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 bmr27435_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _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 -1.84 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 4.02 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 LEU 0.93 3.56 0 80 MET -6.16 -0.51 0 10 THR -1.15 -1.23 1 12 SER -0.11 -0.47 1 13 TRP -0.94 -1.83 1 15 LEU -2.78 -0.82 1 16 TYR -5.30 -1.33 1 17 LYS -4.65 -2.46 1 18 ASP -2.43 -3.18 1 19 ALA 3.17 1.58 1 20 ASP 0.43 -1.20 1 22 VAL 2.37 0.53 1 23 TYR -4.66 -4.90 1 24 VAL -2.16 -3.24 1 25 SER 0.38 -0.11 1 26 ALA -5.87 -1.66 1 27 LEU 3.34 2.98 1 29 ILE -0.92 -1.07 1 30 LYS 1.92 0.82 1 31 ALA -3.23 -1.37 1 32 ILE -2.45 -0.87 1 33 LYS -2.51 -2.80 1 34 TYR 1.01 1.16 1 35 ALA -4.09 -2.35 1 36 ASN 3.40 2.04 1 37 ASP 0.41 -1.25 1 40 ALA -4.07 -1.75 1 41 ASN 0.24 -1.46 1 42 ALA -0.26 0.09 1 43 GLU -4.43 -3.79 1 44 PHE -4.77 -1.62 1 45 ASP -0.56 -0.35 1 48 TYR -2.86 -1.24 1 49 ALA -0.80 -0.97 1 50 ASP 1.18 -0.40 1 51 GLN -1.95 0.63 1 52 TYR -5.40 -2.87 1 53 MET 6.03 2.75 1 54 SER -1.71 -1.31 1 55 ALA 4.36 2.36 1 56 GLN 4.90 2.90 1 57 THR 6.55 4.25 1 58 VAL 6.36 4.57 1 59 ALA 3.40 1.89 1 60 VAL 3.40 2.10 1 61 PHE 0.98 -0.06 1 62 LYS 4.94 1.64 1 64 GLU -6.24 -3.65 1 65 VAL 5.10 2.98 1 68 TYR -0.92 -0.69 1 70 PHE -4.82 -2.43 1 71 ARG -4.19 -3.10 1 72 SER -3.65 -1.95 1 73 GLN 3.80 1.97 1 74 TYR 0.26 -1.24 1 76 GLU -0.90 -1.14 1 77 LEU -0.27 -0.70 1 78 LEU -4.00 -1.88 1 79 TYR -5.42 -2.56 1 81 SER -1.07 -0.94 1 82 LYS 5.36 4.35 1 83 THR 4.51 2.90 1 84 ALA 3.30 1.80 1 86 GLU 2.97 0.85 1 87 ALA 1.02 0.37 1 88 ASN -2.23 1.07 1 89 TYR -1.51 -0.69 1 90 THR -3.27 -1.90 1 91 SER 2.23 1.19 1 92 ALA -1.09 -1.05 1 93 SER 0.37 -0.18 1 95 SER 0.38 -0.17 1 96 VAL 0.66 -0.23 1 97 ALA 0.49 -0.11 1 98 ASN 0.26 -0.12 1 99 ALA 0.71 0.10 1 100 GLU 0.89 -0.54 1 101 THR 0.33 -0.16 1 102 ALA 0.91 0.30 1 103 ASP 1.60 -0.29 1 104 LYS 1.24 0.08 1 105 LEU 0.96 -0.09 1 106 SER 0.96 0.18 1 107 THR 0.15 -0.34 1 108 ALA 0.50 0.01 1 109 ARG 0.54 -0.21 1 110 THR 0.52 0.03 1 111 ILE 0.54 -0.19 1 112 THR -0.06 -0.51 1 113 LEU -0.27 -0.25 1 114 THR 0.13 -0.33 1 116 ALA -0.10 -0.42 1 117 VAL 0.56 -0.34 1 118 THR -0.08 -0.36 1 120 SER -0.05 -0.52 1 121 ALA 0.49 -0.11 1 122 SER 0.14 -0.41 1 123 PHE 0.32 -0.27 1 124 ASP 0.66 -0.98 1 126 SER 0.41 -0.14 1 127 ALA 0.33 -0.22 1 128 ASN 0.27 -0.10 1 129 VAL 0.44 -0.40 1 130 THR 0.25 -0.22 1 131 ILE 0.18 -0.55 1 132 GLU 0.10 -1.08 1 133 THR -0.05 -0.47 1 134 THR -0.11 -0.60 1 135 SER 0.46 -0.09 1 137 SER 0.39 0.77 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27435_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 3.