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 bmr15692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.22 _LACS_plot.Line_1_terminator_val_y_1 -3.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _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 3.81 _LACS_plot.Line_2_terminator_val_y_2 2.65 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 99 ALA -9.22 -1.25 0 116 GLN 1.38 4.20 0 10 THR 0.62 -0.15 1 11 LYS -4.62 -0.81 1 12 ALA -5.90 -1.21 1 13 THR 1.82 1.87 1 14 LEU -4.95 -1.57 1 15 GLU -5.01 -2.70 1 16 GLU 0.45 0.71 1 18 GLN -4.22 -1.25 1 19 GLN -5.53 -2.22 1 20 LEU -5.48 -2.25 1 21 THR 0.03 0.90 1 22 LEU -5.15 -1.65 1 23 THR 1.74 0.90 1 24 PHE -3.56 -1.11 1 25 ILE -1.58 0.11 1 26 SER -3.00 -1.57 1 27 THR 2.26 1.94 1 28 LYS 0.69 1.73 1 29 LEU -5.17 -1.79 1 30 ASP -3.49 -0.60 1 31 VAL -3.37 -1.07 1 32 ALA -3.44 -1.28 1 33 VAL 1.19 -0.84 1 35 SER -1.88 -1.79 1 37 HIS -0.74 2.55 1 38 SER -2.77 -0.52 1 39 LEU -1.89 0.64 1 40 VAL -5.08 -2.11 1 41 ALA -2.49 -1.90 1 42 ASN -1.38 -1.88 1 43 PHE 2.53 1.83 1 44 LEU 2.88 2.53 1 45 ASP -0.50 0.75 1 47 PHE -2.65 -0.67 1 48 LEU -3.39 -1.20 1 49 LYS -5.46 -1.83 1 50 PHE -4.73 -2.13 1 51 GLN -3.97 -0.65 1 52 THR 0.17 0.45 1 56 SER -0.22 -0.26 1 57 ALA -1.25 -0.52 1 58 PHE -3.24 -1.38 1 59 ASP -6.11 -0.82 1 60 VAL -3.37 0.03 1 67 ALA -1.56 -0.14 1 70 ALA -4.98 -0.69 1 71 VAL -3.43 -0.52 1 72 LEU -6.98 -2.17 1 73 THR -0.97 -0.41 1 74 ILE -4.43 -1.21 1 76 LEU -3.35 -1.64 1 78 HIS 0.17 1.82 1 79 LYS 3.82 0.85 1 81 ARG 1.75 1.57 1 82 LEU -5.43 -1.18 1 83 ALA -5.51 -2.26 1 84 VAL -3.50 -1.56 1 85 VAL -3.90 -1.02 1 86 LEU -3.93 -1.19 1 87 ASP -2.64 0.23 1 90 ARG -2.33 0.49 1 91 LEU 2.70 2.50 1 92 ASN 1.57 0.00 1 93 ALA 2.12 1.19 1 94 ALA -1.85 -0.74 1 95 LEU -2.23 -0.56 1 97 SER -1.73 0.33 1 98 ALA -4.92 -1.69 1 100 TYR -5.07 -1.86 1 101 VAL -4.90 -2.04 1 102 VAL -4.83 -1.78 1 103 GLU 1.35 1.51 1 104 ASP -0.51 -0.97 1 105 SER 0.93 2.44 1 108 SER -0.68 -0.22 1 109 SER 1.34 1.49 1 110 SER -0.21 -0.19 1 111 GLU -2.47 2.23 1 112 GLU -1.43 -0.46 1 113 VAL -0.83 -1.22 1 114 SER -2.48 -0.97 1 115 PHE -3.74 -1.44 1 118 VAL 1.78 0.35 1 120 SER -0.32 0.30 1 122 ALA -0.67 0.57 1 123 THR -4.45 -1.64 1 124 LEU -5.98 -1.20 1 125 VAL -4.40 -1.51 1 126 VAL -1.79 -0.99 1 127 THR -4.97 -2.16 1 128 THR 2.19 1.94 1 129 LEU 1.69 1.34 1 131 GLU -2.03 -1.21 1 132 SER -0.26 0.11 1 134 THR 0.70 0.39 1 135 ALA 0.43 0.58 1 136 VAL 0.81 0.57 1 137 SER 0.58 0.37 1 138 ALA -0.01 0.21 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.22 _LACS_plot.Line_1_terminator_val_y_1 6.