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 bmr17280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.35 _LACS_plot.Line_1_terminator_val_y_1 -4.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 7.69 _LACS_plot.Line_2_terminator_val_y_2 5.38 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ASN 1.01 -2.14 0 30 VAL 2.63 -1.26 0 28 GLU -9.35 -3.51 0 14 LEU -6.60 -2.36 1 15 TYR -4.64 -0.76 1 16 LYS -4.79 -2.39 1 17 LEU 1.46 1.74 1 18 ILE 1.08 -1.22 1 19 SER -1.82 -0.87 1 20 GLN -1.66 -0.61 1 23 ASN 0.45 0.52 1 24 MET -1.99 -0.31 1 25 LEU -3.33 -1.48 1 26 ILE 1.14 -1.03 1 27 VAL -6.30 -4.43 1 29 THR 2.73 1.49 1 31 ASP -0.27 -1.52 1 32 ALA 2.35 1.71 1 33 ALA 1.46 1.12 1 34 LYS 3.75 0.64 1 35 LYS -0.25 0.06 1 36 ARG -0.66 -0.91 1 37 VAL -4.79 -2.31 1 39 ALA -3.17 -2.05 1 40 TYR -1.99 -0.18 1 41 ALA 2.91 2.11 1 42 HIS 0.35 0.98 1 43 ASP 0.67 0.89 1 44 LYS 1.21 -0.53 1 45 VAL -1.70 -1.25 1 46 ILE -4.43 -1.33 1 47 SER -1.54 -1.46 1 48 LEU 4.88 3.80 1 49 ALA 1.68 1.07 1 50 ASP -0.39 0.01 1 51 ILE 0.75 0.63 1 52 ALA -5.17 -1.81 1 53 MET -4.16 -2.07 1 54 TYR -1.52 0.70 1 55 THR -3.72 -2.03 1 56 ASP 2.43 1.18 1 57 ALA -1.58 -0.46 1 58 GLU -2.09 -0.63 1 59 GLU -0.92 -0.34 1 60 VAL -3.47 -1.49 1 62 LEU 4.00 2.92 1 63 SER 5.58 2.92 1 64 GLU 2.60 2.00 1 65 VAL 5.62 4.08 1 66 LEU 4.88 2.92 1 67 GLU 3.19 2.30 1 68 ALA 3.39 2.61 1 69 VAL 5.98 4.73 1 70 LYS 3.18 2.81 1 71 LYS 6.01 3.09 1 73 GLU 2.80 3.47 1 74 ASN 2.53 1.31 1 76 ALA -4.11 -2.10 1 77 VAL 1.95 1.09 1 78 ALA 0.52 0.54 1 79 SER 1.98 1.18 1 80 ILE -2.47 -2.20 1 82 TYR 2.39 1.29 1 83 LYS 2.98 2.11 1 84 LYS -2.56 -1.44 1 85 ALA -0.71 -0.17 1 86 SER -2.78 -1.46 1 87 ALA 4.60 3.48 1 88 ASP 4.13 3.23 1 89 GLU 0.19 2.56 1 91 HIS -0.22 -0.79 1 92 ALA 3.64 2.40 1 93 TYR 3.33 3.63 1 94 PHE 3.87 3.54 1 95 ALA 2.51 1.41 1 96 GLU 1.42 1.12 1 97 VAL 2.40 1.44 1 98 LEU -2.74 -2.41 1 100 ASN 1.82 -0.74 1 101 TYR 1.41 0.12 1 102 ASP -1.38 -1.46 1 103 ARG 2.94 2.31 1 104 ASP 1.25 1.47 1 105 ARG -3.12 -0.03 1 106 VAL 0.61 0.06 1 107 HIS -4.22 -0.50 1 110 ASP 2.78 2.64 1 111 ILE 5.13 4.13 1 112 LYS 4.73 4.45 1 113 LYS 4.68 2.64 1 114 LEU 4.59 3.21 1 115 ILE 5.73 3.85 1 116 SER 4.33 2.94 1 117 TRP 1.19 0.22 1 118 TYR 6.17 4.88 1 119 ASN 4.28 2.57 1 120 ILE 4.83 4.71 1 121 LEU 7.69 4.09 1 122 VAL 5.68 4.02 1 123 ASN 2.20 1.87 1 124 ASN -0.45 0.52 1 126 ILE 1.42 -0.45 1 127 THR -1.23 -1.73 1 128 GLU -1.01 -1.61 1 129 PHE -1.40 -1.15 1 130 VAL -2.35 -1.55 1 131 GLU -0.92 -0.34 1 132 ALA -0.17 -0.10 1 134 ALA -0.29 -0.34 1 135 LEU 0.13 -0.07 1 136 GLU -0.62 -0.34 1 137 HIS 0.66 2.43 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.35 _LACS_plot.Line_1_terminator_val_y_1 5.