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -2.52 _LACS_plot.Y_axis_chem_shift_offset 0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 LEU 0.93 2.63 0 80 MET -6.16 5.65 0 10 THR -1.15 -0.08 1 12 SER -0.11 -0.36 1 13 TRP -0.94 -0.89 1 15 LEU -2.78 1.96 1 16 TYR -5.30 3.97 1 17 LYS -4.65 2.19 1 18 ASP -2.43 -0.75 1 19 ALA 3.17 -1.59 1 20 ASP 0.43 -1.63 1 22 VAL 2.37 -1.84 1 23 TYR -4.66 -0.24 1 24 VAL -2.16 -1.08 1 25 SER 0.38 -0.49 1 26 ALA -5.87 4.21 1 27 LEU 3.34 -0.36 1 29 ILE -0.92 -0.15 1 30 LYS 1.92 -1.10 1 31 ALA -3.23 1.86 1 32 ILE -2.45 1.58 1 33 LYS -2.51 -0.29 1 34 TYR 1.01 0.15 1 35 ALA -4.09 1.74 1 36 ASN 3.40 -1.36 1 37 ASP 0.41 -1.66 1 40 ALA -4.07 2.32 1 41 ASN 0.24 -1.70 1 42 ALA -0.26 0.35 1 43 GLU -4.43 0.64 1 44 PHE -4.77 3.15 1 45 ASP -0.56 0.21 1 48 TYR -2.86 1.62 1 49 ALA -0.80 -0.17 1 50 ASP 1.18 -1.58 1 51 GLN -1.95 2.58 1 52 TYR -5.40 2.53 1 53 MET 6.03 -3.28 1 54 SER -1.71 0.40 1 55 ALA 4.36 -2.00 1 56 GLN 4.90 -2.00 1 57 THR 6.55 -2.30 1 58 VAL 6.36 -1.79 1 59 ALA 3.40 -1.51 1 60 VAL 3.40 -1.30 1 61 PHE 0.98 -1.04 1 62 LYS 4.94 -3.30 1 64 GLU -6.24 2.59 1 65 VAL 5.10 -2.12 1 68 TYR -0.92 0.23 1 70 PHE -4.82 2.39 1 71 ARG -4.19 1.09 1 72 SER -3.65 1.70 1 73 GLN 3.80 -1.83 1 74 TYR 0.26 -1.50 1 76 GLU -0.90 -0.24 1 77 LEU -0.27 -0.43 1 78 LEU -4.00 2.12 1 79 TYR -5.42 2.86 1 81 SER -1.07 0.13 1 82 LYS 5.36 -1.01 1 83 THR 4.51 -1.61 1 84 ALA 3.30 -1.50 1 86 GLU 2.97 -2.12 1 87 ALA 1.02 -0.65 1 88 ASN -2.23 3.30 1 89 TYR -1.51 0.82 1 90 THR -3.27 1.37 1 91 SER 2.23 -1.04 1 92 ALA -1.09 0.04 1 93 SER 0.37 -0.55 1 95 SER 0.38 -0.55 1 96 VAL 0.66 -0.89 1 97 ALA 0.49 -0.60 1 98 ASN 0.26 -0.38 1 99 ALA 0.71 -0.61 1 100 GLU 0.89 -1.43 1 101 THR 0.33 -0.49 1 102 ALA 0.91 -0.61 1 103 ASP 1.60 -1.89 1 104 LYS 1.24 -1.16 1 105 LEU 0.96 -1.05 1 106 SER 0.96 -0.78 1 107 THR 0.15 -0.49 1 108 ALA 0.50 -0.49 1 109 ARG 0.54 -0.75 1 110 THR 0.52 -0.49 1 111 ILE 0.54 -0.73 1 112 THR -0.06 -0.45 1 113 LEU -0.27 0.02 1 114 THR 0.13 -0.46 1 116 ALA -0.10 -0.32 1 117 VAL 0.56 -0.90 1 118 THR -0.08 -0.28 1 120 SER -0.05 -0.47 1 121 ALA 0.49 -0.60 1 122 SER 0.14 -0.55 1 123 PHE 0.32 -0.59 1 124 ASP 0.66 -1.64 1 126 SER 0.41 -0.55 1 127 ALA 0.33 -0.55 1 128 ASN 0.27 -0.37 1 129 VAL 0.44 -0.84 1 130 THR 0.25 -0.47 1 131 ILE 0.18 -0.73 1 132 GLU 0.10 -1.18 1 133 THR -0.05 -0.42 1 134 THR -0.11 -0.49 1 135 SER 0.46 -0.55 1 137 SER 