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 bmr11084_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.42 _LACS_plot.Line_1_terminator_val_y_1 -4.49 _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 -3.66 _LACS_plot.Line_2_terminator_val_x_2 8.56 _LACS_plot.Line_2_terminator_val_y_2 4.20 _LACS_plot.Y_axis_chem_shift_offset 2.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 HIS 0.13 0.90 0 105 MET 3.71 -2.52 0 10 LEU 0.55 -2.08 1 11 LEU -0.02 -2.38 1 12 SER -0.13 -2.34 1 13 LYS -1.67 -3.08 1 14 TYR 2.57 -0.22 1 15 ASP -4.42 -3.98 1 17 GLN 4.79 0.69 1 18 LYS 2.63 -1.27 1 19 GLU 3.85 0.81 1 20 ALA 4.68 0.89 1 21 GLU 2.93 0.50 1 22 LEU 1.35 0.39 1 23 ARG 5.33 2.35 1 24 THR 5.37 2.28 1 25 TRP 4.48 1.05 1 26 ILE 4.38 2.18 1 27 GLU 4.83 1.29 1 29 LEU 0.66 -0.43 1 30 THR -0.07 -0.84 1 32 LEU -3.11 -4.32 1 33 SER -1.63 -3.82 1 34 ILE 2.74 0.96 1 37 ASP -3.97 -3.97 1 38 PHE 3.70 2.23 1 39 GLN 8.48 2.62 1 40 LYS 3.57 0.88 1 42 LEU -2.40 -3.58 1 43 LYS 5.28 2.30 1 44 ASP 0.17 -2.40 1 46 THR 6.37 2.57 1 47 ILE 7.78 3.60 1 48 LEU 6.77 0.36 1 50 THR 8.56 3.79 1 51 LEU 3.94 1.15 1 52 MET 2.20 -1.48 1 53 ASN 2.02 -1.01 1 54 LYS 2.50 -1.72 1 55 LEU 2.80 -0.36 1 56 GLN -1.69 -2.82 1 59 SER 3.91 1.33 1 60 VAL 0.59 -2.14 1 62 LYS -2.42 -3.42 1 63 ILE -0.91 -2.22 1 64 ASN -0.21 -1.77 1 65 ARG 0.66 -3.36 1 66 SER -1.85 -3.73 1 67 MET 0.22 -2.70 1 68 GLN 1.67 -1.93 1 69 ASN 5.36 1.50 1 70 TRP 5.15 0.38 1 72 GLN 3.98 1.39 1 73 LEU 3.77 0.67 1 74 GLU 3.27 0.70 1 75 ASN 3.38 0.25 1 76 LEU 3.42 0.82 1 77 SER 5.00 1.50 1 78 ASN 4.12 0.32 1 79 PHE 5.09 1.85 1 80 ILE 5.53 2.67 1 81 LYS 4.25 1.43 1 82 ALA 2.03 -0.40 1 83 MET 4.54 3.67 1 84 VAL 6.27 2.44 1 85 SER 4.52 1.09 1 86 TYR -1.07 -1.83 1 88 MET 1.27 -3.01 1 89 ASN -0.07 -2.07 1 91 VAL 2.99 -0.84 1 92 ASP -1.17 -2.38 1 93 LEU -1.80 -3.62 1 94 PHE -3.26 -5.01 1 95 GLU -3.08 -4.15 1 96 ALA 5.77 2.75 1 97 ASN 4.06 1.13 1 98 ASP 3.41 0.67 1 99 LEU -2.28 -2.08 1 100 PHE 4.71 3.68 1 101 GLU -1.68 -4.69 1 102 SER 2.71 -1.83 1 104 ASN 2.31 -2.65 1 106 THR 7.96 3.75 1 107 GLN 3.72 -0.61 1 108 VAL 6.17 1.89 1 109 GLN 4.85 2.92 1 110 VAL 5.56 2.36 1 111 SER 2.27 1.01 1 112 LEU 2.18 0.41 1 113 LEU 3.45 0.36 