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 bmr25397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.65 _LACS_plot.Line_1_terminator_val_y_1 -1.36 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.18 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 5.45 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 MET 4.95 0.48 0 10 THR 1.11 0.66 1 11 ASN -1.80 -1.64 1 13 ASN 4.20 3.45 1 14 ALA 3.05 2.06 1 15 ALA 3.57 2.91 1 16 MET 3.47 2.71 1 17 THR 6.56 5.01 1 18 MET 6.07 4.44 1 19 THR 7.36 5.58 1 20 ASN 4.14 3.34 1 21 ASN 4.75 3.37 1 22 LEU 5.15 4.20 1 23 VAL 6.42 5.15 1 24 GLN 4.20 3.14 1 26 ALA 4.07 2.49 1 27 SER 4.63 3.83 1 28 ARG 2.41 1.83 1 29 SER 2.29 2.68 1 31 VAL 0.12 0.07 1 32 LEU 0.47 0.20 1 33 THR -2.36 -1.02 1 34 ALA 4.33 3.05 1 35 ASP 3.96 3.01 1 36 GLN 1.96 3.14 1 37 MET 4.31 2.14 1 38 ASP 4.63 3.31 1 39 ASP 4.30 3.34 1 40 MET 3.50 1.88 1 42 MET 3.42 2.79 1 43 MET 7.22 3.04 1 44 ALA 4.34 3.05 1 45 ASP 3.41 3.28 1 46 SER 3.54 2.50 1 47 VAL 5.83 4.53 1 48 ASN 4.49 3.47 1 49 SER 4.37 3.31 1 50 GLN 3.67 3.51 1 51 MET 4.42 3.09 1 52 GLN 3.67 2.78 1 53 LYS 1.16 0.65 1 54 MET 1.85 2.79 1 57 ASN 0.91 1.04 1 61 HIS 4.19 4.18 1 62 ARG 2.48 1.22 1 63 LEU 3.79 2.76 1 64 ARG 4.23 2.95 1 65 ALA 3.30 2.06 1 66 MET 2.14 0.83 1 67 ASN 5.12 3.73 1 68 THR 6.28 4.28 1 69 ALA 4.01 2.74 1 70 MET 4.82 3.93 1 71 ALA 1.73 2.42 1 72 ALA 3.96 2.70 1 73 GLU 3.33 2.90 1 74 VAL 6.10 4.45 1 75 ALA 2.09 2.77 1 76 GLU 3.15 2.27 1 77 VAL 4.82 3.53 1 78 VAL 5.82 4.19 1 79 ALA 2.06 2.08 1 80 THR 0.45 -0.01 1 81 SER 2.25 1.74 1 84 GLN 4.24 2.16 1 85 SER -0.56 0.15 1 86 TYR 4.84 4.88 1 87 SER 5.38 3.72 1 88 ALA 3.68 2.41 1 89 VAL 6.71 5.11 1 90 LEU 4.49 3.56 1 91 ASN 3.77 3.06 1 92 THR 7.09 5.62 1 93 ILE 6.30 2.68 1 95 ALA 4.00 2.73 1 97 LEU 4.73 3.75 1 98 ARG 5.43 4.49 1 99 GLU 2.57 2.89 1 101 MET 4.49 3.80 1 102 MET 4.33 2.76 1 103 GLN 3.52 2.49 1 104 ALA 0.09 1.76 1 105 THR -2.65 0.16 1 107 SER -2.45 -1.14 1 108 VAL -0.61 -0.16 1 109 ASP -1.30 -1.39 1 110 ASN 2.43 2.37 1 111 ALA 3.95 2.70 1 112 PHE 3.00 2.79 1 113 THR 6.95 4.59 1 114 ASN 3.86 2.79 1 115 GLU 3.77 3.16 1 116 VAL 6.10 4.82 1 118 GLN 4.73 3.28 1 119 LEU 2.87 2.74 1 120 VAL 5.93 4.52 1 121 LYS 4.73 3.93 1 122 MET 3.05 3.42 1 123 LEU 1.44 1.12 1 124 SER -0.75 0.20 1 125 ALA 0.72 0.84 1 126 ASP 0.83 0.58 1 127 SER 1.02 0.68 1 128 ALA 0.40 0.11 1 129 ASN -0.16 0.08 1 130 GLU -0.56 -0.17 1 131 VAL 0.16 -0.10 1 132 SER 0.60 -0.08 1 133 THR 0.54 1.