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.04 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 -1.16 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 99 ALA -9.22 7.97 0 116 GLN 1.38 2.82 0 10 THR 0.62 -0.77 1 11 LYS -4.62 3.81 1 12 ALA -5.90 4.69 1 13 THR 1.82 0.05 1 14 LEU -4.95 3.38 1 15 GLU -5.01 2.31 1 16 GLU 0.45 0.26 1 18 GLN -4.22 2.97 1 19 GLN -5.53 3.31 1 20 LEU -5.48 3.23 1 21 THR 0.03 0.87 1 22 LEU -5.15 3.50 1 23 THR 1.74 -0.84 1 24 PHE -3.56 2.45 1 25 ILE -1.58 1.69 1 26 SER -3.00 1.43 1 27 THR 2.26 -0.32 1 28 LYS 0.69 1.04 1 29 LEU -5.17 3.38 1 30 ASP -3.49 2.89 1 31 VAL -3.37 2.30 1 32 ALA -3.44 2.16 1 33 VAL 1.19 -2.03 1 35 SER -1.88 0.09 1 37 HIS -0.74 3.29 1 38 SER -2.77 2.25 1 39 LEU -1.89 2.53 1 40 VAL -5.08 2.97 1 41 ALA -2.49 0.59 1 42 ASN -1.38 -0.50 1 43 PHE 2.53 -0.70 1 44 LEU 2.88 -0.35 1 45 ASP -0.50 1.25 1 47 PHE -2.65 1.98 1 48 LEU -3.39 2.19 1 49 LYS -5.46 3.63 1 50 PHE -4.73 2.60 1 51 GLN -3.97 3.32 1 52 THR 0.17 0.28 1 56 SER -0.22 -0.04 1 57 ALA -1.25 0.73 1 58 PHE -3.24 1.86 1 59 ASP -6.11 5.29 1 60 VAL -3.37 3.40 1 67 ALA -1.56 1.42 1 70 ALA -4.98 4.29 1 71 VAL -3.43 2.91 1 72 LEU -6.98 4.81 1 73 THR -0.97 0.56 1 74 ILE -4.43 3.22 1 76 LEU -3.35 1.71 1 78 HIS 0.17 1.65 1 79 LYS 3.82 -2.97 1 81 ARG 1.75 -0.18 1 82 LEU -5.43 4.25 1 83 ALA -5.51 3.25 1 84 VAL -3.50 1.94 1 85 VAL -3.90 2.88 1 86 LEU -3.93 2.74 1 87 ASP -2.64 2.87 1 90 ARG -2.33 2.82 1 91 LEU 2.70 -0.20 1 92 ASN 1.57 -1.57 1 93 ALA 2.12 -0.93 1 94 ALA -1.85 1.11 1 95 LEU -2.23 1.67 1 97 SER -1.73 2.06 1 98 ALA -4.92 3.23 1 100 TYR -5.07 3.21 1 101 VAL -4.90 2.86 1 102 VAL -4.83 3.05 1 103 GLU 1.35 0.16 1 104 ASP -0.51 -0.46 1 105 SER 0.93 1.51 1 108 SER -0.68 0.46 1 109 SER 1.34 0.15 1 110 SER -0.21 0.02 1 111 GLU -2.47 4.70 1 112 GLU -1.43 0.97 1 113 VAL -0.83 -0.39 1 114 SER -2.48 1.51 1 115 PHE -3.74 2.30 1 118 VAL 1.78 -1.43 1 120 SER -0.32 0.62 1 122 ALA -0.67 1.24 1 123 THR -4.45 2.81 1 124 LEU -5.98 4.78 1 125 VAL -4.40 2.89 1 126 VAL -1.79 0.80 1 127 THR -4.97 2.81 1 128 THR 2.19 -0.25 1 129 LEU 1.69 -0.35 1 131 GLU -2.03 0.82 1 132 SER -0.26 0.37 1 134 THR 0.70 -0.31 1 135 ALA 0.43 0.15 1 136 VAL 0.81 -0.24 1 137 SER 0.58 -0.21 1 138 ALA -0.01 0.22 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.22 _LACS_plot.Line_1_terminator_val_y_1 1.