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 bmr7249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.10 _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 8.59 _LACS_plot.Line_2_terminator_val_y_2 6.62 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 MET -7.12 -2.07 0 26 ALA -0.30 -2.75 0 49 LYS 5.74 1.23 0 10 SER 0.21 0.33 1 12 ILE 0.46 0.40 1 13 GLU 0.57 0.62 1 14 GLU 0.65 0.50 1 16 ARG 0.07 0.07 1 17 MET 0.40 0.30 1 18 THR -0.17 0.05 1 19 GLU -0.46 -0.04 1 20 ALA 0.02 0.30 1 21 ASP 0.50 0.31 1 22 VAL -1.87 -1.15 1 23 ASN -0.03 0.70 1 25 LYS 1.21 0.71 1 27 TYR -5.28 -1.78 1 29 LEU -3.69 -2.01 1 30 ALA -1.04 0.06 1 31 ASP -1.23 -1.71 1 32 ALA 4.66 3.92 1 33 HIS 3.77 3.84 1 34 LEU 4.41 2.28 1 35 THR 7.91 6.72 1 36 LYS 4.75 3.79 1 37 LYS 3.48 3.00 1 38 LEU 2.12 2.98 1 39 LEU 5.97 3.02 1 40 ASP 3.72 3.32 1 41 LEU 3.73 2.25 1 42 VAL 6.51 5.33 1 43 GLN 4.54 3.83 1 44 GLN 3.46 3.78 1 45 SER 6.51 4.99 1 47 ASN 3.90 2.88 1 48 TYR 0.98 0.40 1 50 GLN -3.10 -1.36 1 51 LEU -4.97 -1.50 1 52 ARG -3.85 -2.88 1 53 LYS -2.13 -0.13 1 55 ALA 4.24 3.75 1 56 ASN 5.10 3.68 1 57 GLU 3.27 2.55 1 58 ALA 5.11 3.13 1 59 THR 7.20 6.04 1 60 LYS 5.00 4.23 1 61 THR 3.59 2.89 1 62 LEU 2.11 1.98 1 63 ASN 3.78 3.00 1 64 ARG -0.48 0.11 1 66 ILE -1.02 -0.89 1 67 SER -0.90 -0.06 1 68 GLU 0.96 1.55 1 69 PHE -0.22 -0.50 1 70 ILE -5.06 -4.04 1 71 VAL -3.15 -2.16 1 73 ALA -4.43 -2.40 1 74 ALA 0.56 1.27 1 75 ASP 0.85 -1.76 1 76 ALA 0.55 1.76 1 77 GLU -5.71 -1.64 1 79 LEU 3.32 2.47 1 80 GLU 4.12 3.59 1 81 ILE 3.29 2.90 1 82 ILE -1.42 -0.39 1 83 LEU 4.24 2.37 1 84 HIS 2.27 2.77 1 85 LEU 8.60 6.01 1 87 LEU 3.40 2.52 1 88 LEU 2.16 2.34 1 90 GLU 3.63 2.80 1 91 ASP 2.66 3.15 1 92 LYS -1.05 -1.70 1 93 ASN 2.99 1.36 1 94 VAL -3.45 -0.26 1 96 TYR -6.63 -3.56 1 97 VAL -4.69 -2.44 1 98 PHE -2.87 -1.35 1 99 VAL -4.40 -3.70 1 100 ARG 4.12 4.49 1 101 SER -3.78 -3.18 1 102 LYS 2.53 1.54 1 103 GLN 4.53 3.41 1 104 ALA 3.03 2.16 1 105 LEU 3.82 2.48 1 107 ARG 4.42 3.17 1 108 ALA 2.69 2.77 1 111 VAL -5.61 -3.20 1 112 SER -0.06 -1.05 1 113 ARG -1.11 -0.96 1 115 VAL -4.01 -0.88 1 116 ILE -0.39 -0.06 1 117 ALA -3.74 -1.37 1 119 SER -6.34 -3.87 1 120 VAL 0.20 -0.90 1 121 THR -2.30 -1.53 1 122 ILE -0.68 0.57 1 123 LYS -3.21 -0.74 1 124 GLU 2.36 1.57 1 126 SER 0.35 0.22 1 127 GLN 2.70 1.76 1 128 LEU -0.73 -1.19 1 129 LYS 3.96 3.73 1 130 GLN 5.41 3.94 1 131 GLN -0.38 0.22 1 132 ILE 5.67 4.99 1 133 GLN 4.17 3.22 1 134 SER 4.01 3.05 1 135 ILE 4.79 1.58 1 136 GLN 6.16 4.55 1 137 GLN 4.32 3.22 1 139 ILE 5.38 4.46 1 140 GLU 3.90 3.13 1 141 ARG 2.73 2.16 1 142 LEU 1.06 0.62 1 143 LEU -0.16 -0.34 1 144 VAL 1.61 1.64 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 3.57 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.90 _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 8.59 _LACS_plot.Line_2_terminator_val_y_2 -1.97 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 MET -7.12 5.05 0 26 ALA -0.30 -2.45 0 49 LYS 5.74 -4.51 0 10 SER 0.21 0.12 1 12 ILE 0.46 -0.06 1 13 GLU 0.57 0.05 1 14 GLU 0.65 -0.15 1 16 ARG 0.07 0.00 1 17 MET 0.40 -0.10 1 18 THR -0.17 0.22 1 19 GLU -0.46 0.42 1 20 ALA 0.02 0.28 1 21 ASP 0.50 -0.19 1 22 VAL -1.87 0.72 1 23 ASN -0.03 0.73 1 25 LYS 1.21 -0.50 1 27 TYR -5.28 3.50 1 29 LEU -3.69 1.68 1 30 ALA -1.04 1.10 1 31 ASP -1.23 -0.48 1 32 ALA 4.66 -0.74 1 33 HIS 3.77 0.07 1 34 LEU 4.41 -2.13 1 35 THR 7.91 -1.19 1 36 LYS 4.75 -0.96 1 37 LYS 3.48 -0.48 1 38 LEU 2.12 0.86 1 39 LEU 5.97 -2.95 1 40 ASP 3.72 -0.40 1 41 LEU 3.73 -1.48 1 42 VAL 6.51 -1.18 1 43 GLN 4.54 -0.71 1 44 GLN 3.46 0.32 1 45 SER 6.51 -1.52 1 47 ASN 3.90 -1.02 1 48 TYR 0.98 -0.58 1 50 GLN -3.10 1.74 1 51 LEU -4.97 3.47 1 52 ARG -3.85 0.97 1 53 LYS -2.13 2.00 1 55 ALA 4.24 -0.49 1 56 ASN 5.10 -1.42 1 57 GLU 3.27 -0.72 1 58 ALA 5.11 -1.98 1 59 THR 7.20 -1.16 1 60 LYS 5.00 -0.77 1 61 THR 3.59 -0.70 1 62 LEU 2.11 -0.13 1 63 ASN 3.78 -0.78 1 64 ARG -0.48 0.59 1 66 ILE -1.02 0.13 1 67 SER -0.90 0.84 1 68 GLU 0.96 0.59 1 69 PHE -0.22 -0.28 1 70 ILE -5.06 1.02 1 71 VAL -3.15 0.99 1 73 ALA -4.43 2.03 1 74 ALA 0.56 0.71 1 75 ASP 0.85 -2.61 1 76 ALA 0.55 1.21 1 77 GLU -5.71 4.07 1 79 LEU 3.32 -0.85 1 80 GLU 4.12 -0.53 1 81 ILE 3.29 -0.39 1 82 ILE -1.42 1.03 1 83 LEU 4.24 -1.87 1 84 HIS 2.27 0.50 1 85 LEU 8.60 -2.59 1 87 LEU 3.40 -0.88 1 88 LEU 2.16 0.18 1 90 GLU 3.63 -0.83 1 91 ASP 2.66 0.49 1 92 LYS -1.05 -0.65 1 93 ASN 2.99 -1.63 1 94 VAL -3.45 3.19 1 96 TYR -6.63 3.07 1 97 VAL -4.69 2.25 1 98 PHE -2.87 1.52 1 99 VAL -4.40 0.70 1 100 ARG 4.12 0.37 1 101 SER -3.78 0.60 1 102 LYS 2.53 -0.99 1 103 GLN 4.53 -1.12 1 104 ALA 3.03 -0.87 1 105 LEU 3.82 -1.34 1 107 ARG 4.42 -1.25 1 108 ALA 2.69 0.08 1 111 VAL -5.61 2.41 1 112 SER -0.06 -0.99 1 113 ARG -1.11 0.15 1 115 VAL -4.01 3.13 1 116 ILE -0.39 0.33 1 117 ALA -3.74 2.37 1 119 SER -6.34 2.47 1 120 VAL 0.20 -1.10 1 121 THR -2.30 0.77 1 122 ILE -0.68 1.25 1 123 LYS -3.21 2.47 1 124 GLU 2.36 -0.79 1 126 SER 0.35 -0.13 1 127 GLN 2.70 -0.94 1 128 LEU -0.73 -0.46 1 129 LYS 3.96 -0.23 1 130 GLN 5.41 -1.47 1 131 GLN -0.38 0.60 1 132 ILE 5.67 -0.68 1 133 GLN 4.17 -0.95 1 134 SER 4.01 -0.96 1 135 ILE 4.79 -3.21 1 136 GLN 6.16 -1.61 1 137 GLN 4.32 -1.10 1 139 ILE 5.38 -0.92 1 140 GLU 3.90 -0.77 1 141 ARG 2.73 -0.57 1 142 LEU 1.06 -0.44 1 143 LEU -0.16 -0.18 1 144 VAL 1.61 0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 0.