1 114 ALA 4.20 -0.02 1 115 LEU 3.97 0.92 1 116 ALA 6.63 0.66 1 118 LYS 3.23 -0.32 1 119 ALA 2.11 0.09 1 120 LYS 3.41 0.43 1 121 THR 2.87 0.16 1 122 LYS 2.34 -0.52 1 124 LEU 0.59 -1.80 1 125 GLN 0.32 -2.06 1 126 SER 0.19 -1.93 1 128 VAL -0.02 -2.33 1 129 ASP -0.11 -2.32 1 130 ILE 0.60 -1.90 1 132 VAL 0.42 -2.08 1 133 LYS -0.05 -2.43 1 134 TYR 0.23 -2.04 1 135 SER -0.31 -2.42 1 136 GLU -0.28 -2.25 1 137 LYS 0.31 -2.25 1 138 GLN 0.01 -2.25 1 139 GLU -0.26 -2.25 1 140 ARG 0.11 -2.31 1 141 SER -0.32 -2.35 1 144 SER 0.16 -2.19 1 145 SER -0.19 -2.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11084_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.42 _LACS_plot.Line_1_terminator_val_y_1 -0.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.66 _LACS_plot.Line_2_terminator_val_x_2 8.56 _LACS_plot.Line_2_terminator_val_y_2 -4.36 _LACS_plot.Y_axis_chem_shift_offset 2.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 HIS 0.13 0.77 0 105 MET 3.71 -6.23 0 10 LEU 0.55 -2.63 1 11 LEU -0.02 -2.36 1 12 SER -0.13 -2.21 1 13 LYS -1.67 -1.41 1 14 TYR 2.57 -2.79 1 15 ASP -4.42 0.44 1 17 GLN 4.79 -4.10 1 18 LYS 2.63 -3.90 1 19 GLU 3.85 -3.04 1 20 ALA 4.68 -3.79 1 21 GLU 2.93 -2.43 1 22 LEU 1.35 -0.96 1 23 ARG 5.33 -2.98 1 24 THR 5.37 -3.09 1 25 TRP 4.48 -3.43 1 26 ILE 4.38 -2.20 1 27 GLU 4.83 -3.54 1 29 LEU 0.66 -1.09 1 30 THR -0.07 -0.77 1 32 LEU -3.11 -1.21 1 33 SER -1.63 -2.19 1 34 ILE 2.74 -1.78 1 37 ASP -3.97 0.00 1 38 PHE 3.70 -1.47 1 39 GLN 8.48 -5.86 1 40 LYS 3.57 -2.69 1 42 LEU -2.40 -1.18 1 43 LYS 5.28 -2.98 1 44 ASP 0.17 -2.57 1 46 THR 6.37 -3.80 1 47 ILE 7.78 -4.18 1 48 LEU 6.77 -6.41 1 50 THR 8.56 -4.77 1 51 LEU 3.94 -2.79 1 52 MET 2.20 -3.68 1 53 ASN 2.02 -3.03 1 54 LYS 2.50 -4.22 1 55 LEU 2.80 -3.16 1 56 GLN -1.69 -1.13 1 59 SER 3.91 -2.58 1 60 VAL 0.59 -2.73 1 62 LYS -2.42 -1.00 1 63 ILE -0.91 -1.31 1 64 ASN -0.21 -1.56 1 65 ARG 0.66 -4.02 1 66 SER -1.85 -1.88 1 67 MET 0.22 -2.92 1 68 GLN 1.67 -3.60 1 69 ASN 5.36 -3.86 1 70 TRP 5.15 -4.77 1 72 GLN 3.98 -2.59 1 73 LEU 3.77 -3.10 1 74 GLU 3.27 -2.57 1 75 ASN 3.38 -3.13 1 76 LEU 3.42 -2.60 1 77 SER 5.00 -3.50 1 78 ASN 4.12 -3.80 1 79 PHE 5.09 -3.24 1 80 ILE 5.53 -2.86 1 81 LYS 4.25 -2.82 1 82 ALA 2.03 -2.43 1 83 MET 4.54 -0.87 1 84 VAL 6.27 -3.83 1 85 SER 4.52 -3.43 1 86 TYR -1.07 -0.76 1 88 MET 1.27 -4.28 1 89 ASN -0.07 -2.00 1 91 VAL 2.99 -3.83 1 92 ASP -1.17 -1.21 1 93 LEU -1.80 -1.82 1 94 PHE -3.26 -1.75 1 95 GLU -3.08 -1.07 1 96 ALA 5.77 -3.02 1 97 ASN 4.06 -2.93 1 98 ASP 3.41 -2.74 1 99 LEU -2.28 0.20 1 100 PHE 4.71 -1.03 1 101 GLU -1.68 -3.01 1 102 SER 2.71 -4.54 1 104 ASN 2.31 -4.96 1 106 THR 7.96 -4.21 1 107 GLN 3.72 -4.33 1 108 VAL 6.17 -4.28 1 109 GLN 4.85 -1.93 1 110 VAL 5.56 -3.20 1 111 SER 2.27 -1.26 1 112 LEU 2.18 -1.77 1 113 LEU 3.45 -3.09 1 114 ALA 4.20 -4.22 1 115 LEU 3.97 -3.05 1 116 ALA 6.63 -5.97 1 118 LYS 3.23 -3.55 1 119 ALA 2.11 -2.02 1 120 LYS 3.41 -2.98 1 121 THR 2.87 -2.71 1 122 LYS 2.34 -2.86 1 124 LEU 0.59 -2.39 1 125 GLN 0.32 -2.38 1 126 SER 0.19 -2.12 1 128 VAL -0.02 -2.31 1 129 ASP -0.11 -2.21 1 130 ILE 0.60 -2.50 1 132 VAL 0.42 -2.50 1 133 LYS -0.05 -2.38 1 134 TYR 0.23 -2.27 1 135 SER -0.31 -2.11 1 136 GLU -0.28 -1.97 1 137 LYS 0.31 -2.56 1 138 GLN 0.01 -2.26 1 139 GLU -0.26 -1.99 1 140 ARG 0.11 -2.42 1 141 SER -0.32 -2.03 1 144 SER 0.16 -2.35 1 145 SER -0.19 -2.01 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11084_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.42 _LACS_plot.Line_1_terminator_val_y_1 0.25 _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 0.09 _LACS_plot.Line_2_terminator_val_x_2 8.56 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 ILE 4.38 -1.28 0 106 THR 7.96 -0.09 0 50 THR 8.56 -0.12 0 10 LEU 0.55 -0.08 1 11 LEU -0.02 -0.02 1 12 SER -0.13 -0.10 1 13 LYS -1.67 0.07 1 14 TYR 2.57 -0.80 1 15 ASP -4.42 0.22 1 17 GLN 4.79 -0.23 1 18 LYS 2.63 -0.32 1 19 GLU 3.85 -0.93 1 20 ALA 4.68 -0.33 1 21 GLU 2.93 -0.36 1 22 LEU 1.35 -0.01 1 23 ARG 5.33 -0.49 1 24 THR 5.37 -0.39 1 25 TRP 4.48 -0.21 1 27 GLU 4.83 -0.43 1 29 LEU 0.66 -0.22 1 30 THR -0.07 -0.45 1 32 LEU -3.11 0.12 1 33 SER -1.63 -0.08 1 34 ILE 2.74 -0.88 1 37 ASP -3.97 0.20 1 38 PHE 3.70 -0.92 1 39 GLN 8.48 -0.89 1 40 LYS 3.57 -0.84 1 42 LEU -2.40 0.16 1 43 LYS 5.28 -0.60 1 44 ASP 0.17 0.01 1 46 THR 6.37 -0.78 1 47 ILE 7.78 -0.87 1 48 LEU 6.77 -0.81 1 51 LEU 3.94 -0.98 1 52 MET 2.20 -0.12 1 53 ASN 2.02 