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 7.69 _LACS_plot.Line_2_terminator_val_y_2 -2.31 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ASN 1.01 -3.15 0 30 VAL 2.63 -3.89 0 28 GLU -9.35 5.84 0 14 LEU -6.60 4.24 1 15 TYR -4.64 3.88 1 16 LYS -4.79 2.40 1 17 LEU 1.46 0.28 1 18 ILE 1.08 -2.30 1 19 SER -1.82 0.95 1 20 GLN -1.66 1.05 1 23 ASN 0.45 0.07 1 24 MET -1.99 1.68 1 25 LEU -3.33 1.85 1 26 ILE 1.14 -2.17 1 27 VAL -6.30 1.87 1 29 THR 2.73 -1.24 1 31 ASP -0.27 -1.25 1 32 ALA 2.35 -0.64 1 33 ALA 1.46 -0.34 1 34 LYS 3.75 -3.11 1 35 LYS -0.25 0.31 1 36 ARG -0.66 -0.25 1 37 VAL -4.79 2.48 1 39 ALA -3.17 1.12 1 40 TYR -1.99 1.81 1 41 ALA 2.91 -0.80 1 42 HIS 0.35 0.63 1 43 ASP 0.67 0.22 1 44 LYS 1.21 -1.74 1 45 VAL -1.70 0.45 1 46 ILE -4.43 3.10 1 47 SER -1.54 0.08 1 48 LEU 4.88 -1.08 1 49 ALA 1.68 -0.61 1 50 ASP -0.39 0.40 1 51 ILE 0.75 -0.12 1 52 ALA -5.17 3.36 1 53 MET -4.16 2.09 1 54 TYR -1.52 2.22 1 55 THR -3.72 1.69 1 56 ASP 2.43 -1.25 1 57 ALA -1.58 1.12 1 58 GLU -2.09 1.46 1 59 GLU -0.92 0.58 1 60 VAL -3.47 1.98 1 62 LEU 4.00 -1.08 1 63 SER 5.58 -2.66 1 64 GLU 2.60 -0.60 1 65 VAL 5.62 -1.54 1 66 LEU 4.88 -1.96 1 67 GLU 3.19 -0.89 1 68 ALA 3.39 -0.78 1 69 VAL 5.98 -1.25 1 70 LYS 3.18 -0.37 1 71 LYS 6.01 -2.92 1 73 GLU 2.80 0.67 1 74 ASN 2.53 -1.22 1 76 ALA -4.11 2.01 1 77 VAL 1.95 -0.86 1 78 ALA 0.52 0.02 1 79 SER 1.98 -0.80 1 80 ILE -2.47 0.27 1 82 TYR 2.39 -1.10 1 83 LYS 2.98 -0.87 1 84 LYS -2.56 1.12 1 85 ALA -0.71 0.54 1 86 SER -2.78 1.32 1 87 ALA 4.60 -1.12 1 88 ASP 4.13 -0.90 1 89 GLU 0.19 2.37 1 91 HIS -0.22 -0.57 1 92 ALA 3.64 -1.24 1 93 TYR 3.33 0.30 1 94 PHE 3.87 -0.33 1 95 ALA 2.51 -1.10 1 96 GLU 1.42 -0.30 1 97 VAL 2.40 -0.96 1 98 LEU -2.74 0.33 1 100 ASN 1.82 -2.56 1 101 TYR 1.41 -1.29 1 102 ASP -1.38 -0.08 1 103 ARG 2.94 -0.63 1 104 ASP 1.25 0.22 1 105 ARG -3.12 3.09 1 106 VAL 0.61 -0.55 1 107 HIS -4.22 3.72 1 110 ASP 2.78 -0.14 1 111 ILE 5.13 -1.00 1 112 LYS 4.73 -0.28 1 113 LYS 4.68 -2.04 1 114 LEU 4.59 -1.38 1 115 ILE 5.73 -1.88 1 116 SER 4.33 -1.39 1 117 TRP 1.19 -0.97 1 118 TYR 6.17 -1.29 1 119 ASN 4.28 -1.71 1 120 ILE 4.83 -0.12 1 121 LEU 7.69 -3.60 1 122 VAL 5.68 -1.66 1 123 ASN 2.20 -0.33 1 124 ASN -0.45 0.97 1 126 ILE 1.42 -1.87 1 127 THR -1.23 -0.50 1 128 GLU -1.01 -0.60 1 129 PHE -1.40 0.25 1 130 VAL -2.35 0.80 1 131 GLU -0.92 0.58 1 132 ALA -0.17 0.07 1 134 ALA -0.29 -0.05 1 135 LEU 0.13 -0.20 1 136 GLU -0.62 0.28 1 137 HIS 0.66 1.77 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.35 _LACS_plot.Line_1_terminator_val_y_1 0.