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 bmr19967_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 5.51 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 LYS 4.34 0.59 0 33 ILE 4.09 0.38 0 10 GLU -0.34 -0.03 1 11 GLU -0.56 -0.18 1 12 VAL -2.13 -1.40 1 13 MET 1.56 0.86 1 14 ILE -1.81 -1.19 1 17 VAL 0.13 -0.59 1 18 ILE 0.66 0.36 1 19 LEU -4.36 -1.66 1 21 PHE -7.26 -3.81 1 22 LYS -3.62 -0.78 1 24 VAL -0.19 -0.67 1 26 LYS -0.32 0.50 1 28 LEU -2.09 -1.09 1 29 HIS -5.62 -0.99 1 30 ARG 5.90 5.04 1 32 ASP 2.04 3.04 1 34 LYS 6.01 5.07 1 35 GLU 3.86 3.21 1 36 ILE 3.76 3.74 1 37 PHE 7.15 5.06 1 38 SER 3.65 2.78 1 39 GLN 3.33 1.70 1 40 TYR -0.43 -0.05 1 42 GLU 0.67 0.80 1 43 VAL 0.23 0.17 1 44 GLN -0.85 0.48 1 45 PHE -2.68 0.56 1 46 VAL -1.60 -0.87 1 48 TYR -1.67 1.38 1 49 ASN -3.15 -1.95 1 50 SER 2.84 2.19 1 51 ASP 3.68 2.78 1 52 GLU 0.87 0.65 1 53 GLU 0.39 1.50 1 54 ASN -5.05 -2.30 1 56 SER -4.72 -1.67 1 57 VAL -3.97 -1.28 1 58 ARG -4.64 -1.99 1 59 TYR -1.75 1.59 1 60 LYS 2.41 3.00 1 61 THR -5.28 -3.21 1 62 ALA 2.98 2.00 1 63 GLU 4.42 3.33 1 64 SER 4.69 3.80 1 66 LYS 3.78 2.96 1 67 ARG 3.87 2.96 1 68 ALA 2.93 2.48 1 69 ILE 6.07 5.02 1 70 GLU 3.55 3.17 1 71 SER 3.83 3.45 1 72 LEU 5.32 3.12 1 73 THR 5.21 4.31 1 74 GLU 3.19 2.97 1 75 THR -0.17 0.71 1 77 LYS 0.93 0.88 1 78 GLU -2.45 -1.20 1 79 ILE 0.45 0.56 1 82 GLN -5.82 -2.59 1 83 ILE 1.03 0.30 1 85 THR -2.22 -1.08 1 86 TYR -5.51 -1.19 1 87 ASN -2.80 0.30 1 88 LEU -1.37 -0.93 1 89 LEU 0.20 0.50 1 90 GLU -5.53 -1.81 1 92 GLU 2.81 2.44 1 93 GLU 3.82 3.21 1 94 GLU 2.97 2.68 1 95 LYS 4.57 3.82 1 96 LYS 3.52 2.63 1 97 GLU 3.27 2.06 1 98 TRP 4.74 3.70 1 99 GLU 3.51 2.89 1 100 LYS 3.38 2.35 1 101 ILE 4.49 3.62 1 102 ILE 3.45 2.39 1 103 GLU 1.85 1.70 1 104 ARG 2.27 1.40 1 105 LYS 1.77 1.09 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19967_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 4.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 LYS 4.34 -3.75 0 33 ILE 4.09 -3.71 0 10 GLU -0.34 0.31 1 11 GLU -0.56 0.38 1 12 VAL -2.13 0.73 1 13 MET 1.56 -0.70 1 14 ILE -1.81 0.62 1 17 VAL 0.13 -0.72 1 18 ILE 0.66 -0.30 1 19 LEU -4.36 2.70 1 21 PHE -7.26 3.45 1 22 LYS -3.62 2.84 1 24 VAL -0.19 -0.48 1 26 LYS -0.32 0.82 1 28 LEU -2.09 1.00 1 29 HIS -5.62 4.63 1 30 ARG 5.90 -0.86 1 32 ASP 2.04 1.00 1 34 LYS 6.01 -0.94 1 35 GLU 3.86 -0.65 1 36 ILE 3.76 -0.02 1 37 PHE 7.15 -2.09 1 38 SER 3.65 -0.87 1 39 GLN 3.33 -1.63 1 40 TYR -0.43 0.38 1 42 GLU 0.67 0.13 1 43 VAL 0.23 -0.06 1 44 GLN -0.85 1.33 1 45 PHE -2.68 3.24 1 46 VAL -1.60 0.73 1 48 TYR -1.67 3.05 1 49 ASN -3.15 1.20 1 50 SER 2.84 -0.65 1 51 ASP 3.68 -0.90 1 52 GLU 0.87 -0.22 1 53 GLU 0.39 1.11 1 54 ASN -5.05 2.75 1 56 SER -4.72 3.05 1 57 VAL -3.97 2.69 1 58 ARG -4.64 2.65 1 59 TYR -1.75 3.34 1 60 LYS 2.41 0.59 1 61 THR -5.28 2.07 1 62 ALA 2.98 -0.98 1 63 GLU 4.42 -1.09 1 64 SER 4.69 -0.89 1 66 LYS 3.78 -0.82 1 67 ARG 3.87 -0.91 1 68 ALA 2.93 -0.45 1 69 ILE 6.07 -1.05 1 70 GLU 3.55 -0.38 1 71 SER 3.83 -0.38 1 72 LEU 5.32 -2.20 1 73 THR 5.21 -0.90 1 74 GLU 3.19 -0.22 1 75 THR -0.17 0.88 1 77 LYS 0.93 -0.05 1 78 GLU -2.45 1.25 1 79 ILE 0.45 0.11 1 82 GLN -5.82 3.23 1 83 ILE 1.03 -0.73 1 85 THR -2.22 1.14 1 86 TYR -5.51 4.32 1 87 ASN -2.80 3.10 1 88 LEU -1.37 0.44 1 89 LEU 0.20 0.30 1 90 GLU -5.53 3.72 1 92 GLU 2.81 -0.37 1 93 GLU 3.82 -0.61 1 94 GLU 2.97 -0.29 1 95 LYS 4.57 -0.75 1 96 LYS 3.52 -0.89 1 97 GLU 3.27 -1.21 1 98 TRP 4.74 -1.04 1 99 GLU 3.51 -0.62 1 100 LYS 3.38 -1.03 1 101 ILE 4.49 -0.87 1 102 ILE 3.45 -1.06 1 103 GLU 1.85 -0.15 1 104 ARG 2.27 -0.87 1 105 LYS 1.77 -0.68 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19967_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.19 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ALA 2.93 -1.79 0 10 GLU -0.34 -0.07 1 11 GLU -0.56 -0.05 1 12 VAL -2.13 -0.03 1 13 MET 1.56 -0.16 1 14 ILE -1.81 -0.06 1 17 VAL 0.13 0.55 1 18 ILE 0.66 0.84 1 19 LEU -4.36 0.66 1 21 PHE -7.26 1.19 1 22 LYS -3.62 0.88 1 24 VAL -0.19 0.05 1 26 LYS -0.32 0.00 1 28 LEU -2.09 0.34 1 29 HIS -5.62 0.44 1 30 ARG 5.90 -0.39 1 32 ASP 2.04 -0.18 1 33 ILE 4.09 -0.50 1 34 LYS 6.01 -0.64 1 35 GLU 3.86 -0.33 1 36 ILE 3.76 -0.54 1 37 PHE 7.15 -0.33 1 38 SER 3.65 0.73 1 39 GLN 3.33 -0.41 1 40 TYR -0.43 0.00 1 42 GLU 0.67 0.02 1 43 VAL 0.23 -0.35 1 44 GLN -0.85 0.12 1 45 PHE -2.68 -0.07 1 46 VAL -1.60 0.08 1 48 TYR -1.67 0.28 1 49 ASN -3.15 0.10 1 50 SER 2.84 -0.06 1 51 ASP 3.68 0.44 1 52 GLU 0.87 0.04 1 53 GLU 0.39 0.29 1 54 ASN -5.05 0.93 1 56 SER -4.72 0.84 1 57 VAL -3.97 0.40 1 58 ARG -4.64 1.23 1 59 TYR -1.75 0.37 1 60 LYS 2.41 -0.03 1 61 THR -5.28 0.48 1 62 ALA 2.98 -0.21 1 63 GLU 4.42 -0.34 1 64 SER 4.69 -0.47 1 66 LYS 3.78 -0.40 1 67 ARG 3.87 -0.43 1 69 ILE 6.07 -1.01 