0.10 1 54 LYS 2.50 -0.18 1 55 LEU 2.80 -0.26 1 56 GLN -1.69 -0.04 1 59 SER 3.91 -0.47 1 60 VAL 0.59 -0.05 1 62 LYS -2.42 0.10 1 63 ILE -0.91 -0.53 1 64 ASN -0.21 -0.32 1 65 ARG 0.66 0.08 1 66 SER -1.85 0.11 1 67 MET 0.22 -0.01 1 68 GLN 1.67 -0.17 1 69 ASN 5.36 -0.49 1 70 TRP 5.15 -0.46 1 71 HIS 0.13 -0.68 1 72 GLN 3.98 -0.23 1 73 LEU 3.77 -0.74 1 74 GLU 3.27 -0.38 1 75 ASN 3.38 -0.20 1 76 LEU 3.42 -0.19 1 77 SER 5.00 -0.36 1 78 ASN 4.12 -0.20 1 79 PHE 5.09 -0.62 1 80 ILE 5.53 -1.10 1 81 LYS 4.25 -0.46 1 82 ALA 2.03 -0.11 1 83 MET 4.54 -0.89 1 84 VAL 6.27 -0.41 1 85 SER 4.52 -0.30 1 86 TYR -1.07 -0.25 1 88 MET 1.27 -0.13 1 89 ASN -0.07 -0.25 1 91 VAL 2.99 -0.16 1 92 ASP -1.17 0.11 1 93 LEU -1.80 0.01 1 94 PHE -3.26 0.27 1 95 GLU -3.08 0.17 1 96 ALA 5.77 -0.43 1 97 ASN 4.06 -0.17 1 98 ASP 3.41 -0.56 1 99 LEU -2.28 0.41 1 100 PHE 4.71 -0.78 1 101 GLU -1.68 0.16 1 102 SER 2.71 -0.83 1 104 ASN 2.31 -0.11 1 105 MET 3.71 0.10 1 107 GLN 3.72 -0.37 1 108 VAL 6.17 -1.07 1 109 GLN 4.85 -0.69 1 110 VAL 5.56 -0.64 1 111 SER 2.27 -0.12 1 112 LEU 2.18 0.01 1 113 LEU 3.45 -0.48 1 114 ALA 4.20 -0.18 1 115 LEU 3.97 0.07 1 116 ALA 6.63 -1.08 1 118 LYS 3.23 -0.21 1 119 ALA 2.11 0.30 1 120 LYS 3.41 -0.21 1 121 THR 2.87 -0.21 1 122 LYS 2.34 -0.16 1 124 LEU 0.59 -0.02 1 125 GLN 0.32 -0.01 1 126 SER 0.19 -0.07 1 128 VAL -0.02 -0.07 1 129 ASP -0.11 -0.06 1 130 ILE 0.60 -0.06 1 132 VAL 0.42 -0.17 1 133 LYS -0.05 -0.11 1 134 TYR 0.23 -0.08 1 135 SER -0.31 -0.17 1 136 GLU -0.28 -0.16 1 137 LYS 0.31 -0.10 1 138 GLN 0.01 -0.11 1 139 GLU -0.26 -0.16 1 140 ARG 0.11 -0.01 1 141 SER -0.32 -0.03 1 144 SER 0.16 -0.04 1 145 SER -0.19 -0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11084_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.97 _LACS_plot.Line_1_terminator_val_y_1 -3.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.45 _LACS_plot.Line_2_terminator_val_x_2 8.56 _LACS_plot.Line_2_terminator_val_y_2 1.38 _LACS_plot.Y_axis_chem_shift_offset 1.77 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 43 LYS 5.28 -5.08 0 10 LEU 0.55 -2.24 1 11 LEU -0.02 -2.27 1 12 SER -0.13 -2.72 1 13 LYS -1.67 -3.20 1 14 TYR 2.57 -2.92 1 17 GLN 4.79 1.41 1 18 LYS 2.63 0.02 