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 bmr25194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 -3.23 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 4.25 _LACS_plot.Line_2_terminator_val_y_2 3.17 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 118 ILE -2.24 -4.28 0 10 ARG 0.54 0.28 1 11 LEU 0.26 0.18 1 12 GLN -0.05 0.10 1 13 ASN 0.06 0.02 1 14 PHE 0.16 0.17 1 15 ASP 0.13 0.20 1 16 VAL 0.41 0.17 1 17 THR 0.21 0.16 1 18 SER -0.48 -0.19 1 19 ASP 0.10 0.12 1 20 ILE -0.19 -0.09 1 21 SER -0.36 -0.20 1 22 ASP 0.84 0.64 1 23 ASP 0.17 -0.16 1 24 ASN -1.49 0.01 1 25 PHE -0.98 -0.20 1 26 VAL -5.20 -1.97 1 27 ILE 2.67 2.07 1 28 ASP -0.55 1.59 1 29 LYS 2.97 2.40 1 30 ASN -0.43 0.97 1 31 ASP -2.08 -1.06 1 32 SER 2.96 2.57 1 33 ARG 1.15 -0.57 1 34 LYS -5.11 -2.13 1 35 ILE -6.75 -3.26 1 36 ASP -1.51 -2.19 1 37 TYR -1.61 0.36 1 38 MET 3.02 0.40 1 40 ASN -5.20 -1.79 1 41 ILE -1.75 -0.57 1 42 TYR -3.75 -1.82 1 43 SER -2.15 -1.50 1 44 ILE 3.63 2.42 1 45 SER -2.62 0.11 1 46 ASP -0.53 -0.43 1 47 THR 1.79 1.80 1 48 THR 0.86 1.28 1 49 VAL -0.24 -0.44 1 50 SER -0.90 -0.05 1 51 ASP 4.16 3.40 1 52 GLU 2.38 1.86 1 53 GLU -2.21 -0.53 1 54 LEU 1.27 1.35 1 56 GLU -2.03 -0.38 1 57 TYR 1.54 1.86 1 58 GLN -3.79 -0.48 1 59 ASP -4.37 -1.44 1 60 VAL -4.09 -2.22 1 61 LEU 1.45 1.17 1 62 ALA 2.60 0.15 1 63 GLU -7.75 -1.93 1 64 VAL -3.92 -1.41 1 65 ARG -5.42 -1.51 1 66 VAL -0.97 -1.17 1 67 PHE -6.26 -3.28 1 68 ASP -1.59 0.24 1 69 SER 3.55 3.11 1 70 VAL 3.29 2.50 1 71 SER -1.44 0.49 1 73 LYS 0.97 0.97 1 74 SER 0.99 1.01 1 75 ILE -1.54 -1.09 1 77 ARG 3.02 1.96 1 78 SER 3.19 1.80 1 79 GLU -1.41 -0.92 1 80 TRP 1.50 0.93 1 82 ARG 0.48 0.26 1 83 ILE 0.05 0.11 1 84 ASP 0.03 0.25 1 85 LYS 1.22 0.77 1 86 ASP 0.08 0.18 1 88 SER 0.85 0.84 1 89 ASN 0.46 0.32 1 90 SER 0.72 0.69 1 91 LYS 1.10 0.70 1 92 GLN 0.36 0.47 1 93 SER 0.22 0.02 1 94 ARG -2.57 -0.85 1 95 THR -1.16 -0.10 1 96 GLU -3.79 -2.35 1 97 TRP -7.54 -3.04 1 98 ASP -1.18 -1.41 1 99 TYR -1.94 -1.15 1 101 GLU -2.49 0.30 1 102 ILE -2.71 -1.50 1 103 HIS -6.46 -1.24 1 104 SER -1.09 -0.34 1 105 ILE -3.07 -1.65 1 106 ARG 3.80 2.44 1 108 LYS -4.46 -2.16 1 109 SER -0.22 -0.47 1 110 LEU 1.71 2.43 1 111 THR 2.72 1.83 1 112 GLU -0.93 1.32 1 113 ALA -4.58 -0.41 1 114 PHE -0.10 -0.72 1 115 ALA -6.22 -2.94 1 116 VAL -5.75 -3.43 1 117 GLU -2.28 -0.79 1 119 ASN 4.25 1.26 1 120 ASP 3.07 1.96 1 121 ASP -5.12 -1.38 1 122 PHE 2.69 3.20 1 123 LYS -5.33 -4.31 1 124 LEU 0.02 0.39 1 125 ALA -3.55 -2.50 1 126 THR -3.77 -2.04 1 127 LYS 2.32 1.58 1 128 VAL 0.44 0.29 1 130 ASN 0.14 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 4.