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.27 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.75 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 ALA -0.30 -1.56 0 10 SER 0.21 0.02 1 12 ILE 0.46 -0.02 1 13 GLU 0.57 -0.07 1 14 GLU 0.65 -0.11 1 16 ARG 0.07 0.02 1 17 MET 0.40 0.09 1 18 THR -0.17 0.04 1 19 GLU -0.46 -0.04 1 20 ALA 0.02 -0.04 1 21 ASP 0.50 -0.07 1 22 VAL -1.87 0.03 1 23 ASN -0.03 -0.34 1 25 LYS 1.21 -0.17 1 27 TYR -5.28 -0.17 1 29 LEU -3.69 0.46 1 30 ALA -1.04 -0.17 1 31 ASP -1.23 -0.01 1 32 ALA 4.66 -0.27 1 33 HIS 3.77 -0.33 1 34 LEU 4.41 -0.22 1 35 THR 7.91 -0.04 1 36 LYS 4.75 -0.36 1 37 LYS 3.48 -0.21 1 38 LEU 2.12 -0.50 1 39 LEU 5.97 -0.43 1 40 ASP 3.72 -0.13 1 41 LEU 3.73 0.01 1 42 VAL 6.51 -0.70 1 43 GLN 4.54 0.22 1 44 GLN 3.46 -0.15 1 45 SER 6.51 -0.51 1 47 ASN 3.90 -0.28 1 48 TYR 0.98 0.02 1 49 LYS 5.74 -0.17 1 50 GLN -3.10 0.27 1 51 LEU -4.97 0.95 1 52 ARG -3.85 0.53 1 53 LYS -2.13 0.26 1 55 ALA 4.24 -0.57 1 56 ASN 5.10 -0.27 1 57 GLU 3.27 -0.31 1 58 ALA 5.11 -0.52 1 59 THR 7.20 -0.77 1 60 LYS 5.00 -0.19 1 61 THR 3.59 -0.46 1 62 LEU 2.11 -0.17 1 63 ASN 3.78 -0.27 1 64 ARG -0.48 0.01 1 66 ILE -1.02 0.60 1 67 SER -0.90 -0.14 1 68 GLU 0.96 0.17 1 69 PHE -0.22 0.25 1 70 ILE -5.06 0.79 1 71 VAL -3.15 0.85 1 72 MET -7.12 0.37 1 73 ALA -4.43 0.65 1 74 ALA 0.56 -0.20 1 75 ASP 0.85 0.10 1 76 ALA 0.55 -0.37 1 77 GLU -5.71 0.36 1 79 LEU 3.32 -0.46 1 80 GLU 4.12 -0.51 1 81 ILE 3.29 0.02 1 82 ILE -1.42 0.70 1 83 LEU 4.24 -0.14 1 84 HIS 2.27 -0.13 1 85 LEU 8.60 -0.86 1 87 LEU 3.40 -0.33 1 88 LEU 2.16 -0.09 1 90 GLU 3.63 -0.08 1 91 ASP 2.66 -0.17 1 92 LYS -1.05 0.04 1 93 ASN 2.99 -0.32 1 94 VAL -3.45 0.13 1 96 TYR -6.63 1.31 1 97 VAL -4.69 0.17 1 98 PHE -2.87 0.98 1 99 VAL -4.40 0.79 1 100 ARG 4.12 -0.45 1 101 SER -3.78 0.91 1 102 LYS 2.53 0.13 1 103 GLN 4.53 -0.27 1 104 ALA 3.03 -0.24 1 105 LEU 3.82 -0.23 1 107 ARG 4.42 -0.06 1 108 ALA 2.69 -0.12 1 111 VAL -5.61 0.75 1 112 SER -0.06 0.04 1 113 ARG -1.11 0.25 1 115 VAL -4.01 0.25 1 116 ILE -0.39 0.43 1 117 ALA -3.74 0.93 1 119 SER -6.34 0.62 1 120 VAL 0.20 0.68 1 121 THR -2.30 0.77 1 122 ILE -0.68 -0.23 1 123 LYS -3.21 0.22 1 124 GLU 2.36 -0.26 1 126 SER 0.35 -0.35 1 127 GLN 2.70 -0.03 1 128 LEU -0.73 0.08 1 129 LYS 3.96 -0.49 1 130 GLN 5.41 -0.20 1 131 GLN -0.38 0.02 1 132 ILE 5.67 -0.67 1 133 GLN 4.17 0.20 1 134 SER 4.01 -0.25 1 135 ILE 4.79 -0.45 1 136 GLN 6.16 -0.87 1 137 GLN 4.32 -0.28 1 139 ILE 5.38 -0.77 1 140 