER -0.52 0.17 1 19 ARG 4.92 -1.18 1 20 ASP 2.74 -0.95 1 21 SER -0.86 1.91 1 22 ILE 4.65 -3.65 1 23 ILE 7.92 -1.96 1 24 ASP 4.39 -1.01 1 25 LEU 5.41 -2.08 1 26 ILE 4.98 -3.57 1 27 ASP 2.16 1.53 1 28 GLU 3.45 -0.30 1 29 TYR 2.91 -0.02 1 30 ILE 4.64 -1.47 1 31 THR 7.52 -1.89 1 32 TRP 7.27 -2.17 1 33 ARG 3.65 -3.95 1 34 ASN 1.68 2.53 1 35 HIS 3.35 2.34 1 36 VAL 4.95 -1.93 1 37 ILE 1.66 -2.33 1 38 VAL 5.12 -0.89 1 39 PHE 1.81 -1.61 1 40 ASN 2.98 -1.80 1 41 LYS -2.57 0.83 1 42 ASP -0.79 0.07 1 43 ILE 1.83 0.13 1 44 THR 1.16 -0.40 1 45 SER 0.31 -1.73 1 48 ARG 3.62 0.14 1 49 LEU 5.28 -1.44 1 50 TYR 4.18 -1.27 1 51 LYS 5.10 -0.62 1 52 GLU 3.30 -1.32 1 53 LEU 4.94 -3.36 1 54 MET 3.18 0.95 1 55 LYS 4.30 -1.84 1 56 PHE 3.30 -4.90 1 57 ASP 5.69 -1.29 1 58 ASP 3.21 -0.33 1 59 VAL 5.72 -1.77 1 60 ALA 5.01 -1.43 1 61 ILE 5.61 -0.79 1 62 ARG 3.72 -0.68 1 63 TYR 1.41 1.89 1 64 TYR 1.61 1.01 1 66 ILE 2.49 -0.28 1 67 ASP 3.64 -1.18 1 68 LYS 1.99 -1.38 1 69 ILE 6.04 -1.95 1 70 ASN 4.57 -1.49 1 71 GLU 2.71 -0.06 1 72 ILE 4.75 -0.67 1 73 VAL 6.20 -1.66 1 74 GLU 2.75 -0.20 1 75 ALA 2.90 -0.81 1 76 MET 1.17 -0.15 1 77 SER 2.50 -0.21 1 78 GLU -0.82 0.64 1 80 ASP -0.16 0.17 1 81 HIS -1.50 2.22 1 82 TYR -1.26 1.20 1 83 ILE -0.44 -0.24 1 84 ASN -0.89 -0.29 1 85 PHE 0.89 -0.80 1 86 THR 1.83 -0.27 1 87 LYS 0.38 -0.93 1 88 VAL 2.64 -1.08 1 89 HIS -2.93 3.13 1 90 ASP -2.72 0.86 1 91 GLN 4.34 -0.16 1 92 GLU 3.75 -0.54 1 93 SER 4.75 -1.46 1 94 LEU 5.62 -1.96 1 95 PHE 3.41 -4.23 1 96 ALA 2.13 0.46 1 97 THR 7.51 -2.08 1 98 ILE 7.15 -0.83 1 100 ILE 4.67 -1.63 1 102 ALA 2.64 -0.27 1 103 LYS 4.33 -1.98 1 104 ILE 5.74 -1.33 1 105 THR 5.85 -1.92 1 106 GLU 2.44 1.15 1 107 HIS 4.46 0.87 1 108 TRP 2.53 -1.40 1 110 TYR 4.26 -0.77 1 111 LYS 0.45 -0.66 1 112 LYS 4.20 -3.32 1 113 ILE -0.04 -0.23 1 114 SER -0.61 0.44 1 116 SER 0.17 0.23 1 125 THR 5.33 -1.73 1 126 ASP 2.07 -0.05 1 127 LEU 0.76 0.26 1 129 THR -2.27 1.06 1 130 ASP 5.21 -0.67 1 131 ASP 3.54 -0.55 1 132 ASN 3.95 -1.74 1 133 ILE 6.27 -0.57 1 134 ASN 4.40 -1.08 1 135 ILE 5.09 -0.74 1 136 LEU 3.63 0.04 1 137 ILE 5.61 -1.04 1 138 LEU 3.48 -0.57 1 139 PHE 2.81 0.99 1 140 LEU 2.82 -0.27 1 141 GLU 3.45 -0.33 1 142 LYS 2.81 -0.98 1 143 LYS 0.32 -0.73 1 144 LEU 0.06 -0.63 1 145 ASN 0.75 1.13 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15740_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.52 _LACS_plot.Line_1_terminator_val_y_1 0.34 _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 0.12 _LACS_plot.Line_2_terminator_val_x_2 7.91 