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 bmr7182_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.62 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 4.34 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 GLU 1.02 3.32 0 29 LEU -6.54 -1.61 0 12 LYS 0.15 -0.19 1 13 SER 0.14 -0.18 1 14 MET -1.17 -0.14 1 15 PHE -3.73 -1.07 1 17 VAL -0.31 -0.19 1 18 ILE -0.54 -0.18 1 19 TYR -3.76 -0.55 1 20 ARG -4.47 -1.88 1 21 SER -1.33 -1.65 1 22 SER 2.22 1.54 1 23 LYS -1.18 0.54 1 24 ARG -1.99 -1.87 1 25 ASP 0.59 0.84 1 26 GLN 3.78 1.40 1 27 THR 0.05 -0.13 1 28 TYR -5.90 -1.69 1 30 TYR -2.65 -2.20 1 31 VAL -5.35 -2.48 1 33 LYS -4.38 -1.96 1 35 ASP 3.59 1.89 1 36 ASP -0.89 -1.34 1 37 PHE 0.14 -1.55 1 38 SER 4.70 3.65 1 39 ARG 0.74 -0.27 1 40 VAL 0.62 0.21 1 42 GLU 3.71 3.41 1 43 GLU 3.90 2.59 1 44 LEU 3.04 2.40 1 45 MET 3.58 0.68 1 46 LYS 4.17 3.08 1 48 PHE 1.26 2.79 1 50 GLN 0.81 0.89 1 52 GLN -2.69 -1.64 1 53 LEU 4.52 3.35 1 54 ALA -0.10 0.66 1 55 MET -2.63 0.23 1 56 ILE 0.29 0.04 1 57 LEU -6.53 -3.55 1 59 LEU -0.03 -1.13 1 60 ASP -0.79 -0.75 1 62 ARG 2.42 1.26 1 64 LYS -3.19 -2.75 1 65 LEU -1.52 -0.89 1 66 VAL 1.09 0.46 1 67 ASN 1.44 0.41 1 68 ALA -3.09 -0.99 1 69 ASP -1.84 -1.38 1 70 ILE 3.34 2.51 1 71 GLU 3.95 2.38 1 72 LYS 3.61 2.23 1 73 VAL 5.91 4.04 1 74 LYS 4.96 4.28 1 75 GLN 4.51 3.12 1 76 ALA 2.72 2.59 1 77 LEU 5.20 3.68 1 78 THR 5.16 4.48 1 79 GLU 1.70 2.54 1 80 GLN -1.46 -0.36 1 82 TYR -3.28 -1.67 1 83 TYR -3.73 -0.43 1 84 LEU -3.73 -1.74 1 85 GLN -3.67 -1.39 1 86 LEU 0.12 -0.09 1 91 GLU 1.34 1.13 1 92 ASP 0.58 0.38 1 93 LEU 1.43 1.03 1 94 LEU 1.33 0.79 1 95 LYS 1.43 0.87 1 96 GLN 0.87 0.60 1 97 HIS 0.27 1.36 1 98 LEU 0.59 0.24 1 99 SER 0.33 0.13 1 100 VAL 0.78 0.26 1 101 MET 0.86 -1.52 1 103 GLN -0.06 0.04 1 104 LYS 0.12 -0.09 1 105 THR -0.18 -0.31 1 106 ASP -0.18 -0.15 1 107 ASP -0.10 0.10 1 108 THR 0.94 0.58 1 109 ASN 0.53 0.35 1 110 LYS 1.10 1.66 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7182_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 3.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.38 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -1.56 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 GLU 1.02 2.30 0 29 LEU -6.54 4.93 0 12 LYS 0.15 -0.34 1 13 SER 0.14 -0.32 1 14 MET -1.17 1.03 1 15 PHE -3.73 2.66 1 17 VAL -0.31 0.12 1 18 ILE -0.54 0.36 1 19 TYR -3.76 3.21 1 20 ARG -4.47 2.59 1 21 SER -1.33 -0.32 1 22 SER 2.22 -0.68 1 23 LYS -1.18 1.72 1 24 ARG -1.99 0.12 1 25 ASP 0.59 0.25 1 26 