GLU 3.90 -0.45 1 141 ARG 2.73 -0.22 1 142 LEU 1.06 -0.12 1 143 LEU -0.16 0.12 1 144 VAL 1.61 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7249_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.12 _LACS_plot.Line_1_terminator_val_y_1 -2.81 _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 -0.62 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 2.95 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 VAL -4.69 -5.44 0 26 ALA -0.30 -4.98 0 10 SER 0.21 0.38 1 12 ILE 0.46 0.06 1 14 GLU 0.65 0.43 1 16 ARG 0.07 0.04 1 17 MET 0.40 0.07 1 18 THR -0.17 -0.13 1 19 GLU -0.46 -0.47 1 20 ALA 0.02 -0.34 1 21 ASP 0.50 -0.55 1 22 VAL -1.87 -1.16 1 25 LYS 1.21 -0.44 1 29 LEU -3.69 -1.58 1 30 ALA -1.04 -1.08 1 31 ASP -1.23 1.54 1 32 ALA 4.66 2.45 1 33 HIS 3.77 3.88 1 34 LEU 4.41 0.93 1 35 THR 7.91 -0.04 1 36 LYS 4.75 1.77 1 37 LYS 3.48 3.34 1 38 LEU 2.12 0.52 1 39 LEU 5.97 2.30 1 40 ASP 3.72 2.11 1 41 LEU 3.73 2.29 1 42 VAL 6.51 1.59 1 43 GLN 4.54 3.58 1 44 GLN 3.46 3.12 1 45 SER 6.51 1.76 1 47 ASN 3.90 1.17 1 48 TYR 0.98 -1.88 1 49 LYS 5.74 -0.28 1 50 GLN -3.10 -2.62 1 51 LEU -4.97 -0.98 1 52 ARG -3.85 -1.32 1 53 LYS -2.13 -1.35 1 56 ASN 5.10 3.19 1 57 GLU 3.27 3.15 1 58 ALA 5.11 2.72 1 59 THR 7.20 0.80 1 60 LYS 5.00 2.78 1 61 THR 3.59 0.92 1 62 LEU 2.11 2.38 1 63 ASN 3.78 2.30 1 64 ARG -0.48 0.03 1 66 ILE -1.02 -1.63 1 67 SER -0.90 1.91 1 68 GLU 0.96 1.86 1 69 PHE -0.22 -3.94 1 70 ILE -5.06 -1.65 1 71 VAL -3.15 -1.51 1 72 MET -7.12 -2.81 1 73 ALA -4.43 -0.84 1 74 ALA 0.56 -1.27 1 75 ASP 0.85 0.31 1 76 ALA 0.55 -2.50 1 79 LEU 3.32 0.14 1 80 GLU 4.12 1.18 1 81 ILE 3.29 -0.14 1 82 ILE -1.42 0.98 1 83 LEU 4.24 1.60 1 84 HIS 2.27 3.76 1 87 LEU 3.40 1.74 1 88 LEU 2.16 -0.76 1 91 ASP 2.66 1.55 1 92 LYS -1.05 -1.05 1 93 ASN 2.99 -1.30 1 96 TYR -6.63 -4.45 1 98 PHE -2.87 0.32 1 99 VAL -4.40 0.55 1 100 ARG 4.12 0.35 1 101 SER -3.78 1.05 1 102 LYS 2.53 2.52 1 103 GLN 4.53 2.24 1 104 ALA 3.03 3.04 1 105 LEU 3.82 1.15 1 107 ARG 4.42 5.02 1 108 ALA 2.69 -0.41 1 111 VAL -5.61 -1.08 1 112 SER -0.06 -0.97 1 115 VAL -4.01 -1.80 1 116 ILE -0.39 -1.33 1 117 ALA -3.74 -3.10 1 119 SER -6.34 -0.72 1 120 VAL 0.20 -0.17 1 121 THR -2.30 -0.96 1 122 ILE -0.68 0.47 1 123 LYS -3.21 -1.01 1 124 GLU 2.36 0.97 1 126 SER 0.35 3.48 1 127 GLN 2.70 0.43 1 128 LEU -0.73 -0.70 1 129 LYS 3.96 0.43 1 130 GLN 5.41 3.12 1 131 GLN -0.38 3.10 1 132 ILE 5.67 0.87 1 133 GLN 4.17 3.07 1 134 SER 4.01 3.20 1 135 ILE 4.79 1.35 1 136 GLN 6.16 2.20 1 137 GLN 4.32 2.86 1 139 ILE 5.38 0.98 1 140 GLU 3.90 2.83 1 141 ARG 2.73 1.29 1 142 LEU 1.06 0.31 1 143 LEU -0.16 -1.25 1 stop_ save_