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 bmr18604_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.35 _LACS_plot.Line_2_terminator_val_x_2 6.32 _LACS_plot.Line_2_terminator_val_y_2 3.33 _LACS_plot.Y_axis_chem_shift_offset -0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 PHE -1.24 -2.75 0 90 HIS 1.42 3.88 0 52 HIS 4.04 4.92 0 10 LEU -0.77 0.00 1 12 LYS 2.81 1.16 1 13 ILE -3.98 -1.45 1 14 ASP -1.46 0.60 1 15 VAL 3.16 1.67 1 16 HIS 2.02 1.23 1 17 LEU -2.38 -0.14 1 18 VAL -1.22 -0.35 1 20 ASP 3.32 2.17 1 21 ARG -1.84 -1.16 1 22 LYS 0.88 0.32 1 23 LYS -3.89 -1.48 1 24 ASP 2.57 2.14 1 25 GLN -3.34 -0.89 1 26 TYR -3.28 -1.07 1 27 LYS -1.49 -1.08 1 28 VAL 5.20 3.12 1 30 GLU 0.74 2.08 1 31 VAL -1.70 -0.82 1 32 LEU -1.97 0.09 1 33 LYS -3.11 -1.70 1 34 PHE -6.27 -0.60 1 35 SER -3.28 -1.14 1 37 LYS 2.18 1.89 1 40 PHE -3.73 -0.88 1 41 THR -1.96 -0.54 1 42 ILE -0.05 0.51 1 43 VAL 0.19 0.33 1 46 ASN 0.57 0.29 1 47 SER -3.56 -1.70 1 48 VAL -4.99 -2.44 1 49 GLN -4.95 -2.39 1 51 TYR -2.63 -0.83 1 55 LEU -0.86 -0.52 1 56 SER -2.27 0.20 1 58 ASP 0.74 0.62 1 59 LEU 2.15 0.81 1 61 ILE -4.86 -1.97 1 63 LYS -4.12 -1.26 1 64 GLU 1.73 1.69 1 65 GLN -1.10 -0.55 1 66 VAL -3.39 -2.19 1 67 GLN -0.88 0.11 1 68 SER -1.53 -0.65 1 74 GLU -0.60 -0.10 1 75 LEU -4.69 -2.71 1 76 LEU 2.82 1.32 1 77 ASN 5.31 2.46 1 79 ASN -5.64 -1.13 1 80 VAL -1.41 -1.46 1 81 LYS 1.64 2.48 1 82 GLU -3.72 -1.75 1 83 LYS 1.19 0.65 1 84 THR -0.59 0.05 1 85 LYS -2.65 -1.36 1 86 GLU 0.86 1.37 1 87 GLU -4.52 -1.26 1 88 TYR -4.34 -0.96 1 91 SER 3.61 3.25 1 92 GLU 1.32 2.86 1 93 VAL -4.82 -2.08 1 94 VAL -3.04 -0.64 1 95 GLU -5.07 -1.94 1 96 TYR -5.55 -0.53 1 97 TYR -3.81 -1.50 1 99 ASN 3.79 0.93 1 101 ARG 6.32 2.88 1 102 PHE -2.99 -0.80 1 103 LEU -4.33 -1.76 1 104 MET -0.82 0.88 1 105 LYS -1.53 -1.02 1 108 ASN 1.53 0.68 1 109 LYS -4.84 -2.11 1 110 ILE -3.49 -1.72 1 111 GLN -6.09 -2.23 1 113 VAL -0.71 -1.13 1 114 ASP 0.93 0.48 1 116 GLU -5.97 -2.66 1 117 TRP -2.21 -0.72 1 118 THR 0.47 0.82 1 119 THR 2.08 2.43 1 120 LEU -0.18 1.07 1 122 VAL -4.42 -1.84 1 124 ILE -3.93 -1.71 1 125 VAL 1.76 1.27 1 126 GLU 0.86 1.95 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18604_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 3.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 1.65 _LACS_plot.Line_2_terminator_val_x_2 6.32 _LACS_plot.Line_2_terminator_val_y_2 -2.99 _LACS_plot.Y_axis_chem_shift_offset -0.44 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 PHE -1.24 -1.51 0 90 HIS 1.42 2.46 0 52 HIS 4.04 0.88 0 10 LEU -0.77 0.77 1 12 LYS 2.81 -1.65 1 13 ILE -3.98 2.53 1 14 ASP -1.46 2.06 1 15 VAL 3.16 -1.49 1 16 HIS 2.02 -0.79 1 17 LEU -2.38 2.24 1 18 VAL -1.22 0.87 1 20 ASP 3.32 -1.15 1 21 ARG -1.84 0.68 1 22 LYS 0.88 -0.56 1 23 LYS -3.89 2.41 1 24 ASP 2.57 -0.43 1 25 GLN -3.34 2.45 1 26 TYR -3.28 2.21 1 27 LYS -1.49 