GLN 3.78 -2.38 1 27 THR 0.05 -0.18 1 28 TYR -5.90 4.21 1 30 TYR -2.65 0.45 1 31 VAL -5.35 2.87 1 33 LYS -4.38 2.42 1 35 ASP 3.59 -1.70 1 36 ASP -0.89 -0.45 1 37 PHE 0.14 -1.69 1 38 SER 4.70 -1.05 1 39 ARG 0.74 -1.01 1 40 VAL 0.62 -0.41 1 42 GLU 3.71 -0.30 1 43 GLU 3.90 -1.31 1 44 LEU 3.04 -0.64 1 45 MET 3.58 -2.90 1 46 LYS 4.17 -1.09 1 48 PHE 1.26 1.53 1 50 GLN 0.81 0.08 1 52 GLN -2.69 1.05 1 53 LEU 4.52 -1.17 1 54 ALA -0.10 0.76 1 55 MET -2.63 2.86 1 56 ILE 0.29 -0.25 1 57 LEU -6.53 2.98 1 59 LEU -0.03 -1.10 1 60 ASP -0.79 0.04 1 62 ARG 2.42 -1.16 1 64 LYS -3.19 0.44 1 65 LEU -1.52 0.63 1 66 VAL 1.09 -0.63 1 67 ASN 1.44 -1.03 1 68 ALA -3.09 2.10 1 69 ASP -1.84 0.46 1 70 ILE 3.34 -0.83 1 71 GLU 3.95 -1.57 1 72 LYS 3.61 -1.38 1 73 VAL 5.91 -1.87 1 74 LYS 4.96 -0.68 1 75 GLN 4.51 -1.39 1 76 ALA 2.72 -0.13 1 77 LEU 5.20 -1.52 1 78 THR 5.16 -0.68 1 79 GLU 1.70 0.84 1 80 GLN -1.46 1.10 1 82 TYR -3.28 1.61 1 83 TYR -3.73 3.30 1 84 LEU -3.73 1.99 1 85 GLN -3.67 2.28 1 86 LEU 0.12 -0.21 1 91 GLU 1.34 -0.21 1 92 ASP 0.58 -0.20 1 93 LEU 1.43 -0.40 1 94 LEU 1.33 -0.54 1 95 LYS 1.43 -0.56 1 96 GLN 0.87 -0.27 1 97 HIS 0.27 1.09 1 98 LEU 0.59 -0.35 1 99 SER 0.33 -0.20 1 100 VAL 0.78 -0.52 1 101 MET 0.86 -2.38 1 103 GLN -0.06 0.10 1 104 LYS 0.12 -0.21 1 105 THR -0.18 -0.13 1 106 ASP -0.18 0.03 1 107 ASP -0.10 0.20 1 108 THR 0.94 -0.36 1 109 ASN 0.53 -0.18 1 110 LYS 1.10 0.56 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7182_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 0.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 21 SER -1.33 -0.64 0 30 TYR -2.65 1.29 0 40 VAL 0.62 -0.92 0 73 VAL 5.91 -1.44 0 12 LYS 0.15 0.08 1 13 SER 0.14 -0.01 1 14 MET -1.17 0.14 1 15 PHE -3.73 0.60 1 17 VAL -0.31 0.38 1 18 ILE -0.54 0.60 1 19 TYR -3.76 0.66 1 20 ARG -4.47 0.74 1 22 SER 2.22 -0.11 1 23 LYS -1.18 0.07 1 24 ARG -1.99 0.16 1 25 ASP 0.59 -0.15 1 26 GLN 3.78 -0.57 1 27 THR 0.05 0.75 1 28 TYR -5.90 1.32 1 29 LEU -6.54 1.12 1 31 VAL -5.35 0.95 1 32 GLU 1.02 -0.07 1 33 LYS -4.38 0.26 1 35 ASP 3.59 -0.71 1 36 ASP -0.89 0.18 1 37 PHE 0.14 0.15 1 38 SER 4.70 -0.32 1 39 ARG 0.74 0.19 1 42 GLU 3.71 -0.48 1 43 GLU 3.90 -0.33 1 44 LEU 3.04 -0.14 1 45 MET 3.58 -0.14 1 46 LYS 4.17 -0.27 1 48 PHE 1.26 -0.62 1 50 GLN 0.81 -0.15 1 52 GLN -2.69 0.61 1 53 LEU 4.52 -0.79 1 54 ALA -0.10 0.46 1 55 MET -2.63 0.08 1 56 ILE 0.29 0.51 1 57 LEU -6.53 0.79 1 59 LEU -0.03 0.14 1 60 ASP -0.79 -0.06 1 64 LYS -3.19 0.16 1 65 LEU -1.52 0.19 1 66 VAL 1.09 -0.06 1 67 ASN 1.44 -0.12 