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 bmr26880_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.01 _LACS_plot.Line_1_terminator_val_y_1 -1.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 7.46 _LACS_plot.Line_2_terminator_val_y_2 5.74 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 MET 4.17 5.35 0 10 THR 0.17 0.29 1 12 ALA -0.74 -0.14 1 15 ALA -0.36 0.09 1 17 ARG 2.54 2.35 1 18 TYR -0.78 -1.67 1 19 ASP 4.58 3.66 1 20 GLN 4.87 3.59 1 21 ALA 2.40 2.53 1 22 THR 7.16 5.36 1 23 ASP 3.96 3.83 1 24 THR 6.06 5.16 1 25 ILE 5.96 5.43 1 26 LEU 5.22 3.65 1 27 THR 5.94 5.03 1 28 VAL 6.79 4.87 1 29 ILE 6.70 6.13 1 30 GLU 3.77 2.70 1 31 ASN 3.41 2.22 1 32 ILE 7.46 5.77 1 33 PHE 5.42 4.43 1 34 SER 3.14 2.44 1 35 SER 0.19 0.18 1 36 MET 3.04 2.03 1 38 ASP -2.01 -2.08 1 39 ALA 3.43 3.49 1 41 GLU 1.19 1.07 1 43 VAL 5.77 4.56 1 44 ARG 4.17 4.46 1 45 GLN 3.48 2.39 1 46 ALA 4.57 3.01 1 47 ARG 4.84 3.75 1 48 ILE 5.19 4.35 1 49 LEU 3.76 2.76 1 50 ALA 4.33 3.08 1 51 GLN 3.75 2.89 1 52 ALA 3.70 2.66 1 53 VAL 6.25 4.54 1 54 SER 5.50 4.09 1 55 ASP 4.49 3.46 1 56 LEU 3.71 2.84 1 57 VAL 6.69 5.44 1 58 ASN 4.28 3.10 1 59 ALA 4.32 3.06 1 60 ILE 5.07 4.50 1 61 LYS 5.35 4.56 1 62 ALA 4.11 2.71 1 63 ASP 4.24 2.96 1 64 ALA 3.45 2.84 1 65 GLU 2.29 2.01 1 67 GLU -1.17 -0.57 1 68 SER 1.34 1.30 1 69 ASP -1.78 -0.51 1 70 LEU 3.27 2.87 1 71 GLU 3.66 2.63 1 72 ASN 3.64 2.84 1 74 ARG 4.77 4.07 1 75 LYS 4.41 3.93 1 76 LEU 3.20 3.22 1 77 LEU 4.26 3.11 1 78 SER 4.47 3.32 1 79 ALA 4.10 2.48 1 80 ALA 4.15 2.87 1 81 LYS 4.05 3.31 1 82 ILE 4.32 3.53 1 83 LEU 3.06 3.27 1 84 ALA 3.49 2.60 1 85 ASP 3.68 2.98 1 86 ALA 2.95 2.42 1 87 VAL 4.81 3.10 1 88 ALA 4.65 3.16 1 89 LYS 3.42 2.96 1 90 MET 3.79 3.20 1 91 VAL 6.68 5.47 1 92 GLU 3.13 2.76 1 93 ALA 3.14 2.12 1 94 ALA 4.47 2.98 1 95 LYS 4.70 4.02 1 97 ALA 2.81 2.04 1 98 ALA 1.84 1.75 1 99 ALA 0.74 0.85 1 100 HIS -0.89 -0.31 1 102 ASP -0.12 -0.71 1 103 SER -1.10 -1.84 1 104 GLU 3.71 3.13 1 105 GLU 3.69 3.21 1 106 GLN 4.33 2.42 1 107 GLN 5.33 3.66 1 108 GLN 5.39 3.47 1 109 ARG 3.80 3.26 1 110 LEU 4.00 3.29 1 111 ARG 5.69 4.93 1 112 GLU 2.87 2.78 1 113 ALA 3.19 2.08 1 114 ALA 3.79 3.49 1 115 GLU 3.47 2.66 1 117 LEU 3.42 2.53 1 118 ARG 5.78 4.94 1 119 MET 3.78 3.38 1 120 ALA 2.60 2.52 1 121 ILE 4.37 2.58 1 122 ASN 3.70 3.26 1 123 ALA 3.18 2.31 1 124 ALA 3.34 2.28 1 125 ALA 2.16 1.86 1 126 GLN 2.05 1.46 1 127 ASN 0.43 1.06 1 128 ALA -0.61 0.17 1 129 ILE 0.29 0.13 1 130 LYS 0.22 0.17 1 131 LYS 0.76 1.54 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26880_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.01 _LACS_plot.Line_1_terminator_val_y_1 0.