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 7.69 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 VAL -4.79 -0.73 0 14 LEU -6.60 0.71 1 15 TYR -4.64 0.46 1 16 LYS -4.79 0.96 1 17 LEU 1.46 -0.28 1 18 ILE 1.08 0.16 1 19 SER -1.82 0.17 1 20 GLN -1.66 0.42 1 23 ASN 0.45 -0.07 1 24 MET -1.99 0.24 1 25 LEU -3.33 0.51 1 26 ILE 1.14 0.26 1 27 VAL -6.30 1.23 1 28 GLU -9.35 1.37 1 29 THR 2.73 -0.73 1 30 VAL 2.63 -0.21 1 31 ASP -0.27 -0.15 1 32 ALA 2.35 -0.15 1 33 ALA 1.46 -0.25 1 34 LYS 3.75 -0.14 1 35 LYS -0.25 -0.08 1 36 ARG -0.66 1.18 1 39 ALA -3.17 0.05 1 40 TYR -1.99 0.14 1 41 ALA 2.91 -0.20 1 42 HIS 0.35 -0.18 1 43 ASP 0.67 0.02 1 44 LYS 1.21 0.07 1 45 VAL -1.70 0.47 1 46 ILE -4.43 0.30 1 47 SER -1.54 0.57 1 48 LEU 4.88 -0.49 1 49 ALA 1.68 -0.12 1 50 ASP -0.39 0.21 1 51 ILE 0.75 -0.02 1 52 ALA -5.17 0.57 1 53 MET -4.16 0.11 1 54 TYR -1.52 0.38 1 55 THR -3.72 0.61 1 56 ASP 2.43 -0.17 1 57 ALA -1.58 0.23 1 58 GLU -2.09 0.21 1 59 GLU -0.92 0.23 1 60 VAL -3.47 0.20 1 62 LEU 4.00 -0.48 1 63 SER 5.58 -0.46 1 64 GLU 2.60 0.13 1 65 VAL 5.62 -0.49 1 66 LEU 4.88 -0.52 1 67 GLU 3.19 -0.29 1 68 ALA 3.39 -0.06 1 69 VAL 5.98 -0.82 1 70 LYS 3.18 0.16 1 71 LYS 6.01 -0.18 1 73 GLU 2.80 0.53 1 74 ASN 2.53 -0.25 1 76 ALA -4.11 0.33 1 77 VAL 1.95 -0.21 1 78 ALA 0.52 -0.13 1 79 SER 1.98 -0.19 1 80 ILE -2.47 0.06 1 81 ASN 1.01 0.00 1 82 TYR 2.39 -0.62 1 83 LYS 2.98 -0.42 1 84 LYS -2.56 0.09 1 85 ALA -0.71 0.01 1 86 SER -2.78 -0.04 1 87 ALA 4.60 -0.28 1 88 ASP 4.13 -0.18 1 89 GLU 0.19 -0.21 1 91 HIS -0.22 0.15 1 92 ALA 3.64 -0.27 1 93 TYR 3.33 -0.51 1 94 PHE 3.87 -0.59 1 95 ALA 2.51 -0.28 1 96 GLU 1.42 -0.34 1 97 VAL 2.40 -0.47 1 98 LEU -2.74 -0.13 1 100 ASN 1.82 -0.04 1 101 TYR 1.41 -0.15 1 102 ASP -1.38 -0.16 1 103 ARG 2.94 -0.14 1 104 ASP 1.25 0.05 1 105 ARG -3.12 0.11 1 106 VAL 0.61 0.15 1 107 HIS -4.22 0.33 1 110 ASP 2.78 -0.40 1 111 ILE 5.13 -1.33 1 112 LYS 4.73 -0.95 1 113 LYS 4.68 -1.01 1 114 LEU 4.59 -0.65 1 115 ILE 5.73 -0.74 1 116 SER 4.33 -0.56 1 117 TRP 1.19 -0.09 1 118 TYR 6.17 -0.68 1 119 ASN 4.28 -0.47 1 120 ILE 4.83 -0.48 1 121 LEU 7.69 -0.51 1 122 VAL 5.68 -0.59 1 123 ASN 2.20 -0.20 1 124 ASN -0.45 0.00 1 126 ILE 1.42 -0.01 1 127 THR -1.23 -0.44 1 128 GLU -1.01 -0.09 1 129 PHE -1.40 0.08 1 130 VAL -2.35 0.20 1 131 GLU -0.92 -0.11 1 132 ALA -0.17 -0.03 1 134 ALA -0.29 -0.03 1 135 LEU 0.13 -0.06 1 136 GLU -0.62 0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17280_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.35 _LACS_plot.Line_1_terminator_val_y_1 -3.