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 VAL 2.10 -2.54 0 10 PHE -0.94 0.21 1 12 ASP -0.94 0.09 1 13 ASP 1.99 -0.20 1 14 ASP -1.49 0.25 1 15 LYS -4.52 0.32 1 16 ILE -0.94 -0.32 1 18 SER -0.52 -0.14 1 19 ARG 4.92 -0.49 1 20 ASP 2.74 -0.17 1 21 SER -0.86 0.37 1 22 ILE 4.65 -0.60 1 23 ILE 7.92 -0.74 1 24 ASP 4.39 -0.19 1 25 LEU 5.41 -0.28 1 26 ILE 4.98 -0.38 1 27 ASP 2.16 -0.20 1 28 GLU 3.45 0.08 1 29 TYR 2.91 -0.41 1 30 ILE 4.64 -0.84 1 31 THR 7.52 -0.17 1 32 TRP 7.27 -0.83 1 33 ARG 3.65 -0.75 1 34 ASN 1.68 -0.36 1 35 HIS 3.35 -0.64 1 36 VAL 4.95 -0.81 1 37 ILE 1.66 -0.34 1 38 VAL 5.12 -0.89 1 39 PHE 1.81 -0.09 1 40 ASN 2.98 -0.34 1 41 LYS -2.57 0.16 1 42 ASP -0.79 -0.01 1 43 ILE 1.83 -0.03 1 44 THR 1.16 0.07 1 45 SER 0.31 0.23 1 48 ARG 3.62 -0.55 1 49 LEU 5.28 -0.43 1 50 TYR 4.18 -0.77 1 51 LYS 5.10 -0.39 1 52 GLU 3.30 -0.56 1 53 LEU 4.94 -1.69 1 54 MET 3.18 -0.37 1 55 LYS 4.30 -0.04 1 56 PHE 3.30 0.08 1 57 ASP 5.69 -0.55 1 58 ASP 3.21 -0.12 1 59 VAL 5.72 -0.43 1 60 ALA 5.01 -0.07 1 61 ILE 5.61 -0.65 1 62 ARG 3.72 -0.23 1 63 TYR 1.41 -0.50 1 64 TYR 1.61 -0.16 1 66 ILE 2.49 -0.29 1 67 ASP 3.64 -0.18 1 68 LYS 1.99 -0.06 1 69 ILE 6.04 -0.72 1 70 ASN 4.57 -0.48 1 71 GLU 2.71 -0.39 1 72 ILE 4.75 -0.72 1 73 VAL 6.20 -0.82 1 74 GLU 2.75 -0.40 1 75 ALA 2.90 -0.11 1 76 MET 1.17 0.04 1 77 SER 2.50 0.00 1 78 GLU -0.82 0.07 1 80 ASP -0.16 -0.03 1 81 HIS -1.50 -0.10 1 82 TYR -1.26 0.00 1 83 ILE -0.44 -0.29 1 85 PHE 0.89 0.02 1 86 THR 1.83 0.02 1 87 LYS 0.38 0.05 1 88 VAL 2.64 -0.39 1 89 HIS -2.93 0.29 1 90 ASP -2.72 -0.19 1 91 GLN 4.34 -1.26 1 92 GLU 3.75 -0.86 1 93 SER 4.75 -1.37 1 94 LEU 5.62 -0.54 1 95 PHE 3.41 -0.88 1 96 ALA 2.13 -0.55 1 97 THR 7.51 -0.13 1 98 ILE 7.15 -0.62 1 100 ILE 4.67 -0.20 1 102 ALA 2.64 -0.40 1 103 LYS 4.33 -0.37 1 104 ILE 5.74 -0.85 1 105 THR 5.85 -0.39 1 106 GLU 2.44 -0.41 1 107 HIS 4.46 -0.28 1 108 TRP 2.53 -0.21 1 110 TYR 4.26 -0.32 1 111 LYS 0.45 -0.07 1 112 LYS 4.20 -0.51 1 113 ILE -0.04 -0.07 1 114 SER -0.61 0.29 1 116 SER 0.17 -0.01 1 125 THR 5.33 -0.57 1 127 LEU 0.76 -0.06 1 128 MET 1.23 0.33 1 129 THR -2.27 -0.04 1 130 ASP 5.21 -0.37 1 131 ASP 3.54 -0.24 1 132 ASN 3.95 -0.12 1 133 ILE 6.27 -0.81 1 134 ASN 4.40 -0.30 1 135 ILE 5.09 -0.52 1 136 LEU 3.63 -0.03 1 137 ILE 5.61 -0.46 1 138 LEU 3.48 -0.23 1 139 PHE 2.81 -0.30 1 140 LEU 2.82 -0.59 1 141 GLU 3.45 -0.49 1 142 LYS 2.81 -0.23 1 143 LYS 0.32 -0.27 1 144 LEU 0.06 0.10 1 145 ASN 0.75 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15740_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.52 _LACS_plot.Line_1_terminator_val_y_1 -1.