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 4.25 _LACS_plot.Line_2_terminator_val_y_2 -1.08 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 118 ILE -2.24 -2.04 0 10 ARG 0.54 -0.26 1 11 LEU 0.26 -0.08 1 12 GLN -0.05 0.15 1 13 ASN 0.06 -0.04 1 14 PHE 0.16 0.01 1 15 ASP 0.13 0.07 1 16 VAL 0.41 -0.24 1 17 THR 0.21 -0.05 1 18 SER -0.48 0.29 1 19 ASP 0.10 0.02 1 20 ILE -0.19 0.10 1 21 SER -0.36 0.16 1 22 ASP 0.84 -0.20 1 23 ASP 0.17 -0.33 1 24 ASN -1.49 1.50 1 25 PHE -0.98 0.78 1 26 VAL -5.20 3.23 1 27 ILE 2.67 -0.60 1 28 ASP -0.55 2.14 1 29 LYS 2.97 -0.57 1 30 ASN -0.43 1.40 1 31 ASP -2.08 1.02 1 32 SER 2.96 -0.39 1 33 ARG 1.15 -1.72 1 34 LYS -5.11 2.98 1 35 ILE -6.75 3.49 1 36 ASP -1.51 -0.68 1 37 TYR -1.61 1.97 1 38 MET 3.02 -2.62 1 40 ASN -5.20 3.41 1 41 ILE -1.75 1.18 1 42 TYR -3.75 1.93 1 43 SER -2.15 0.65 1 44 ILE 3.63 -1.21 1 45 SER -2.62 2.73 1 46 ASP -0.53 0.10 1 47 THR 1.79 0.01 1 48 THR 0.86 0.42 1 49 VAL -0.24 -0.20 1 50 SER -0.90 0.85 1 51 ASP 4.16 -0.76 1 52 GLU 2.38 -0.52 1 53 GLU -2.21 1.68 1 54 LEU 1.27 0.08 1 56 GLU -2.03 1.65 1 57 TYR 1.54 0.32 1 58 GLN -3.79 3.31 1 59 ASP -4.37 2.93 1 60 VAL -4.09 1.87 1 61 LEU 1.45 -0.28 1 62 ALA 2.60 -2.45 1 63 GLU -7.75 5.82 1 64 VAL -3.92 2.51 1 65 ARG -5.42 3.91 1 66 VAL -0.97 -0.20 1 67 PHE -6.26 2.98 1 68 ASP -1.59 1.83 1 69 SER 3.55 -0.44 1 70 VAL 3.29 -0.79 1 71 SER -1.44 1.93 1 73 LYS 0.97 0.00 1 74 SER 0.99 0.02 1 75 ILE -1.54 0.45 1 77 ARG 3.02 -1.06 1 78 SER 3.19 -1.39 1 79 GLU -1.41 0.49 1 80 TRP 1.50 -0.57 1 82 ARG 0.48 -0.22 1 83 ILE 0.05 0.06 1 84 ASP 0.03 0.22 1 85 LYS 1.22 -0.45 1 86 ASP 0.08 0.10 1 88 SER 0.85 -0.01 1 89 ASN 0.46 -0.14 1 90 SER 0.72 -0.03 1 91 LYS 1.10 -0.40 1 92 GLN 0.36 0.11 1 93 SER 0.22 -0.20 1 94 ARG -2.57 1.72 1 95 THR -1.16 1.06 1 96 GLU -3.79 1.44 1 97 TRP -7.54 4.50 1 98 ASP -1.18 -0.23 1 99 TYR -1.94 0.79 1 101 GLU -2.49 2.79 1 102 ILE -2.71 1.21 1 103 HIS -6.46 5.22 1 104 SER -1.09 0.75 1 105 ILE -3.07 1.42 1 106 ARG 3.80 -1.36 1 108 LYS -4.46 2.30 1 109 SER -0.22 -0.25 1 110 LEU 1.71 0.72 1 111 THR 2.72 -0.89 1 112 GLU -0.93 2.25 1 113 ALA -4.58 4.17 1 114 PHE -0.10 -0.62 1 115 ALA -6.22 3.28 1 116 VAL -5.75 2.32 1 117 GLU -2.28 1.49 1 119 ASN 4.25 -2.99 1 120 ASP 3.07 -1.11 1 121 ASP -5.12 3.74 1 122 PHE 2.69 0.51 1 123 LYS -5.33 1.02 1 124 LEU 0.02 0.37 1 125 ALA -3.55 1.05 1 126 THR -3.77 1.73 1 127 LYS 2.32 -0.74 1 128 VAL 0.44 -0.15 1 130 ASN 0.14 1.49 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 