1 68 ALA -3.09 0.11 1 69 ASP -1.84 0.08 1 70 ILE 3.34 -0.54 1 71 GLU 3.95 -0.29 1 72 LYS 3.61 -0.28 1 74 LYS 4.96 -0.60 1 75 GLN 4.51 -0.34 1 76 ALA 2.72 -0.05 1 77 LEU 5.20 -0.71 1 78 THR 5.16 -0.32 1 79 GLU 1.70 -0.13 1 80 GLN -1.46 0.53 1 82 TYR -3.28 1.11 1 83 TYR -3.73 -0.08 1 84 LEU -3.73 0.88 1 85 GLN -3.67 0.23 1 86 LEU 0.12 0.22 1 91 GLU 1.34 -0.13 1 92 ASP 0.58 -0.03 1 93 LEU 1.43 -0.08 1 94 LEU 1.33 -0.03 1 95 LYS 1.43 -0.08 1 96 GLN 0.87 -0.06 1 98 LEU 0.59 0.03 1 99 SER 0.33 0.04 1 100 VAL 0.78 0.08 1 101 MET 0.86 0.06 1 103 GLN -0.06 0.06 1 105 THR -0.18 0.06 1 106 ASP -0.18 0.06 1 107 ASP -0.10 0.06 1 108 THR 0.94 -0.31 1 109 ASN 0.53 0.04 1 110 LYS 1.10 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7182_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.54 _LACS_plot.Line_1_terminator_val_y_1 -5.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.76 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -0.42 _LACS_plot.Y_axis_chem_shift_offset 2.93 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 105 THR -0.18 -112.92 0 14 MET -1.17 -4.43 1 17 VAL -0.31 -5.07 1 18 ILE -0.54 -3.73 1 19 TYR -3.76 -3.07 1 20 ARG -4.47 -4.19 1 21 SER -1.33 -1.40 1 22 SER 2.22 -3.09 1 23 LYS -1.18 -3.37 1 25 ASP 0.59 -1.71 1 26 GLN 3.78 -6.23 1 27 THR 0.05 -4.20 1 28 TYR -5.90 -5.21 1 29 LEU -6.54 -6.02 1 30 TYR -2.65 -2.37 1 31 VAL -5.35 -3.70 1 32 GLU 1.02 -3.51 1 33 LYS -4.38 -4.70 1 35 ASP 3.59 -3.65 1 36 ASP -0.89 -3.51 1 37 PHE 0.14 -0.48 1 39 ARG 0.74 -3.39 1 40 VAL 0.62 -3.00 1 42 GLU 3.71 -0.58 1 43 GLU 3.90 -0.35 1 44 LEU 3.04 -0.44 1 45 MET 3.58 0.81 1 46 LYS 4.17 0.02 1 48 PHE 1.26 -1.13 1 53 LEU 4.52 -3.07 1 54 ALA -0.10 -8.04 1 55 MET -2.63 -6.42 1 56 ILE 0.29 -4.05 1 57 LEU -6.53 -6.58 1 59 LEU -0.03 -4.14 1 60 ASP -0.79 -2.02 1 62 ARG 2.42 -3.40 1 66 VAL 1.09 -2.37 1 67 ASN 1.44 -3.29 1 68 ALA -3.09 -4.43 1 69 ASP -1.84 -2.19 1 70 ILE 3.34 -2.75 1 71 GLU 3.95 0.54 1 72 LYS 3.61 0.05 1 73 VAL 5.91 -1.65 1 74 LYS 4.96 -0.16 1 75 GLN 4.51 -1.14 1 76 ALA 2.72 0.13 1 77 LEU 5.20 -0.95 1 78 THR 5.16 -1.21 1 79 GLU 1.70 -1.58 1 80 GLN -1.46 -2.77 1 82 TYR -3.28 -6.51 1 83 TYR -3.73 -6.04 1 84 LEU -3.73 -7.42 1 91 GLU 1.34 -2.42 1 92 ASP 0.58 -1.93 1 93 LEU 1.43 -2.09 1 94 LEU 1.33 -2.30 1 95 LYS 1.43 -2.21 1 96 GLN 0.87 -2.26 1 97 HIS 0.27 -1.43 1 98 LEU 0.59 -2.76 1 99 SER 0.33 -2.42 1 100 VAL 0.78 -2.30 1 101 MET 0.86 -2.21 1 103 GLN -0.06 -2.33 1 107 ASP -0.10 -2.30 1 108 THR 0.94 -2.69 1 109 ASN 0.53 -3.85 1 stop_ save_