1 70 GLU 3.55 -0.42 1 71 SER 3.83 -0.16 1 72 LEU 5.32 -0.60 1 73 THR 5.21 -0.08 1 74 GLU 3.19 -0.22 1 75 THR -0.17 -0.13 1 76 LYS 4.34 -0.38 1 77 LYS 0.93 -0.38 1 78 GLU -2.45 -0.01 1 79 ILE 0.45 0.00 1 82 GLN -5.82 0.38 1 83 ILE 1.03 0.15 1 85 THR -2.22 0.01 1 86 TYR -5.51 1.09 1 87 ASN -2.80 0.18 1 88 LEU -1.37 0.33 1 89 LEU 0.20 0.10 1 90 GLU -5.53 0.41 1 92 GLU 2.81 -0.47 1 93 GLU 3.82 -0.43 1 94 GLU 2.97 -0.33 1 95 LYS 4.57 -0.29 1 96 LYS 3.52 -0.24 1 97 GLU 3.27 -0.27 1 98 TRP 4.74 -0.48 1 99 GLU 3.51 -0.22 1 100 LYS 3.38 -0.25 1 101 ILE 4.49 -0.78 1 102 ILE 3.45 -0.37 1 103 GLU 1.85 -0.28 1 104 ARG 2.27 -0.18 1 105 LYS 1.77 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19967_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -3.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.89 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 3.21 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 HIS -5.62 3.13 0 10 GLU -0.34 -0.19 1 11 GLU -0.56 -1.40 1 12 VAL -2.13 -1.90 1 13 MET 1.56 -1.38 1 17 VAL 0.13 -0.82 1 18 ILE 0.66 -2.24 1 19 LEU -4.36 -2.17 1 21 PHE -7.26 -1.89 1 22 LYS -3.62 -0.84 1 26 LYS -0.32 0.79 1 28 LEU -2.09 -1.56 1 30 ARG 5.90 1.85 1 32 ASP 2.04 2.54 1 33 ILE 4.09 2.28 1 34 LYS 6.01 2.06 1 35 GLU 3.86 2.45 1 36 ILE 3.76 2.53 1 37 PHE 7.15 4.01 1 39 GLN 3.33 0.76 1 40 TYR -0.43 -1.62 1 42 GLU 0.67 -0.17 1 43 VAL 0.23 -0.27 1 44 GLN -0.85 0.04 1 45 PHE -2.68 -3.34 1 46 VAL -1.60 -3.08 1 48 TYR -1.67 -3.24 1 49 ASN -3.15 -2.90 1 51 ASP 3.68 -0.07 1 52 GLU 0.87 1.40 1 54 ASN -5.05 -1.94 1 56 SER -4.72 -1.60 1 57 VAL -3.97 -3.35 1 58 ARG -4.64 0.03 1 59 TYR -1.75 -0.88 1 60 LYS 2.41 0.22 1 61 THR -5.28 -0.33 1 62 ALA 2.98 3.13 1 63 GLU 4.42 2.65 1 66 LYS 3.78 1.71 1 67 ARG 3.87 2.32 1 68 ALA 2.93 0.70 1 69 ILE 6.07 2.59 1 70 GLU 3.55 2.13 1 72 LEU 5.32 2.63 1 74 GLU 3.19 1.94 1 75 THR -0.17 0.18 1 76 LYS 4.34 -1.76 1 77 LYS 0.93 0.08 1 78 GLU -2.45 0.14 1 79 ILE 0.45 0.38 1 82 GLN -5.82 -2.19 1 83 ILE 1.03 -0.74 1 85 THR -2.22 -0.64 1 86 TYR -5.51 -0.18 1 87 ASN -2.80 -2.53 1 88 LEU -1.37 -0.02 1 89 LEU 0.20 -1.84 1 90 GLU -5.53 0.28 1 93 GLU 3.82 2.55 1 95 LYS 4.57 2.53 1 96 LYS 3.52 2.78 1 97 GLU 3.27 2.68 1 98 TRP 4.74 2.01 1 99 GLU 3.51 2.19 1 100 LYS 3.38 2.02 1 101 ILE 4.49 1.98 1 102 ILE 3.45 1.30 1 103 GLU 1.85 1.24 1 104 ARG 2.27 1.05 1 105 LYS 1.77 0.84 1 stop_ save_