0.81 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 4.25 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _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 77 ARG 3.02 -2.28 0 10 ARG 0.54 -0.02 1 11 LEU 0.26 -0.02 1 12 GLN -0.05 -0.09 1 13 ASN 0.06 -0.10 1 14 PHE 0.16 -0.01 1 15 ASP 0.13 0.00 1 16 VAL 0.41 0.08 1 17 THR 0.21 0.04 1 18 SER -0.48 0.01 1 19 ASP 0.10 0.00 1 20 ILE -0.19 0.04 1 21 SER -0.36 0.00 1 22 ASP 0.84 -0.06 1 23 ASP 0.17 -0.18 1 24 ASN -1.49 0.02 1 25 PHE -0.98 0.08 1 26 VAL -5.20 0.26 1 27 ILE 2.67 -0.20 1 28 ASP -0.55 -0.42 1 29 LYS 2.97 -0.36 1 30 ASN -0.43 0.07 1 31 ASP -2.08 -0.22 1 32 SER 2.96 -0.32 1 33 ARG 1.15 0.27 1 34 LYS -5.11 1.30 1 35 ILE -6.75 0.72 1 36 ASP -1.51 1.05 1 37 TYR -1.61 0.18 1 38 MET 3.02 -0.79 1 40 ASN -5.20 0.36 1 41 ILE -1.75 0.82 1 42 TYR -3.75 0.41 1 43 SER -2.15 0.40 1 44 ILE 3.63 -0.33 1 45 SER -2.62 0.32 1 46 ASP -0.53 0.18 1 47 THR 1.79 -0.22 1 48 THR 0.86 0.44 1 49 VAL -0.24 -0.21 1 50 SER -0.90 -0.11 1 51 ASP 4.16 -0.48 1 52 GLU 2.38 -0.25 1 53 GLU -2.21 -0.15 1 54 LEU 1.27 -0.56 1 56 GLU -2.03 0.01 1 57 TYR 1.54 -1.81 1 58 GLN -3.79 -0.05 1 59 ASP -4.37 -0.28 1 60 VAL -4.09 0.57 1 61 LEU 1.45 0.07 1 62 ALA 2.60 0.04 1 63 GLU -7.75 0.60 1 64 VAL -3.92 1.54 1 65 ARG -5.42 0.68 1 66 VAL -0.97 0.62 1 67 PHE -6.26 0.73 1 68 ASP -1.59 0.01 1 69 SER 3.55 -0.58 1 70 VAL 3.29 -0.18 1 71 SER -1.44 0.03 1 73 LYS 0.97 0.00 1 74 SER 0.99 0.08 1 75 ILE -1.54 0.24 1 78 SER 3.19 -0.40 1 79 GLU -1.41 0.13 1 80 TRP 1.50 -0.17 1 82 ARG 0.48 0.01 1 83 ILE 0.05 0.01 1 84 ASP 0.03 -0.01 1 85 LYS 1.22 -0.06 1 86 ASP 0.08 0.00 1 88 SER 0.85 -0.08 1 89 ASN 0.46 0.03 1 90 SER 0.72 -0.07 1 91 LYS 1.10 -0.06 1 92 GLN 0.36 0.00 1 93 SER 0.22 0.01 1 94 ARG -2.57 0.43 1 95 THR -1.16 -0.36 1 96 GLU -3.79 0.61 1 97 TRP -7.54 0.44 1 98 ASP -1.18 0.61 1 99 TYR -1.94 0.53 1 101 GLU -2.49 0.32 1 102 ILE -2.71 1.01 1 103 HIS -6.46 0.58 1 104 SER -1.09 0.16 1 105 ILE -3.07 0.21 1 106 ARG 3.80 -0.36 1 108 LYS -4.46 0.52 1 109 SER -0.22 0.18 1 110 LEU 1.71 0.35 1 111 THR 2.72 -0.07 1 112 GLU -0.93 0.25 1 113 ALA -4.58 0.82 1 114 PHE -0.10 -0.08 1 115 ALA -6.22 1.19 1 116 VAL -5.75 0.95 1 117 GLU -2.28 -0.86 1 118 ILE -2.24 0.15 1 119 ASN 4.25 -0.39 1 120 ASP 3.07 -0.55 1 121 ASP -5.12 0.30 1 122 PHE 2.69 -0.41 1 123 LYS -5.33 0.73 1 124 LEU 0.02 -0.27 1 125 ALA -3.55 1.27 1 126 THR -3.77 0.63 1 127 LYS 2.32 -0.67 1 128 VAL 0.44 0.01 1 130 ASN 0.14 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25194_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 -2.