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.71 _LACS_plot.Line_2_terminator_val_x_2 7.46 _LACS_plot.Line_2_terminator_val_y_2 -1.72 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 MET 4.17 1.18 0 10 THR 0.17 0.12 1 12 ALA -0.74 0.60 1 15 ALA -0.36 0.45 1 17 ARG 2.54 -0.19 1 18 TYR -0.78 -0.89 1 19 ASP 4.58 -0.92 1 20 GLN 4.87 -1.28 1 21 ALA 2.40 0.13 1 22 THR 7.16 -1.80 1 23 ASP 3.96 -0.13 1 24 THR 6.06 -0.90 1 25 ILE 5.96 -0.53 1 26 LEU 5.22 -1.57 1 27 THR 5.94 -0.91 1 28 VAL 6.79 -1.92 1 29 ILE 6.70 -0.57 1 30 GLU 3.77 -1.07 1 31 ASN 3.41 -1.19 1 32 ILE 7.46 -1.69 1 33 PHE 5.42 -0.99 1 34 SER 3.14 -0.70 1 35 SER 0.19 -0.01 1 36 MET 3.04 -1.01 1 38 ASP -2.01 -0.07 1 39 ALA 3.43 0.06 1 41 GLU 1.19 -0.12 1 43 VAL 5.77 -1.21 1 44 ARG 4.17 0.29 1 45 GLN 3.48 -1.09 1 46 ALA 4.57 -1.56 1 47 ARG 4.84 -1.09 1 48 ILE 5.19 -0.84 1 49 LEU 3.76 -1.00 1 50 ALA 4.33 -1.25 1 51 GLN 3.75 -0.86 1 52 ALA 3.70 -1.04 1 53 VAL 6.25 -1.71 1 54 SER 5.50 -1.41 1 55 ASP 4.49 -1.03 1 56 LEU 3.71 -0.87 1 57 VAL 6.69 -1.25 1 58 ASN 4.28 -1.18 1 59 ALA 4.32 -1.26 1 60 ILE 5.07 -0.57 1 61 LYS 5.35 -0.79 1 62 ALA 4.11 -1.40 1 63 ASP 4.24 -1.28 1 64 ALA 3.45 -0.61 1 65 GLU 2.29 -0.28 1 67 GLU -1.17 0.60 1 68 SER 1.34 -0.04 1 69 ASP -1.78 1.27 1 70 LEU 3.27 -0.40 1 71 GLU 3.66 -1.03 1 72 ASN 3.64 -0.80 1 74 ARG 4.77 -0.70 1 75 LYS 4.41 -0.48 1 76 LEU 3.20 0.02 1 77 LEU 4.26 -1.15 1 78 SER 4.47 -1.15 1 79 ALA 4.10 -1.62 1 80 ALA 4.15 -1.28 1 81 LYS 4.05 -0.74 1 82 ILE 4.32 -0.79 1 83 LEU 3.06 0.21 1 84 ALA 3.49 -0.89 1 85 ASP 3.68 -0.70 1 86 ALA 2.95 -0.53 1 87 VAL 4.81 -1.71 1 88 ALA 4.65 -1.49 1 89 LYS 3.42 -0.46 1 90 MET 3.79 -0.59 1 91 VAL 6.68 -1.21 1 92 GLU 3.13 -0.37 1 93 ALA 3.14 -1.02 1 94 ALA 4.47 -1.49 1 95 LYS 4.70 -0.68 1 97 ALA 2.81 -0.77 1 98 ALA 1.84 -0.09 1 99 ALA 0.74 0.11 1 100 HIS -0.89 0.58 1 102 ASP -0.12 -0.59 1 103 SER -1.10 -0.74 1 104 GLU 3.71 -0.58 1 105 GLU 3.69 -0.48 1 106 GLN 4.33 -1.91 1 107 GLN 5.33 -1.67 1 108 GLN 5.39 -1.92 1 109 ARG 3.80 -0.54 1 110 LEU 4.00 -0.71 1 111 ARG 5.69 -0.76 1 112 GLU 2.87 -0.09 1 113 ALA 3.19 -1.11 1 114 ALA 3.79 -0.30 1 115 GLU 3.47 -0.81 1 117 LEU 3.42 -0.89 1 118 ARG 5.78 -0.84 1 119 MET 3.78 -0.40 1 120 ALA 2.60 -0.08 1 121 ILE 4.37 -1.79 1 122 ASN 3.70 -0.44 1 123 ALA 3.18 -0.87 1 124 ALA 3.34 -1.06 1 125 ALA 2.16 -0.30 1 126 GLN 2.05 -0.59 1 127 ASN 0.43 0.63 1 128 ALA -0.61 0.78 1 129 ILE 0.29 -0.16 1 130 LYS 0.22 -0.05 1 131 LYS 0.76 0.78 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26880_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.01 _LACS_plot.Line_1_terminator_val_y_1 -0.