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.65 _LACS_plot.Line_1_terminator_val_y_1 1.29 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.82 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 -1.91 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 117 MET 4.95 -4.47 0 10 THR 1.11 -0.45 1 11 ASN -1.80 0.16 1 13 ASN 4.20 -0.75 1 14 ALA 3.05 -0.99 1 15 ALA 3.57 -0.66 1 16 MET 3.47 -0.76 1 17 THR 6.56 -1.55 1 18 MET 6.07 -1.63 1 19 THR 7.36 -1.78 1 20 ASN 4.14 -0.80 1 21 ASN 4.75 -1.38 1 22 LEU 5.15 -0.95 1 23 VAL 6.42 -1.27 1 24 GLN 4.20 -1.06 1 26 ALA 4.07 -1.58 1 27 SER 4.63 -0.80 1 28 ARG 2.41 -0.58 1 29 SER 2.29 0.39 1 31 VAL 0.12 -0.05 1 32 LEU 0.47 -0.27 1 33 THR -2.36 1.34 1 34 ALA 4.33 -1.28 1 35 ASP 3.96 -0.95 1 36 GLN 1.96 1.18 1 37 MET 4.31 -2.17 1 38 ASP 4.63 -1.32 1 39 ASP 4.30 -0.96 1 40 MET 3.50 -1.62 1 42 MET 3.42 -0.63 1 43 MET 7.22 -4.18 1 44 ALA 4.34 -1.29 1 45 ASP 3.41 -0.13 1 46 SER 3.54 -1.04 1 47 VAL 5.83 -1.30 1 48 ASN 4.49 -1.02 1 49 SER 4.37 -1.06 1 50 GLN 3.67 -0.16 1 51 MET 4.42 -1.33 1 52 GLN 3.67 -0.89 1 53 LYS 1.16 -0.51 1 54 MET 1.85 0.94 1 57 ASN 0.91 0.13 1 61 HIS 4.19 -0.01 1 62 ARG 2.48 -1.26 1 63 LEU 3.79 -1.03 1 64 ARG 4.23 -1.28 1 65 ALA 3.30 -1.24 1 66 MET 2.14 -1.31 1 67 ASN 5.12 -1.39 1 68 THR 6.28 -2.00 1 69 ALA 4.01 -1.27 1 70 MET 4.82 -0.89 1 71 ALA 1.73 0.69 1 72 ALA 3.96 -1.26 1 73 GLU 3.33 -0.43 1 74 VAL 6.10 -1.65 1 75 ALA 2.09 0.68 1 76 GLU 3.15 -0.88 1 77 VAL 4.82 -1.29 1 78 VAL 5.82 -1.63 1 79 ALA 2.06 0.02 1 80 THR 0.45 -0.46 1 81 SER 2.25 -0.51 1 84 GLN 4.24 -2.08 1 85 SER -0.56 0.71 1 86 TYR 4.84 0.04 1 87 SER 5.38 -1.66 1 88 ALA 3.68 -1.27 1 89 VAL 6.71 -1.60 1 90 LEU 4.49 -0.93 1 91 ASN 3.77 -0.71 1 92 THR 7.09 -1.47 1 93 ILE 6.30 -3.62 1 95 ALA 4.00 -1.27 1 97 LEU 4.73 -0.98 1 98 ARG 5.43 -0.94 1 99 GLU 2.57 0.32 1 101 MET 4.49 -0.69 1 102 MET 4.33 -1.57 1 103 GLN 3.52 -1.03 1 104 ALA 0.09 1.67 1 105 THR -2.65 2.81 1 107 SER -2.45 1.31 1 108 VAL -0.61 0.45 1 109 ASP -1.30 -0.09 1 110 ASN 2.43 -0.06 1 111 ALA 3.95 -1.25 1 112 PHE 3.00 -0.21 1 113 THR 6.95 -2.36 1 114 ASN 3.86 -1.07 1 115 GLU 3.77 -0.61 1 116 VAL 6.10 -1.28 1 118 GLN 4.73 -1.45 1 119 LEU 2.87 -0.13 1 120 VAL 5.93 -1.41 1 121 LYS 4.73 -0.80 1 122 MET 3.05 0.37 1 123 LEU 1.44 -0.32 1 124 SER -0.75 0.95 1 125 ALA 0.72 0.12 1 126 ASP 0.83 -0.25 1 127 SER 1.02 -0.34 1 128 ALA 0.40 -0.29 1 129 ASN -0.16 0.24 1 130 GLU -0.56 0.39 1 131 VAL 0.16 -0.26 1 132 SER 0.60 -0.68 1 133 THR 0.54 0.