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.84 _LACS_plot.Line_2_terminator_val_x_2 4.25 _LACS_plot.Line_2_terminator_val_y_2 0.43 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 ASN 0.14 4.54 0 11 LEU 0.26 -0.52 1 12 GLN -0.05 -0.81 1 13 ASN 0.06 -0.46 1 14 PHE 0.16 -0.58 1 15 ASP 0.13 -0.15 1 16 VAL 0.41 0.15 1 17 THR 0.21 -0.08 1 18 SER -0.48 -0.58 1 19 ASP 0.10 -0.33 1 20 ILE -0.19 -0.29 1 21 SER -0.36 -0.15 1 22 ASP 0.84 -0.78 1 23 ASP 0.17 -1.17 1 24 ASN -1.49 -1.17 1 25 PHE -0.98 -0.65 1 26 VAL -5.20 -1.26 1 27 ILE 2.67 -0.31 1 28 ASP -0.55 0.43 1 29 LYS 2.97 0.58 1 30 ASN -0.43 -0.40 1 31 ASP -2.08 -1.38 1 32 SER 2.96 -1.87 1 33 ARG 1.15 -2.13 1 34 LYS -5.11 -2.06 1 35 ILE -6.75 -2.19 1 36 ASP -1.51 -1.36 1 37 TYR -1.61 -1.03 1 38 MET 3.02 -0.91 1 40 ASN -5.20 -1.85 1 41 ILE -1.75 -2.37 1 42 TYR -3.75 -0.40 1 43 SER -2.15 0.18 1 44 ILE 3.63 -1.36 1 45 SER -2.62 -2.16 1 46 ASP -0.53 1.18 1 47 THR 1.79 -1.35 1 48 THR 0.86 -0.24 1 49 VAL -0.24 -1.77 1 50 SER -0.90 0.52 1 51 ASP 4.16 2.36 1 52 GLU 2.38 0.61 1 53 GLU -2.21 -0.86 1 54 LEU 1.27 -0.75 1 56 GLU -2.03 0.05 1 57 TYR 1.54 -1.81 1 58 GLN -3.79 -1.77 1 59 ASP -4.37 -3.58 1 60 VAL -4.09 -3.04 1 61 LEU 1.45 -1.15 1 62 ALA 2.60 -1.59 1 63 GLU -7.75 -2.23 1 64 VAL -3.92 1.11 1 65 ARG -5.42 -2.27 1 66 VAL -0.97 -1.11 1 67 PHE -6.26 -2.42 1 68 ASP -1.59 1.27 1 69 SER 3.55 0.16 1 70 VAL 3.29 1.10 1 71 SER -1.44 1.57 1 73 LYS 0.97 0.40 1 74 SER 0.99 -0.45 1 75 ILE -1.54 -0.30 1 77 ARG 3.02 1.84 1 78 SER 3.19 0.99 1 79 GLU -1.41 1.06 1 80 TRP 1.50 1.50 1 82 ARG 0.48 0.05 1 83 ILE 0.05 -0.46 1 84 ASP 0.03 0.28 1 85 LYS 1.22 0.05 1 86 ASP 0.08 0.64 1 88 SER 0.85 0.24 1 89 ASN 0.46 0.43 1 90 SER 0.72 0.41 1 91 LYS 1.10 0.16 1 92 GLN 0.36 -0.01 1 93 SER 0.22 -0.57 1 94 ARG -2.57 -1.31 1 95 THR -1.16 -4.40 1 96 GLU -3.79 -1.87 1 97 TRP -7.54 -3.37 1 98 ASP -1.18 -0.31 1 99 TYR -1.94 0.96 1 101 GLU -2.49 -1.68 1 102 ILE -2.71 0.20 1 103 HIS -6.46 0.34 1 104 SER -1.09 -1.72 1 105 ILE -3.07 0.18 1 106 ARG 3.80 1.21 1 108 LYS -4.46 0.02 1 109 SER -0.22 1.96 1 110 LEU 1.71 -0.51 1 111 THR 2.72 0.78 1 112 GLU -0.93 -0.18 1 113 ALA -4.58 -3.58 1 114 PHE -0.10 -4.48 1 115 ALA -6.22 -2.00 1 116 VAL -5.75 -2.75 1 117 GLU -2.28 -2.49 1 118 ILE -2.24 0.07 1 119 ASN 4.25 -0.38 1 120 ASP 3.07 -2.05 1 121 ASP -5.12 -1.49 1 122 PHE 2.69 -0.80 1 123 LYS -5.33 0.18 1 124 LEU 0.02 -2.53 1 125 ALA -3.55 -2.14 1 126 THR -3.77 -0.67 1 127 LYS 2.32 0.30 1 128 VAL 0.44 0.05 1 stop_ save_