1 19 GLU 3.85 -1.25 1 20 ALA 4.68 0.44 1 21 GLU 2.93 1.52 1 22 LEU 1.35 -0.45 1 23 ARG 5.33 -0.58 1 24 THR 5.37 0.77 1 25 TRP 4.48 -0.47 1 26 ILE 4.38 2.11 1 27 GLU 4.83 1.58 1 29 LEU 0.66 -0.68 1 30 THR -0.07 -0.93 1 32 LEU -3.11 -4.69 1 33 SER -1.63 -1.55 1 34 ILE 2.74 -1.82 1 37 ASP -3.97 -2.47 1 38 PHE 3.70 -2.92 1 39 GLN 8.48 0.44 1 40 LYS 3.57 1.40 1 42 LEU -2.40 -0.60 1 44 ASP 0.17 -0.43 1 46 THR 6.37 1.72 1 47 ILE 7.78 -0.49 1 48 LEU 6.77 -0.98 1 50 THR 8.56 -0.39 1 51 LEU 3.94 -1.57 1 52 MET 2.20 -0.30 1 53 ASN 2.02 0.82 1 54 LYS 2.50 0.17 1 55 LEU 2.80 -1.24 1 56 GLN -1.69 -5.60 1 59 SER 3.91 -0.99 1 60 VAL 0.59 -2.54 1 62 LYS -2.42 -4.49 1 63 ILE -0.91 -3.00 1 64 ASN -0.21 -1.28 1 65 ARG 0.66 -3.21 1 66 SER -1.85 -2.14 1 67 MET 0.22 -1.28 1 68 GLN 1.67 0.21 1 69 ASN 5.36 0.62 1 70 TRP 5.15 0.65 1 71 HIS 0.13 2.38 1 72 GLN 3.98 0.39 1 73 LEU 3.77 0.21 1 74 GLU 3.27 -0.39 1 75 ASN 3.38 0.77 1 76 LEU 3.42 -1.02 1 77 SER 5.00 0.99 1 78 ASN 4.12 1.47 1 79 PHE 5.09 -1.76 1 80 ILE 5.53 -0.28 1 81 LYS 4.25 1.26 1 82 ALA 2.03 0.69 1 83 MET 4.54 0.39 1 84 VAL 6.27 3.09 1 85 SER 4.52 -1.36 1 86 TYR -1.07 -2.79 1 88 MET 1.27 -2.74 1 89 ASN -0.07 -0.47 1 91 VAL 2.99 -2.30 1 92 ASP -1.17 -2.97 1 93 LEU -1.80 -4.22 1 94 PHE -3.26 -4.62 1 95 GLU -3.08 0.13 1 96 ALA 5.77 0.57 1 97 ASN 4.06 0.52 1 98 ASP 3.41 -2.00 1 99 LEU -2.28 -0.58 1 100 PHE 4.71 -2.66 1 101 GLU -1.68 -2.00 1 102 SER 2.71 -0.73 1 104 ASN 2.31 -2.77 1 105 MET 3.71 1.33 1 106 THR 7.96 -1.49 1 107 GLN 3.72 0.09 1 108 VAL 6.17 -1.37 1 109 GLN 4.85 -0.96 1 110 VAL 5.56 0.99 1 111 SER 2.27 0.90 1 112 LEU 2.18 -0.21 1 113 LEU 3.45 0.99 1 114 ALA 4.20 1.08 1 115 LEU 3.97 -1.63 1 116 ALA 6.63 1.30 1 118 LYS 3.23 0.64 1 119 ALA 2.11 1.10 1 120 LYS 3.41 0.43 1 121 THR 2.87 -0.68 1 122 LYS 2.34 -0.54 1 124 LEU 0.59 -1.68 1 125 GLN 0.32 -1.82 1 126 SER 0.19 -1.47 1 128 VAL -0.02 -2.54 1 129 ASP -0.11 -1.92 1 130 ILE 0.60 -1.50 1 132 VAL 0.42 -2.19 1 133 LYS -0.05 -2.13 1 134 TYR 0.23 -1.96 1 135 SER -0.31 -2.26 1 136 GLU -0.28 -2.01 1 137 LYS 0.31 -2.02 1 138 GLN 0.01 -1.95 1 139 GLU -0.26 -2.08 1 140 ARG 0.11 -2.03 1 141 SER -0.32 -2.00 1 144 SER 0.16 -1.84 1 145 SER -0.19 -2.59 1 stop_ save_