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.39 _LACS_plot.Line_2_terminator_val_x_2 7.91 _LACS_plot.Line_2_terminator_val_y_2 2.51 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 15 LYS -4.52 -1.53 0 11 VAL 2.10 -3.34 0 10 PHE -0.94 0.64 1 12 ASP -0.94 0.36 1 13 ASP 1.99 0.85 1 14 ASP -1.49 -2.54 1 16 ILE -0.94 -3.08 1 18 SER -0.52 1.70 1 19 ARG 4.92 1.60 1 20 ASP 2.74 0.58 1 21 SER -0.86 -1.13 1 22 ILE 4.65 -0.10 1 23 ILE 7.92 0.37 1 24 ASP 4.39 2.66 1 25 LEU 5.41 -0.73 1 26 ILE 4.98 0.94 1 27 ASP 2.16 2.62 1 28 GLU 3.45 0.91 1 29 TYR 2.91 0.90 1 30 ILE 4.64 2.77 1 31 THR 7.52 2.14 1 32 TRP 7.27 0.67 1 33 ARG 3.65 1.82 1 34 ASN 1.68 0.39 1 35 HIS 3.35 2.87 1 36 VAL 4.95 0.95 1 37 ILE 1.66 2.81 1 38 VAL 5.12 1.13 1 39 PHE 1.81 -1.52 1 40 ASN 2.98 -0.42 1 41 LYS -2.57 -1.35 1 42 ASP -0.79 1.55 1 43 ILE 1.83 -1.59 1 44 THR 1.16 1.47 1 45 SER 0.31 -1.50 1 48 ARG 3.62 2.35 1 49 LEU 5.28 -0.57 1 50 TYR 4.18 3.27 1 51 LYS 5.10 3.13 1 52 GLU 3.30 2.56 1 53 LEU 4.94 3.49 1 54 MET 3.18 2.59 1 55 LYS 4.30 2.96 1 56 PHE 3.30 2.51 1 57 ASP 5.69 1.79 1 58 ASP 3.21 2.92 1 59 VAL 5.72 1.66 1 60 ALA 5.01 1.48 1 61 ILE 5.61 1.79 1 62 ARG 3.72 1.12 1 63 TYR 1.41 1.34 1 64 TYR 1.61 1.59 1 66 ILE 2.49 -0.09 1 67 ASP 3.64 1.99 1 68 LYS 1.99 1.66 1 69 ILE 6.04 0.12 1 70 ASN 4.57 2.28 1 71 GLU 2.71 2.57 1 72 ILE 4.75 1.42 1 73 VAL 6.20 2.18 1 74 GLU 2.75 2.39 1 75 ALA 2.90 2.37 1 76 MET 1.17 2.21 1 77 SER 2.50 0.04 1 78 GLU -0.82 0.21 1 80 ASP -0.16 -0.96 1 81 HIS -1.50 -0.21 1 82 TYR -1.26 -0.58 1 84 ASN -0.89 0.80 1 85 PHE 0.89 1.05 1 86 THR 1.83 0.16 1 87 LYS 0.38 -0.68 1 89 HIS -2.93 -0.38 1 90 ASP -2.72 -2.27 1 91 GLN 4.34 -1.12 1 92 GLU 3.75 1.05 1 93 SER 4.75 3.16 1 94 LEU 5.62 -0.01 1 95 PHE 3.41 2.51 1 96 ALA 2.13 1.10 1 97 THR 7.51 1.61 1 98 ILE 7.15 0.86 1 100 ILE 4.67 0.82 1 102 ALA 2.64 0.52 1 103 LYS 4.33 3.76 1 104 ILE 5.74 0.13 1 105 THR 5.85 4.25 1 106 GLU 2.44 0.60 1 107 HIS 4.46 4.71 1 108 TRP 2.53 2.76 1 110 TYR 4.26 1.85 1 111 LYS 0.45 -1.28 1 112 LYS 4.20 -0.92 1 113 ILE -0.04 -0.86 1 114 SER -0.61 -0.23 1 116 SER 0.17 -0.12 1 125 THR 5.33 0.86 1 126 ASP 2.07 0.54 1 127 LEU 0.76 -0.71 1 128 MET 1.23 -0.92 1 129 THR -2.27 0.17 1 130 ASP 5.21 2.10 1 131 ASP 3.54 1.95 1 132 ASN 3.95 2.79 1 133 ILE 6.27 0.89 1 134 ASN 4.40 2.21 1 135 ILE 5.09 2.57 1 136 LEU 3.63 0.43 1 137 ILE 5.61 0.68 1 138 LEU 3.48 2.31 1 139 PHE 2.81 1.70 1 140 LEU 2.82 1.47 1 141 GLU 3.45 2.12 1 142 LYS 2.81 2.10 1 143 LYS 0.32 1.51 1 144 LEU 0.06 -1.44 1 stop_ save_