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 bmr19526_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -2.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.41 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 5.72 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ASN 0.78 -1.86 0 74 ILE -2.77 -3.90 0 10 VAL -3.86 -1.35 1 11 TYR -0.61 0.66 1 12 VAL -2.47 -1.29 1 14 LYS 2.64 0.91 1 15 HIS -0.88 0.01 1 17 ASN -0.88 -1.09 1 18 PHE -0.17 -1.17 1 21 HIS -1.95 1.53 1 22 LEU -3.27 -1.66 1 23 ASP -2.36 -1.21 1 25 LYS 3.81 2.70 1 26 ARG 2.37 2.17 1 27 ILE 4.71 1.20 1 28 GLN 3.60 2.31 1 29 GLN -0.33 -0.43 1 30 LEU 1.93 0.93 1 32 ASP 1.73 2.31 1 33 HIS -3.02 -0.52 1 34 PHE -3.72 -0.83 1 39 VAL 5.34 3.93 1 40 ASN 5.99 4.13 1 41 VAL 3.79 3.52 1 42 VAL 6.20 5.21 1 43 LEU 4.17 3.44 1 44 ARG 6.02 3.82 1 45 ARG 4.25 3.88 1 46 ILE 3.85 3.24 1 47 VAL 7.47 5.73 1 48 GLN 2.56 2.75 1 49 ALA 3.92 2.88 1 51 VAL 6.60 5.33 1 52 ASP 3.83 2.83 1 54 ALA -1.19 0.60 1 55 LEU 2.97 2.72 1 56 GLU -2.65 -2.06 1 57 THR 6.61 6.09 1 58 LYS 3.98 3.45 1 59 THR 5.29 3.68 1 60 VAL 5.47 4.72 1 61 PHE 3.26 3.74 1 63 TYR 2.52 1.45 1 64 LEU -0.35 -1.18 1 65 LYS -0.98 -0.92 1 67 ASP -3.24 -1.16 1 68 ASN -0.05 0.00 1 69 ARG -0.53 0.23 1 72 GLU -2.05 -0.73 1 73 VAL -0.64 0.22 1 75 THR -4.81 -2.11 1 76 ALA -4.99 -0.90 1 77 SER -1.68 -1.57 1 78 PHE -0.33 -0.51 1 79 ASP 3.35 1.55 1 81 GLU -6.63 -2.34 1 82 THR 0.87 0.54 1 83 HIS -4.13 -0.35 1 84 SER -3.40 -0.92 1 85 ILE -6.45 -1.76 1 86 GLN -2.50 -1.53 1 87 LEU 1.06 -0.38 1 90 VAL -2.21 -1.00 1 91 ASN -1.48 -0.29 1 92 SER -4.29 -1.99 1 93 ALA 4.40 3.28 1 94 SER 5.15 3.24 1 95 PHE 3.83 3.36 1 96 ALA 3.82 2.95 1 97 LEU 4.48 2.60 1 98 ARG 3.92 3.09 1 99 PHE 5.39 4.31 1 100 LEU 3.19 2.66 1 101 GLU 3.58 3.16 1 102 ASN 4.12 3.37 1 103 PHE 2.19 2.35 1 105 HIS 4.94 4.35 1 107 LEU -0.80 -0.22 1 108 GLN 4.03 1.16 1 110 ASP 0.99 1.81 1 111 ASN 1.06 0.35 1 112 LEU 0.31 2.39 1 113 LEU -5.27 -2.76 1 114 SER -3.35 -1.66 1 115 SER 1.26 1.18 1 116 GLN -2.45 -1.26 1 118 PHE 1.04 1.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19526_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 4.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.59 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 -1.75 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 13 ASN 0.78 -2.64 0 74 ILE -2.77 -1.13 0 10 VAL -3.86 2.51 1 11 TYR -0.61 1.27 1 12 VAL -2.47 1.18 1 14 LYS 2.64 -1.73 1 15 HIS -0.88 0.89 1 17 ASN -0.88 -0.21 1 18 PHE -0.17 -1.00 1 21 HIS -1.95 3.48 1 22 LEU -3.27 1.61 1 23 ASP -2.36 1.15 1 25 LYS 3.81 -1.11 1 26 ARG 2.37 -0.20 1 27 ILE 4.71 -3.51 1 28 GLN 3.60 -1.29 1 29 GLN -0.33 -0.10 1 30 LEU 1.93 -1.00 1 32 ASP 1.73 0.58 1 33 HIS -3.02 2.50 1 34 PHE -3.72 2.89 1 39 VAL 5.34 -1.41 1 40 ASN 5.99 -1.86 1 41 VAL 3.79 -0.27 1 42 VAL 6.20 -0.99 1 43 LEU 4.17 -0.73 1 44 ARG 6.02 -2.20 1 45 ARG 4.25 -0.37 1 46 ILE 3.85 -0.61 1 47 VAL 7.47 -1.74 1 48 GLN 2.56 0.19 1 49 ALA 3.92 -1.04 1 51 VAL 6.60 -1.27 1 52 ASP 3.83 -1.00 1 54 ALA -1.19 1.79 1 55 LEU 2.97 -0.25 1 56 GLU -2.65 0.59 1 57 THR 6.61 -0.52 1 58 LYS 3.98 -0.53 1 59 THR 5.29 -1.61 1 60 VAL 5.47 -0.75 1 61 PHE 3.26 0.48 1 63 TYR 2.52 -1.07 1 64 LEU -0.35 -0.83 1 65 LYS -0.98 0.06 1 67 ASP -3.24 2.08 1 68 ASN -0.05 0.05 1 69 ARG -0.53 0.76 1 72 GLU -2.05 1.32 1 73 VAL -0.64 0.86 1 75 THR -4.81 2.70 1 76 ALA -4.99 4.09 1 77 SER -1.68 0.11 1 78 PHE -0.33 -0.18 1 79 ASP 3.35 -1.80 1 81 GLU -6.63 4.29 1 82 THR 0.87 -0.33 1 83 HIS -4.13 3.78 1 84 SER -3.40 2.48 1 85 ILE -6.45 4.69 1 86 GLN -2.50 0.97 1 87 LEU 1.06 -1.44 1 90 VAL -2.21 1.21 1 91 ASN -1.48 1.19 1 92 SER -4.29 2.30 1 93 ALA 4.40 -1.12 1 94 SER 5.15 -1.91 1 95 PHE 3.83 -0.47 1 96 ALA 3.82 -0.87 1 97 LEU 4.48 -1.88 1 98 ARG 3.92 -0.83 1 99 PHE 5.39 -1.08 1 100 LEU 3.19 -0.53 1 101 GLU 3.58 -0.42 1 102 ASN 4.12 -0.75 1 103 PHE 2.19 0.16 1 105 HIS 4.94 -0.59 1 107 LEU -0.80 0.58 1 108 GLN 4.03 -2.87 1 110 ASP 0.99 0.82 1 111 ASN 1.06 -0.71 1 112 LEU 0.31 2.08 1 113 LEU -5.27 2.51 1 114 SER -3.35 1.69 1 115 SER 1.26 -0.08 1 116 GLN -2.45 1.19 1 118 PHE 1.04 0.14 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19526_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 0.37 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.02 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 LYS 3.98 -1.93 0 10 VAL -3.86 0.24 1 11 TYR -0.61 0.08 1 12 VAL -2.47 0.51 1 13 ASN 0.78 -0.72 1 14 LYS 2.64 -0.45 1 15 HIS -0.88 -0.04 1 17 ASN -0.88 -0.39 1 18 PHE -0.17 -0.10 1 21 HIS -1.95 0.09 1 22 LEU -3.27 0.26 1 23 ASP -2.36 -0.39 1 25 LYS 3.81 -0.44 1 26 ARG 2.37 -0.27 1 27 ILE 4.71 -0.56 1 28 GLN 3.60 -0.67 1 29 GLN -0.33 -0.19 1 30 LEU 1.93 -0.47 1 32 ASP 1.73 -0.41 1 33 HIS -3.02 0.27 1 34 PHE -3.72 -0.20 1 39 VAL 5.34 -0.71 1 40 ASN 5.99 -0.74 1 41 VAL 3.79 -0.75 1 42 VAL 6.20 -0.93 1 43 LEU 4.17 -0.66 1 44 ARG 6.02 -0.93 1 45 ARG 4.25 -0.61 1 46 ILE 3.85 -1.41 1 47 VAL 7.47 -0.93 1 48 GLN 2.56 -0.62 1 49 ALA 3.92 -0.11 1 51 VAL 6.60 -0.76 1 52 ASP 3.83 -0.22 1 54 ALA -1.19 -0.04 1 55 LEU 2.97 -0.26 1 56 GLU -2.65 0.21 1 57 THR 6.61 -0.94 1 59 THR 5.29 -0.92 1 60 VAL 5.47 -0.75 1 61 PHE 3.26 -0.78 1 63 TYR 2.52 -0.19 1 64 LEU -0.35 -0.10 1 65 LYS -0.98 -0.12 1 67 ASP -3.24 -0.05 1 68 ASN -0.05 -0.03 1 69 ARG -0.53 -0.04 1 72 GLU -2.05 -0.52 1 73 VAL -0.64 0.36 1 74 ILE -2.77 0.15 1 75 THR -4.81 1.22 1 