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.65 _LACS_plot.Line_1_terminator_val_y_1 0.17 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 120 VAL 5.93 0.36 0 10 THR 1.11 -0.10 1 11 ASN -1.80 0.17 1 13 ASN 4.20 -0.27 1 14 ALA 3.05 -0.15 1 15 ALA 3.57 -0.75 1 16 MET 3.47 -0.03 1 17 THR 6.56 -0.35 1 18 MET 6.07 -0.70 1 19 THR 7.36 -0.65 1 20 ASN 4.14 -0.26 1 21 ASN 4.75 -0.37 1 22 LEU 5.15 -0.52 1 23 VAL 6.42 -0.79 1 24 GLN 4.20 -0.29 1 26 ALA 4.07 -0.53 1 27 SER 4.63 -0.25 1 28 ARG 2.41 -0.17 1 29 SER 2.29 -0.30 1 31 VAL 0.12 0.00 1 32 LEU 0.47 0.19 1 33 THR -2.36 -0.03 1 34 ALA 4.33 -0.24 1 35 ASP 3.96 -0.28 1 36 GLN 1.96 -0.20 1 37 MET 4.31 -0.33 1 38 ASP 4.63 -0.17 1 39 ASP 4.30 -0.21 1 40 MET 3.50 -0.17 1 42 MET 3.42 -0.15 1 43 MET 7.22 -0.20 1 44 ALA 4.34 -0.49 1 45 ASP 3.41 -0.19 1 46 SER 3.54 -0.24 1 47 VAL 5.83 -0.67 1 48 ASN 4.49 -0.26 1 49 SER 4.37 -0.26 1 50 GLN 3.67 -0.40 1 51 MET 4.42 -0.30 1 52 GLN 3.67 -0.27 1 53 LYS 1.16 -0.10 1 54 MET 1.85 -0.38 1 57 ASN 0.91 -0.28 1 61 HIS 4.19 -0.40 1 62 ARG 2.48 -0.27 1 63 LEU 3.79 -0.45 1 64 ARG 4.23 -0.32 1 65 ALA 3.30 -0.20 1 66 MET 2.14 -0.38 1 67 ASN 5.12 -0.38 1 68 THR 6.28 -0.55 1 69 ALA 4.01 -0.28 1 70 MET 4.82 -0.56 1 71 ALA 1.73 -0.57 1 72 ALA 3.96 -0.38 1 73 GLU 3.33 -0.26 1 74 VAL 6.10 -0.58 1 75 ALA 2.09 -0.46 1 76 GLU 3.15 -0.34 1 77 VAL 4.82 -0.20 1 78 VAL 5.82 -0.89 1 79 ALA 2.06 0.07 1 80 THR 0.45 0.11 1 81 SER 2.25 -0.21 1 84 GLN 4.24 -0.01 1 85 SER -0.56 0.45 1 86 TYR 4.84 -0.70 1 87 SER 5.38 -0.54 1 88 ALA 3.68 -0.11 1 89 VAL 6.71 -0.80 1 90 LEU 4.49 -0.76 1 91 ASN 3.77 -0.35 1 92 THR 7.09 -0.38 1 93 ILE 6.30 -0.73 1 95 ALA 4.00 -0.14 1 97 LEU 4.73 -0.26 1 98 ARG 5.43 -0.39 1 99 GLU 2.57 -0.35 1 101 MET 4.49 -0.40 1 102 MET 4.33 -0.39 1 103 GLN 3.52 -0.38 1 104 ALA 0.09 -0.11 1 105 THR -2.65 0.34 1 107 SER -2.45 0.14 1 108 VAL -0.61 -0.13 1 109 ASP -1.30 0.08 1 110 ASN 2.43 -0.12 1 111 ALA 3.95 -0.12 1 112 PHE 3.00 -0.21 1 113 THR 6.95 -0.90 1 114 ASN 3.86 -0.36 1 115 GLU 3.77 -0.35 1 116 VAL 6.10 -0.74 1 117 MET 4.95 -0.01 1 118 GLN 4.73 -0.25 1 119 LEU 2.87 -0.22 1 121 LYS 4.73 -0.51 1 122 MET 3.05 -0.35 1 123 LEU 1.44 -0.11 1 124 SER -0.75 0.11 1 125 ALA 0.72 -0.14 1 126 ASP 0.83 -0.10 1 127 SER 1.02 -0.12 1 128 ALA 0.40 -0.14 1 129 ASN -0.16 -0.09 1 130 GLU -0.56 -0.05 1 131 VAL 0.16 0.05 1 132 SER 