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.40 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 -0.42 _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 23 THR 1.74 0.71 0 99 ALA -9.22 1.03 0 59 ASP -6.11 0.09 0 10 THR 0.62 0.33 1 11 LYS -4.62 1.48 1 12 ALA -5.90 0.44 1 13 THR 1.82 0.30 1 14 LEU -4.95 0.29 1 15 GLU -5.01 0.71 1 16 GLU 0.45 -0.52 1 18 GLN -4.22 0.74 1 20 LEU -5.48 1.04 1 25 ILE -1.58 0.50 1 26 SER -3.00 0.21 1 27 THR 2.26 -0.10 1 28 LYS 0.69 0.74 1 29 LEU -5.17 0.66 1 30 ASP -3.49 0.65 1 31 VAL -3.37 0.74 1 32 ALA -3.44 0.60 1 35 SER -1.88 0.26 1 37 HIS -0.74 0.44 1 38 SER -2.77 0.72 1 39 LEU -1.89 1.09 1 40 VAL -5.08 0.94 1 41 ALA -2.49 0.42 1 42 ASN -1.38 0.01 1 43 PHE 2.53 -0.49 1 44 LEU 2.88 -0.08 1 45 ASP -0.50 0.05 1 47 PHE -2.65 0.72 1 48 LEU -3.39 1.08 1 49 LYS -5.46 1.34 1 50 PHE -4.73 0.76 1 52 THR 0.17 0.44 1 56 SER -0.22 -0.16 1 57 ALA -1.25 -0.04 1 58 PHE -3.24 0.27 1 67 ALA -1.56 0.01 1 70 ALA -4.98 0.62 1 71 VAL -3.43 1.17 1 72 LEU -6.98 1.51 1 74 ILE -4.43 0.71 1 76 LEU -3.35 0.65 1 78 HIS 0.17 -0.34 1 79 LYS 3.82 -0.59 1 81 ARG 1.75 0.15 1 82 LEU -5.43 0.68 1 83 ALA -5.51 0.87 1 84 VAL -3.50 0.66 1 85 VAL -3.90 0.31 1 86 LEU -3.93 1.08 1 90 ARG -2.33 0.79 1 91 LEU 2.70 -0.35 1 92 ASN 1.57 -0.22 1 93 ALA 2.12 -0.37 1 94 ALA -1.85 0.10 1 95 LEU -2.23 0.25 1 97 SER -1.73 1.25 1 98 ALA -4.92 0.93 1 101 VAL -4.90 1.08 1 103 GLU 1.35 -0.25 1 104 ASP -0.51 0.01 1 105 SER 0.93 -0.38 1 108 SER -0.68 0.07 1 109 SER 1.34 -0.17 1 110 SER -0.21 0.52 1 111 GLU -2.47 0.44 1 112 GLU -1.43 0.19 1 113 VAL -0.83 0.76 1 114 SER -2.48 0.62 1 115 PHE -3.74 0.48 1 116 GLN 1.38 0.49 1 118 VAL 1.78 -0.33 1 120 SER -0.32 0.16 1 122 ALA -0.67 0.46 1 123 THR -4.45 0.66 1 124 LEU -5.98 1.03 1 125 VAL -4.40 0.71 1 126 VAL -1.79 0.98 1 127 THR -4.97 0.44 1 128 THR 2.19 -0.05 1 129 LEU 1.69 -0.41 1 131 GLU -2.03 0.00 1 134 THR 0.70 -0.19 1 135 ALA 0.43 -0.08 1 136 VAL 0.81 -0.14 1 137 SER 0.58 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15692_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.22 _LACS_plot.Line_1_terminator_val_y_1 -3.