76 ALA -4.99 0.08 1 77 SER -1.68 0.74 1 78 PHE -0.33 0.06 1 79 ASP 3.35 -0.34 1 81 GLU -6.63 0.11 1 82 THR 0.87 -0.06 1 83 HIS -4.13 -0.25 1 84 SER -3.40 1.30 1 85 ILE -6.45 0.34 1 86 GLN -2.50 0.42 1 87 LEU 1.06 -0.52 1 90 VAL -2.21 -0.19 1 91 ASN -1.48 0.05 1 92 SER -4.29 0.34 1 93 ALA 4.40 -0.57 1 94 SER 5.15 -0.45 1 95 PHE 3.83 -0.42 1 96 ALA 3.82 -0.51 1 97 LEU 4.48 -0.39 1 98 ARG 3.92 -0.30 1 99 PHE 5.39 -0.79 1 100 LEU 3.19 -0.34 1 101 GLU 3.58 -0.41 1 102 ASN 4.12 -0.42 1 103 PHE 2.19 -0.39 1 105 HIS 4.94 -0.36 1 107 LEU -0.80 -0.67 1 108 GLN 4.03 -0.55 1 110 ASP 0.99 -0.43 1 111 ASN 1.06 -0.08 1 112 LEU 0.31 -0.17 1 113 LEU -5.27 1.41 1 114 SER -3.35 0.21 1 115 SER 1.26 0.45 1 116 GLN -2.45 -0.13 1 118 PHE 1.04 -0.45 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19526_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -2.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.77 _LACS_plot.Line_2_terminator_val_x_2 7.47 _LACS_plot.Line_2_terminator_val_y_2 2.04 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 HIS 4.94 5.69 0 10 VAL -3.86 -2.49 1 11 TYR -0.61 -1.18 1 12 VAL -2.47 -0.91 1 13 ASN 0.78 -0.04 1 14 LYS 2.64 -0.55 1 15 HIS -0.88 0.62 1 17 ASN -0.88 0.03 1 18 PHE -0.17 0.10 1 21 HIS -1.95 2.35 1 22 LEU -3.27 -3.40 1 25 LYS 3.81 2.94 1 26 ARG 2.37 3.23 1 27 ILE 4.71 1.76 1 28 GLN 3.60 0.53 1 29 GLN -0.33 0.49 1 32 ASP 1.73 -0.02 1 33 HIS -3.02 -2.28 1 34 PHE -3.72 -0.97 1 39 VAL 5.34 -1.33 1 40 ASN 5.99 0.62 1 41 VAL 3.79 0.91 1 42 VAL 6.20 0.83 1 43 LEU 4.17 -0.28 1 44 ARG 6.02 0.88 1 45 ARG 4.25 3.36 1 46 ILE 3.85 0.79 1 47 VAL 7.47 1.44 1 48 GLN 2.56 1.24 1 49 ALA 3.92 2.35 1 51 VAL 6.60 2.70 1 52 ASP 3.83 1.53 1 54 ALA -1.19 0.29 1 56 GLU -2.65 -1.22 1 57 THR 6.61 0.06 1 58 LYS 3.98 1.46 1 59 THR 5.29 0.73 1 60 VAL 5.47 0.71 1 61 PHE 3.26 1.52 1 63 TYR 2.52 0.43 1 64 LEU -0.35 -2.09 1 67 ASP -3.24 -0.78 1 68 ASN -0.05 0.58 1 69 ARG -0.53 -0.21 1 72 GLU -2.05 -1.07 1 73 VAL -0.64 -0.76 1 74 ILE -2.77 -1.18 1 75 THR -4.81 -0.94 1 76 ALA -4.99 -2.48 1 77 SER -1.68 -0.79 1 78 PHE -0.33 -0.61 1 79 ASP 3.35 -0.41 1 81 GLU -6.63 -2.49 1 82 THR 0.87 -1.61 1 83 HIS -4.13 -0.58 1 84 SER -3.40 -1.16 1 85 ILE -6.45 -3.16 1 86 GLN -2.50 0.58 1 91 ASN -1.48 -0.97 1 92 SER -4.29 -0.61 1 93 ALA 4.40 1.02 1 94 SER 5.15 2.75 1 95 PHE 3.83 2.20 1 96 ALA 3.82 0.65 1 97 LEU 4.48 2.06 1 98 ARG 3.92 2.04 1 99 PHE 5.39 3.25 1 100 LEU 3.19 0.89 1 101 GLU 3.58 2.86 1 102 ASN 4.12 2.10 1 103 PHE 2.19 1.60 1 107 LEU -0.80 -2.42 1 108 GLN 4.03 -1.99 1 110 ASP 0.99 -0.57 1 111 ASN 1.06 -1.28 1 112 LEU 0.31 -2.89 1 113 LEU -5.27 -0.25 1 114 SER -3.35 -1.24 1 115 SER 1.26 -1.45 1 118 PHE 1.04 -0.35 1 stop_ save_