0.60 0.09 1 133 THR 0.54 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25397_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.65 _LACS_plot.Line_1_terminator_val_y_1 -1.37 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.18 _LACS_plot.Line_2_terminator_val_x_2 7.36 _LACS_plot.Line_2_terminator_val_y_2 2.97 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 SER -2.45 -2.85 0 133 THR 0.54 4.55 0 10 THR 1.11 -1.15 1 13 ASN 4.20 2.96 1 14 ALA 3.05 1.51 1 15 ALA 3.57 2.44 1 16 MET 3.47 2.02 1 17 THR 6.56 1.63 1 18 MET 6.07 1.24 1 19 THR 7.36 1.70 1 20 ASN 4.14 3.46 1 21 ASN 4.75 1.97 1 22 LEU 5.15 0.43 1 23 VAL 6.42 2.22 1 24 GLN 4.20 2.06 1 26 ALA 4.07 3.11 1 27 SER 4.63 1.82 1 28 ARG 2.41 1.56 1 29 SER 2.29 1.01 1 31 VAL 0.12 -0.58 1 32 LEU 0.47 0.23 1 33 THR -2.36 0.45 1 34 ALA 4.33 2.54 1 35 ASP 3.96 1.99 1 36 GLN 1.96 3.25 1 37 MET 4.31 3.88 1 38 ASP 4.63 3.24 1 39 ASP 4.30 3.51 1 40 MET 3.50 1.85 1 42 MET 3.42 2.27 1 43 MET 7.22 1.24 1 44 ALA 4.34 1.31 1 45 ASP 3.41 2.78 1 46 SER 3.54 3.52 1 47 VAL 5.83 1.61 1 48 ASN 4.49 3.13 1 49 SER 4.37 5.32 1 50 GLN 3.67 1.86 1 51 MET 4.42 3.07 1 52 GLN 3.67 1.89 1 53 LYS 1.16 0.81 1 54 MET 1.85 0.90 1 62 ARG 2.48 2.01 1 63 LEU 3.79 1.37 1 64 ARG 4.23 2.74 1 65 ALA 3.30 2.01 1 66 MET 2.14 1.44 1 67 ASN 5.12 2.20 1 68 THR 6.28 0.68 1 69 ALA 4.01 2.46 1 70 MET 4.82 1.31 1 71 ALA 1.73 1.15 1 72 ALA 3.96 2.40 1 73 GLU 3.33 3.35 1 74 VAL 6.10 1.83 1 75 ALA 2.09 0.99 1 76 GLU 3.15 2.29 1 77 VAL 4.82 3.13 1 78 VAL 5.82 2.56 1 79 ALA 2.06 0.50 1 80 THR 0.45 0.32 1 84 GLN 4.24 1.01 1 85 SER -0.56 -1.47 1 86 TYR 4.84 -0.12 1 87 SER 5.38 1.70 1 88 ALA 3.68 3.49 1 89 VAL 6.71 1.38 1 90 LEU 4.49 1.74 1 91 ASN 3.77 3.28 1 92 THR 7.09 0.21 1 93 ILE 6.30 1.22 1 95 ALA 4.00 3.70 1 97 LEU 4.73 0.08 1 98 ARG 5.43 2.05 1 99 GLU 2.57 2.41 1 101 MET 4.49 2.60 1 102 MET 4.33 3.52 1 103 GLN 3.52 1.61 1 104 ALA 0.09 0.92 1 105 THR -2.65 1.11 1 108 VAL -0.61 -1.16 1 109 ASP -1.30 -0.31 1 111 ALA 3.95 2.60 1 112 PHE 3.00 0.81 1 113 THR 6.95 2.04 1 114 ASN 3.86 2.36 1 115 GLU 3.77 2.32 1 116 VAL 6.10 1.73 1 117 MET 4.95 3.62 1 118 GLN 4.73 2.95 1 119 LEU 2.87 1.17 1 120 VAL 5.93 2.96 1 121 LYS 4.73 1.27 1 122 MET 3.05 2.56 1 123 LEU 1.44 0.36 1 124 SER -0.75 -0.73 1 125 ALA 0.72 0.04 1 126 ASP 0.83 0.74 1 127 SER 1.02 -0.07 1 128 ALA 0.40 -0.28 1 129 ASN -0.16 -0.20 1 130 GLU -0.56 -0.32 1 131 VAL 0.16 -0.22 1 132 SER 0.60 -0.67 1 stop_ save_