0.41 1 28 VAL 5.20 -2.08 1 30 GLU 0.74 1.34 1 31 VAL -1.70 0.88 1 32 LEU -1.97 2.06 1 33 LYS -3.11 1.41 1 34 PHE -6.27 5.67 1 35 SER -3.28 2.14 1 37 LYS 2.18 -0.29 1 40 PHE -3.73 2.85 1 41 THR -1.96 1.42 1 42 ILE -0.05 0.56 1 43 VAL 0.19 0.14 1 46 ASN 0.57 -0.28 1 47 SER -3.56 1.86 1 48 VAL -4.99 2.55 1 49 GLN -4.95 2.56 1 51 TYR -2.63 1.80 1 55 LEU -0.86 0.34 1 56 SER -2.27 2.47 1 58 ASP 0.74 -0.12 1 59 LEU 2.15 -1.34 1 61 ILE -4.86 2.89 1 63 LYS -4.12 2.86 1 64 GLU 1.73 -0.04 1 65 GLN -1.10 0.55 1 66 VAL -3.39 1.20 1 67 GLN -0.88 0.99 1 68 SER -1.53 0.88 1 74 GLU -0.60 0.50 1 75 LEU -4.69 1.98 1 76 LEU 2.82 -1.50 1 77 ASN 5.31 -2.85 1 79 ASN -5.64 4.51 1 80 VAL -1.41 -0.05 1 81 LYS 1.64 0.84 1 82 GLU -3.72 1.97 1 83 LYS 1.19 -0.54 1 84 THR -0.59 0.64 1 85 LYS -2.65 1.29 1 86 GLU 0.86 0.51 1 87 GLU -4.52 3.26 1 88 TYR -4.34 3.38 1 91 SER 3.61 -0.36 1 92 GLU 1.32 1.54 1 93 VAL -4.82 2.74 1 94 VAL -3.04 2.40 1 95 GLU -5.07 3.13 1 96 TYR -5.55 5.02 1 97 TYR -3.81 2.31 1 99 ASN 3.79 -2.86 1 101 ARG 6.32 -3.44 1 102 PHE -2.99 2.19 1 103 LEU -4.33 2.57 1 104 MET -0.82 1.70 1 105 LYS -1.53 0.51 1 108 ASN 1.53 -0.85 1 109 LYS -4.84 2.73 1 110 ILE -3.49 1.77 1 111 GLN -6.09 3.86 1 113 VAL -0.71 -0.42 1 114 ASP 0.93 -0.45 1 116 GLU -5.97 3.31 1 117 TRP -2.21 1.49 1 118 THR 0.47 0.35 1 119 THR 2.08 0.35 1 120 LEU -0.18 1.25 1 122 VAL -4.42 2.58 1 124 ILE -3.93 2.22 1 125 VAL 1.76 -0.49 1 126 GLU 0.86 1.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18604_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 0.66 _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 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.32 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 VAL -4.82 1.35 0 10 LEU -0.77 -0.15 1 12 LYS 2.81 -0.12 1 13 ILE -3.98 0.27 1 14 ASP -1.46 -0.33 1 15 VAL 3.16 -0.22 1 16 HIS 2.02 -0.40 1 17 LEU -2.38 0.21 1 18 VAL -1.22 0.11 1 20 ASP 3.32 -0.55 1 21 ARG -1.84 0.10 1 22 LYS 0.88 -0.09 1 23 LYS -3.89 0.13 1 24 ASP 2.57 -0.18 1 25 GLN -3.34 0.51 1 26 TYR -3.28 -0.12 1 27 LYS -1.49 0.14 1 28 VAL 5.20 -0.85 1 30 GLU 0.74 -0.20 1 31 VAL -1.70 0.26 1 32 LEU -1.97 0.02 1 33 LYS -3.11 0.60 1 34 PHE -6.27 0.69 1 35 SER -3.28 0.11 1 37 LYS 2.18 -0.29 1 40 PHE -3.73 0.11 1 41 THR -1.96 0.20 1 42 ILE -0.05 0.38 1 43 VAL 0.19 0.07 1 46 ASN 0.57 -0.14 1 47 SER -3.56 1.13 1 48 VAL -4.99 0.64 1 49 GLN -4.95 0.86 1 51 TYR -2.63 0.10 1 52 HIS 4.04 -0.59 1 53 PHE -1.24 0.17 1 55 LEU -0.86 0.68 1 56 SER -2.27 0.15 1 58 ASP 0.74 -0.21 1 59 LEU 2.15 -0.84 1 61 ILE -4.86 0.30 1 63 LYS -4.12 0.50 1 64 GLU 1.73 -0.75 1 65 GLN -1.10 -0.01 1 66 VAL -3.39 0.14 1 67 GLN -0.88 -0.07 1 68 SER -1.53 0.23 1 74 GLU -0.60 -0.26 1 75 LEU -4.69 -0.10 1 76 LEU 2.82 -0.41 1 77 ASN 5.31 -1.06 1 79 ASN -5.64 0.19 1 80 VAL -1.41 -0.11 1 81 LYS 1.64 -0.19 1 82 GLU -3.72 0.12 1 83 LYS 1.19 -0.06 1 84 THR -0.59 -0.06 1 85 LYS -2.65 0.30 1 86 GLU 0.86 -0.12 1 87 GLU -4.52 0.48 1 88 TYR -4.34 -0.11 1 90 HIS 1.42 -0.69 1 91 SER 3.61 -0.69 1 92 GLU 1.32 0.01 1 94 VAL -3.04 0.05 1 95 GLU -5.07 0.83 1 96 TYR -5.55 0.62 1 97 TYR -3.81 0.27 1 99 ASN 3.79 -0.23 1 101 ARG 6.32 -0.53 1 102 PHE -2.99 0.37 1 103 LEU -4.33 0.33 1 104 MET -0.82 0.38 1 105 LYS -1.53 0.31 1 108 ASN 1.53 -0.20 1 109 LYS -4.84 1.17 1 110 ILE -3.49 0.34 1 111 GLN -6.09 1.20 1 113 VAL -0.71 0.23 1 114 ASP 0.93 -0.24 1 116 GLU -5.97 0.26 1 117 TRP -2.21 0.55 1 118 THR 0.47 0.08 1 119 THR 2.08 -0.50 1 120 LEU -0.18 -0.65 1 122 VAL -4.42 0.14 1 124 ILE -3.93 0.66 1 125 VAL 1.76 -0.55 1 126 GLU 0.86 -0.46 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18604_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -1.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 6.32 _LACS_plot.Line_2_terminator_val_y_2 0.04 _LACS_plot.Y_axis_chem_shift_offset 0.83 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 ASN 5.31 -2.88 0 90 HIS 1.42 3.50 0 10 LEU -0.77 -0.34 1 12 LYS 2.81 0.17 1 13 ILE -3.98 -0.82 1 14 ASP -1.46 1.46 1 15 VAL 3.16 0.28 1 16 HIS 2.02 -1.64 1 17 LEU -2.38 -1.49 1 18 VAL -1.22 0.31 1 20 ASP 3.32 0.23 1 21 ARG -1.84 -1.62 1 22 LYS 0.88 -2.20 1 23 LYS -3.89 -1.74 1 24 ASP 2.57 0.04 1 25 GLN -3.34 -2.44 1 26 TYR -3.28 -1.78 1 27 LYS -1.49 0.99 1 28 VAL 5.20 1.35 1 30 GLU 0.74 -1.81 1 31 VAL -1.70 -1.08 1 32 LEU -1.97 -3.56 1 33 LYS -3.11 -1.15 1 34 PHE -6.27 -0.74 1 35 SER -3.28 -1.92 1 37 LYS 2.18 -2.70 1 40 PHE -3.73 -1.43 1 41 THR -1.96 -1.73 1 42 ILE -0.05 -1.79 1 43 VAL 0.19 -0.97 1 46 ASN 0.57 -0.48 1 47 SER -3.56 -1.30 1 48 VAL -4.99 -3.57 1 49 GLN -4.95 -2.42 1 51 TYR -2.63 0.91 1 52 HIS 4.04 0.93 1 53 PHE -1.24 -1.18 1 55 LEU -0.86 0.74 1 56 SER -2.27 1.51 1 58 ASP 0.74 -1.28 1 59 LEU 2.15 -0.18 1 61 ILE -4.86 -1.76 1 63 LYS -4.12 -0.81 1 64 GLU 1.73 -0.47 1 65 GLN -1.10 -1.23 1 66 VAL -3.39 -0.41 1 67 GLN -0.88 -0.95 1 68 SER -1.53 -0.81 1 74 GLU -0.60 -1.85 1 75 LEU -4.69 -2.02 1 76 LEU 2.82 0.31 1 79 ASN -5.64 -2.25 1 80 VAL -1.41 0.44 1 81 LYS 1.64 -0.17 1 82 GLU -3.72 -1.37 1 83 LYS 1.19 0.97 1 84 THR -0.59 -0.11 1 85 LYS -2.65 -0.59 1 86 GLU 0.86 -0.80 1 87 GLU -4.52 -2.69 1 88 TYR -4.34 -1.38 1 91 SER 3.61 -0.19 1 92 GLU 1.32 -1.43 1 93 VAL -4.82 -0.19 1 94 VAL -3.04 -2.90 1 95 GLU -5.07 -1.63 1 96 TYR -5.55 -0.55 1 97 TYR -3.81 -2.09 1 99 ASN 3.79 -1.66 1 101 ARG 6.32 -1.32 1 102 PHE -2.99 -1.06 1 103 LEU -4.33 -2.22 1 104 MET -0.82 -0.29 1 105 LYS -1.53 -0.98 1 108 ASN 1.53 -1.46 1 109 LYS -4.84 -0.25 1 110 ILE -3.49 -3.09 1 111 GLN -6.09 -1.75 1 113 VAL -0.71 -0.52 1 114 ASP 0.93 -0.29 1 116 GLU -5.97 -1.41 1 117 TRP -2.21 2.56 1 118 THR 0.47 -1.75 1 119 THR 2.08 -0.87 1 120 LEU -0.18 0.40 1 122 VAL -4.42 -1.83 1 124 ILE -3.93 -1.16 1 125 VAL 1.76 -1.08 1 126 GLU 0.86 -1.84 1 stop_ save_