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.96 _LACS_plot.Line_2_terminator_val_x_2 7.69 _LACS_plot.Line_2_terminator_val_y_2 2.26 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 137 HIS 0.66 5.50 0 28 GLU -9.35 0.08 0 14 LEU -6.60 -2.28 1 15 TYR -4.64 -2.45 1 16 LYS -4.79 0.07 1 17 LEU 1.46 -2.45 1 18 ILE 1.08 0.04 1 19 SER -1.82 -2.62 1 20 GLN -1.66 -1.09 1 23 ASN 0.45 -1.34 1 24 MET -1.99 -2.84 1 25 LEU -3.33 -1.96 1 26 ILE 1.14 -0.78 1 27 VAL -6.30 -3.08 1 29 THR 2.73 0.57 1 30 VAL 2.63 -2.91 1 31 ASP -0.27 -0.37 1 32 ALA 2.35 0.92 1 33 ALA 1.46 0.10 1 34 LYS 3.75 -0.40 1 35 LYS -0.25 0.42 1 36 ARG -0.66 0.37 1 37 VAL -4.79 -2.48 1 39 ALA -3.17 -1.95 1 40 TYR -1.99 1.36 1 41 ALA 2.91 0.44 1 42 HIS 0.35 2.05 1 43 ASP 0.67 -1.26 1 44 LYS 1.21 -1.80 1 45 VAL -1.70 -0.96 1 46 ILE -4.43 -2.13 1 47 SER -1.54 2.27 1 48 LEU 4.88 0.83 1 49 ALA 1.68 0.04 1 50 ASP -0.39 -0.74 1 51 ILE 0.75 -2.31 1 52 ALA -5.17 -2.18 1 53 MET -4.16 -1.60 1 54 TYR -1.52 0.60 1 55 THR -3.72 -0.72 1 56 ASP 2.43 -0.27 1 57 ALA -1.58 -1.19 1 58 GLU -2.09 -0.75 1 59 GLU -0.92 -0.69 1 62 LEU 4.00 0.85 1 63 SER 5.58 0.72 1 64 GLU 2.60 3.19 1 65 VAL 5.62 1.60 1 66 LEU 4.88 1.30 1 67 GLU 3.19 1.46 1 68 ALA 3.39 3.74 1 69 VAL 5.98 0.26 1 70 LYS 3.18 3.36 1 71 LYS 6.01 3.24 1 73 GLU 2.80 0.31 1 74 ASN 2.53 1.30 1 76 ALA -4.11 -0.66 1 77 VAL 1.95 -0.98 1 78 ALA 0.52 1.86 1 79 SER 1.98 -0.10 1 80 ILE -2.47 -2.68 1 81 ASN 1.01 1.12 1 82 TYR 2.39 -1.22 1 83 LYS 2.98 0.84 1 84 LYS -2.56 -0.56 1 85 ALA -0.71 -0.60 1 86 SER -2.78 0.13 1 87 ALA 4.60 2.15 1 88 ASP 4.13 3.07 1 89 GLU 0.19 3.25 1 91 HIS -0.22 3.44 1 92 ALA 3.64 2.62 1 93 TYR 3.33 1.62 1 94 PHE 3.87 0.93 1 95 ALA 2.51 1.19 1 96 GLU 1.42 1.01 1 97 VAL 2.40 -1.70 1 98 LEU -2.74 -3.93 1 100 ASN 1.82 0.30 1 101 TYR 1.41 -2.61 1 102 ASP -1.38 0.20 1 103 ARG 2.94 0.55 1 104 ASP 1.25 1.02 1 105 ARG -3.12 -1.31 1 106 VAL 0.61 -2.47 1 107 HIS -4.22 3.20 1 110 ASP 2.78 1.54 1 111 ILE 5.13 0.62 1 112 LYS 4.73 0.81 1 113 LYS 4.68 0.48 1 114 LEU 4.59 0.42 1 115 ILE 5.73 0.57 1 116 SER 4.33 2.83 1 117 TRP 1.19 1.26 1 118 TYR 6.17 0.01 1 119 ASN 4.28 3.04 1 120 ILE 4.83 2.62 1 121 LEU 7.69 1.79 1 122 VAL 5.68 4.71 1 123 ASN 2.20 1.19 1 124 ASN -0.45 -0.93 1 126 ILE 1.42 -3.18 1 127 THR -1.23 -1.48 1 128 GLU -1.01 -1.98 1 129 PHE -1.40 -0.12 1 130 VAL -2.35 -0.56 1 131 GLU -0.92 -0.92 1 132 ALA -0.17 -0.52 1 134 ALA -0.29 -0.13 1 135 LEU 0.13 -0.25 1 136 GLU -0.62 -2.40 1 stop_ save_