0.39 0.38 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27435_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _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 -0.13 _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 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.51 _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 27 LEU 3.34 1.20 0 10 THR -1.15 -0.12 1 12 SER -0.11 0.04 1 13 TRP -0.94 0.66 1 15 LEU -2.78 0.78 1 16 TYR -5.30 0.45 1 17 LYS -4.65 1.22 1 18 ASP -2.43 0.19 1 19 ALA 3.17 -0.35 1 20 ASP 0.43 0.07 1 23 TYR -4.66 0.33 1 24 VAL -2.16 -0.18 1 25 SER 0.38 -0.24 1 26 ALA -5.87 0.56 1 29 ILE -0.92 0.58 1 30 LYS 1.92 -0.02 1 31 ALA -3.23 -0.01 1 32 ILE -2.45 0.14 1 33 LYS -2.51 0.29 1 34 TYR 1.01 0.06 1 35 ALA -4.09 0.43 1 36 ASN 3.40 -0.19 1 37 ASP 0.41 -0.05 1 40 ALA -4.07 0.57 1 41 ASN 0.24 0.47 1 42 ALA -0.26 0.13 1 43 GLU -4.43 0.51 1 44 PHE -4.77 -0.38 1 45 ASP -0.56 0.23 1 48 TYR -2.86 0.01 1 49 ALA -0.80 0.03 1 50 ASP 1.18 0.06 1 51 GLN -1.95 0.59 1 52 TYR -5.40 -0.14 1 53 MET 6.03 -0.19 1 54 SER -1.71 -0.05 1 55 ALA 4.36 0.25 1 56 GLN 4.90 -0.23 1 57 THR 6.55 -0.71 1 58 VAL 6.36 -0.98 1 59 ALA 3.40 -0.24 1 60 VAL 3.40 -0.32 1 61 PHE 0.98 -0.05 1 62 LYS 4.94 -0.70 1 64 GLU -6.24 0.20 1 65 VAL 5.10 -0.95 1 68 TYR -0.92 0.15 1 69 LEU 0.93 0.90 1 70 PHE -4.82 1.36 1 71 ARG -4.19 1.05 1 72 SER -3.65 0.34 1 73 GLN 3.80 -0.34 1 74 TYR 0.26 0.15 1 76 GLU -0.90 -0.13 1 77 LEU -0.27 0.25 1 78 LEU -4.00 -0.11 1 79 TYR -5.42 0.94 1 80 MET -6.16 -0.26 1 81 SER -1.07 0.00 1 82 LYS 5.36 -0.04 1 83 THR 4.51 -0.41 1 84 ALA 3.30 -0.24 1 86 GLU 2.97 -0.39 1 87 ALA 1.02 -0.10 1 88 ASN -2.23 -0.29 1 89 TYR -1.51 -0.05 1 90 THR -3.27 0.29 1 91 SER 2.23 0.54 1 92 ALA -1.09 0.16 1 93 SER 0.37 -0.04 1 95 SER 0.38 0.00 1 96 VAL 0.66 -0.01 1 97 ALA 0.49 -0.09 1 98 ASN 0.26 -0.10 1 99 ALA 0.71 -0.09 1 100 GLU 0.89 0.04 1 101 THR 0.33 -0.09 1 102 ALA 0.91 -0.07 1 103 ASP 1.60 -0.10 1 104 LYS 1.24 -0.07 1 105 LEU 0.96 -0.08 1 106 SER 0.96 -0.01 1 107 THR 0.15 -0.08 1 108 ALA 0.50 -0.03 1 109 ARG 0.54 0.01 1 110 THR 0.52 -0.07 1 111 ILE 0.54 0.03 1 112 THR -0.06 -0.03 1 113 LEU -0.27 0.08 1 114 THR 0.13 -0.03 1 116 ALA -0.10 0.04 1 117 VAL 0.56 0.11 1 118 THR -0.08 -0.02 1 120 SER -0.05 0.20 1 121 ALA 0.49 0.00 1 122 SER 0.14 -0.09 1 123 PHE 0.32 0.05 1 124 ASP 0.66 -0.02 1 126 SER 0.41 -0.08 1 127 ALA 0.33 0.01 1 128 ASN 0.27 -0.02 1 129 VAL 0.44 0.12 1 130 THR 0.25 0.00 1 131 ILE 0.18 0.06 1 132 GLU 0.10 0.08 1 133 THR -0.05 0.08 1 134 THR -0.11 0.12 1 135 SER 0.46 0.05 1 137 SER 0.39 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27435_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -2.