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 3.81 _LACS_plot.Line_2_terminator_val_y_2 0.17 _LACS_plot.Y_axis_chem_shift_offset 0.92 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 ARG -2.33 2.31 0 10 THR 0.62 -3.12 1 11 LYS -4.62 -1.59 1 12 ALA -5.90 -2.37 1 13 THR 1.82 -2.03 1 14 LEU -4.95 -4.46 1 15 GLU -5.01 -1.08 1 16 GLU 0.45 0.89 1 18 GLN -4.22 -2.85 1 20 LEU -5.48 -1.58 1 21 THR 0.03 -0.94 1 22 LEU -5.15 -2.47 1 23 THR 1.74 -0.52 1 25 ILE -1.58 -1.17 1 26 SER -3.00 -0.90 1 27 THR 2.26 0.61 1 28 LYS 0.69 -3.67 1 29 LEU -5.17 -3.84 1 30 ASP -3.49 -1.08 1 31 VAL -3.37 -2.21 1 32 ALA -3.44 -2.30 1 33 VAL 1.19 -2.87 1 35 SER -1.88 0.20 1 37 HIS -0.74 -1.07 1 38 SER -2.77 -3.91 1 39 LEU -1.89 -2.72 1 40 VAL -5.08 -2.12 1 41 ALA -2.49 -4.01 1 42 ASN -1.38 -0.17 1 43 PHE 2.53 0.35 1 44 LEU 2.88 0.23 1 45 ASP -0.50 0.58 1 47 PHE -2.65 -4.21 1 48 LEU -3.39 -3.23 1 49 LYS -5.46 -1.80 1 50 PHE -4.73 -2.03 1 51 GLN -3.97 -2.34 1 52 THR 0.17 -0.01 1 56 SER -0.22 -0.72 1 57 ALA -1.25 -2.09 1 58 PHE -3.24 -1.50 1 59 ASP -6.11 -2.89 1 67 ALA -1.56 -1.04 1 70 ALA -4.98 -1.65 1 71 VAL -3.43 -0.88 1 72 LEU -6.98 -2.38 1 73 THR -0.97 -1.36 1 74 ILE -4.43 -1.92 1 76 LEU -3.35 -2.99 1 78 HIS 0.17 2.08 1 79 LYS 3.82 0.07 1 81 ARG 1.75 -3.04 1 82 LEU -5.43 -4.33 1 83 ALA -5.51 -3.40 1 84 VAL -3.50 -2.14 1 85 VAL -3.90 -1.81 1 86 LEU -3.93 -3.84 1 91 LEU 2.70 -0.38 1 92 ASN 1.57 0.14 1 93 ALA 2.12 -1.98 1 94 ALA -1.85 -2.30 1 95 LEU -2.23 -0.41 1 97 SER -1.73 -1.10 1 98 ALA -4.92 -3.31 1 99 ALA -9.22 -3.31 1 101 VAL -4.90 -2.05 1 103 GLU 1.35 -0.39 1 104 ASP -0.51 -0.47 1 105 SER 0.93 0.32 1 108 SER -0.68 -2.09 1 109 SER 1.34 -0.16 1 110 SER -0.21 -1.15 1 111 GLU -2.47 -1.91 1 112 GLU -1.43 -0.91 1 113 VAL -0.83 -1.55 1 114 SER -2.48 -1.50 1 115 PHE -3.74 -0.68 1 116 GLN 1.38 -1.71 1 118 VAL 1.78 -1.18 1 120 SER -0.32 1.65 1 122 ALA -0.67 0.00 1 123 THR -4.45 -2.29 1 124 LEU -5.98 -2.72 1 125 VAL -4.40 -1.92 1 126 VAL -1.79 -0.42 1 127 THR -4.97 -1.16 1 128 THR 2.19 -1.16 1 129 LEU 1.69 -0.29 1 131 GLU -2.03 -1.29 1 134 THR 0.70 -0.19 1 135 ALA 0.43 -0.01 1 136 VAL 0.81 0.06 1 137 SER 0.58 -0.01 1 stop_ save_