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.33 _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 7.46 _LACS_plot.Line_2_terminator_val_y_2 3.12 _LACS_plot.Y_axis_chem_shift_offset -0.57 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 ASP -2.01 -1.35 0 131 LYS 0.76 4.70 0 10 THR 0.17 0.62 1 12 ALA -0.74 0.09 1 15 ALA -0.36 0.49 1 17 ARG 2.54 0.95 1 18 TYR -0.78 1.30 1 19 ASP 4.58 1.23 1 20 GLN 4.87 2.79 1 21 ALA 2.40 2.92 1 22 THR 7.16 1.24 1 23 ASP 3.96 3.12 1 24 THR 6.06 1.60 1 25 ILE 5.96 0.71 1 26 LEU 5.22 2.83 1 27 THR 5.94 1.03 1 28 VAL 6.79 2.12 1 29 ILE 6.70 1.41 1 30 GLU 3.77 3.02 1 31 ASN 3.41 3.59 1 32 ILE 7.46 0.75 1 33 PHE 5.42 3.92 1 34 SER 3.14 0.59 1 35 SER 0.19 -1.72 1 36 MET 3.04 0.57 1 39 ALA 3.43 2.27 1 41 GLU 1.19 2.09 1 42 MET 4.17 2.20 1 43 VAL 5.77 1.71 1 44 ARG 4.17 3.81 1 45 GLN 3.48 2.13 1 46 ALA 4.57 1.17 1 47 ARG 4.84 3.57 1 48 ILE 5.19 2.68 1 49 LEU 3.76 0.21 1 50 ALA 4.33 2.81 1 51 GLN 3.75 1.24 1 52 ALA 3.70 4.08 1 53 VAL 6.25 0.88 1 54 SER 5.50 2.03 1 55 ASP 4.49 2.71 1 56 LEU 3.71 0.08 1 57 VAL 6.69 1.51 1 58 ASN 4.28 3.04 1 59 ALA 4.32 1.89 1 60 ILE 5.07 2.40 1 61 LYS 5.35 2.52 1 62 ALA 4.11 3.61 1 63 ASP 4.24 3.22 1 64 ALA 3.45 2.72 1 65 GLU 2.29 1.24 1 67 GLU -1.17 -0.45 1 68 SER 1.34 0.11 1 69 ASP -1.78 -0.04 1 70 LEU 3.27 1.85 1 71 GLU 3.66 3.59 1 72 ASN 3.64 3.02 1 74 ARG 4.77 3.48 1 75 LYS 4.41 3.41 1 76 LEU 3.20 0.90 1 77 LEU 4.26 3.16 1 78 SER 4.47 1.80 1 79 ALA 4.10 2.40 1 80 ALA 4.15 0.97 1 81 LYS 4.05 1.88 1 82 ILE 4.32 3.41 1 83 LEU 3.06 -0.12 1 84 ALA 3.49 3.47 1 85 ASP 3.68 2.44 1 86 ALA 2.95 4.46 1 87 VAL 4.81 -0.46 1 88 ALA 4.65 3.10 1 89 LYS 3.42 2.97 1 90 MET 3.79 0.52 1 91 VAL 6.68 1.84 1 92 GLU 3.13 3.03 1 93 ALA 3.14 2.22 1 94 ALA 4.47 1.01 1 95 LYS 4.70 3.66 1 97 ALA 2.81 0.89 1 98 ALA 1.84 1.27 1 99 ALA 0.74 -0.09 1 100 HIS -0.89 -0.05 1 102 ASP -0.12 -0.28 1 103 SER -1.10 1.38 1 104 GLU 3.71 2.34 1 105 GLU 3.69 2.80 1 106 GLN 4.33 3.46 1 107 GLN 5.33 2.76 1 108 GLN 5.39 2.52 1 109 ARG 3.80 3.42 1 110 LEU 4.00 0.33 1 111 ARG 5.69 3.20 1 112 GLU 2.87 3.46 1 113 ALA 3.19 3.29 1 114 ALA 3.79 1.51 1 115 GLU 3.47 2.98 1 117 LEU 3.42 -0.09 1 118 ARG 5.78 2.64 1 119 MET 3.78 2.76 1 120 ALA 2.60 2.38 1 121 ILE 4.37 0.82 1 122 ASN 3.70 2.48 1 123 ALA 3.18 2.30 1 124 ALA 3.34 0.95 1 125 ALA 2.16 1.69 1 126 GLN 2.05 1.01 1 127 ASN 0.43 -0.47 1 128 ALA -0.61 -0.74 1 129 ILE 0.29 -0.43 1 130 LYS 0.22 -1.19 1 stop_ save_