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 1.88 _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 55 ALA 4.36 -6.86 0 10 THR -1.15 -0.98 1 12 SER -0.11 -0.24 1 13 TRP -0.94 -1.11 1 15 LEU -2.78 0.12 1 16 TYR -5.30 -2.19 1 17 LYS -4.65 -0.22 1 18 ASP -2.43 1.82 1 19 ALA 3.17 0.84 1 20 ASP 0.43 -0.44 1 22 VAL 2.37 -0.67 1 23 TYR -4.66 -1.65 1 24 VAL -2.16 -0.79 1 25 SER 0.38 -2.56 1 26 ALA -5.87 -3.07 1 27 LEU 3.34 -1.15 1 29 ILE -0.92 0.83 1 30 LYS 1.92 -1.59 1 31 ALA -3.23 -3.86 1 32 ILE -2.45 -2.60 1 33 LYS -2.51 -0.21 1 34 TYR 1.01 -0.11 1 35 ALA -4.09 1.81 1 36 ASN 3.40 0.38 1 37 ASP 0.41 0.46 1 40 ALA -4.07 -3.93 1 41 ASN 0.24 -0.65 1 42 ALA -0.26 -3.14 1 43 GLU -4.43 -1.82 1 44 PHE -4.77 -0.58 1 45 ASP -0.56 -0.05 1 48 TYR -2.86 -0.23 1 49 ALA -0.80 -0.73 1 50 ASP 1.18 -0.23 1 51 GLN -1.95 -1.80 1 52 TYR -5.40 1.94 1 53 MET 6.03 -3.46 1 54 SER -1.71 -1.08 1 56 GLN 4.90 1.64 1 57 THR 6.55 1.45 1 58 VAL 6.36 2.17 1 59 ALA 3.40 1.58 1 60 VAL 3.40 2.01 1 61 PHE 0.98 -0.45 1 62 LYS 4.94 -1.44 1 64 GLU -6.24 -0.89 1 65 VAL 5.10 1.19 1 68 TYR -0.92 0.05 1 69 LEU 0.93 -1.82 1 70 PHE -4.82 -3.13 1 71 ARG -4.19 1.42 1 72 SER -3.65 1.59 1 73 GLN 3.80 -0.05 1 74 TYR 0.26 0.45 1 76 GLU -0.90 -1.90 1 77 LEU -0.27 -3.20 1 78 LEU -4.00 -4.53 1 79 TYR -5.42 -0.87 1 80 MET -6.16 -3.73 1 81 SER -1.07 -1.43 1 82 LYS 5.36 1.76 1 83 THR 4.51 2.64 1 84 ALA 3.30 1.91 1 86 GLU 2.97 1.09 1 87 ALA 1.02 0.50 1 88 ASN -2.23 -1.30 1 89 TYR -1.51 -1.04 1 90 THR -3.27 -0.42 1 91 SER 2.23 0.41 1 92 ALA -1.09 -0.93 1 93 SER 0.37 0.41 1 95 SER 0.38 0.09 1 96 VAL 0.66 -0.17 1 97 ALA 0.49 -0.13 1 98 ASN 0.26 -0.02 1 99 ALA 0.71 0.20 1 100 GLU 0.89 0.16 1 101 THR 0.33 0.05 1 102 ALA 0.91 0.04 1 103 ASP 1.60 -0.17 1 104 LYS 1.24 -0.38 1 105 LEU 0.96 0.20 1 106 SER 0.96 0.59 1 107 THR 0.15 -0.16 1 108 ALA 0.50 -0.01 1 109 ARG 0.54 0.24 1 110 THR 0.52 -0.16 1 111 ILE 0.54 -0.15 1 112 THR -0.06 -0.17 1 113 LEU -0.27 -0.08 1 114 THR 0.13 0.46 1 116 ALA -0.10 0.09 1 117 VAL 0.56 0.28 1 118 THR -0.08 0.48 1 120 SER -0.05 -0.22 1 121 ALA 0.49 -0.12 1 122 SER 0.14 -0.22 1 123 PHE 0.32 -0.18 1 124 ASP 0.66 -0.19 1 126 SER 0.41 -0.18 1 127 ALA 0.33 -0.42 1 128 ASN 0.27 -0.06 1 129 VAL 0.44 -0.03 1 130 THR 0.25 -0.30 1 131 ILE 0.18 -0.26 1 132 GLU 0.10 -0.34 1 133 THR -0.05 0.15 1 134 THR -0.11 -0.01 1 135 SER 0.46 0.43 1 137 SER 0.39 3.70 1 stop_ save_