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 bmr11112_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.88 _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 0.97 _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 3.80 _LACS_plot.Line_2_terminator_val_y_2 2.16 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 TYR -2.75 1.70 0 112 GLU -7.88 -1.35 0 10 THR 0.13 0.04 1 11 ASP 0.41 0.23 1 12 TRP 0.37 0.02 1 13 LEU 0.54 0.44 1 14 SER 0.08 0.15 1 15 ALA -0.15 0.17 1 16 GLU -0.27 0.17 1 17 THR -0.45 -0.20 1 18 PHE -0.56 -0.07 1 19 GLU -0.17 0.22 1 20 SER 0.55 0.75 1 21 ASP 0.32 0.17 1 22 LEU -1.17 -0.42 1 23 ASP -1.49 0.04 1 24 GLU -3.52 -1.95 1 25 THR -0.31 0.11 1 26 ARG -5.21 -2.86 1 27 VAL 3.30 0.38 1 29 GLU -2.63 -1.04 1 30 VAL -1.32 -0.35 1 32 SER 2.29 2.71 1 33 SER -1.42 0.36 1 34 LEU -3.25 -0.16 1 35 HIS -3.96 0.06 1 36 VAL -5.69 -3.41 1 37 ARG -4.63 -1.71 1 39 LEU 1.73 -0.75 1 40 VAL 3.58 3.33 1 41 THR -2.87 -2.93 1 42 SER -5.64 -2.70 1 43 ILE -5.61 -0.36 1 44 VAL 0.73 0.49 1 45 VAL -2.10 -0.94 1 46 SER -3.07 -0.74 1 47 TRP -3.18 -0.32 1 48 THR -1.89 -1.93 1 51 GLU 2.29 2.49 1 52 ASN 1.51 -0.20 1 53 GLN 1.29 0.64 1 54 ASN 1.37 1.77 1 55 ILE -1.45 -1.20 1 56 VAL 1.49 2.19 1 57 VAL -1.86 -0.12 1 58 ARG -0.75 -0.64 1 60 TYR -4.13 -1.49 1 61 ALA -4.36 -2.65 1 62 ILE -2.21 -1.06 1 64 TYR -5.17 -1.73 1 66 ILE 2.48 0.71 1 68 SER -1.98 -1.11 1 70 HIS -0.77 1.01 1 71 ALA 2.38 2.52 1 72 GLN -3.66 -0.92 1 73 THR -2.36 -0.41 1 74 ILE -4.28 -1.61 1 75 LYS -2.46 -0.99 1 76 VAL -6.26 -3.53 1 77 ASP -1.03 0.47 1 78 TYR 1.47 0.87 1 79 LYS 1.42 0.65 1 80 GLN 0.15 -0.21 1 81 ARG -4.13 -3.13 1 82 TYR -4.34 -2.12 1 84 THR 1.25 0.11 1 85 ILE 1.00 0.63 1 86 GLU -4.92 -1.53 1 87 ASN 3.40 1.42 1 88 LEU -0.94 -2.02 1 89 ASP -0.41 -0.03 1 91 SER 1.47 0.15 1 92 SER -3.09 -0.02 1 93 HIS -1.61 0.19 1 94 TYR -2.35 0.56 1 95 VAL -1.03 -0.35 1 96 ILE -5.80 -2.49 1 97 THR -6.33 -3.81 1 98 LEU -7.22 -2.03 1 99 LYS -5.87 -2.27 1 100 ALA -4.30 -2.22 1 101 PHE -6.16 -1.95 1 102 ASN -0.21 -0.74 1 103 ASN 3.81 2.36 1 104 VAL 3.29 1.76 1 106 GLU -4.01 -1.83 1 108 ILE -0.10 0.24 1 110 LEU -4.05 -1.01 1 111 TYR -4.47 -1.08 1 113 SER -2.80 -0.71 1 114 ALA -5.40 -1.36 1 115 VAL -2.57 -2.65 1 116 THR 0.52 0.02 1 117 ARG 0.82 0.84 1 119 HIS -0.13 2.25 1 120 THR -0.59 -0.39 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11112_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.88 _LACS_plot.Line_1_terminator_val_y_1 4.82 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.03 _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 3.80 _LACS_plot.Line_2_terminator_val_y_2 -1.64 _LACS_plot.Y_axis_chem_shift_offset -0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 TYR -2.75 4.45 0 112 GLU -7.88 6.53 0 10 THR 0.13 -0.09 1 11 ASP 0.41 -0.18 1 12 TRP 0.37 -0.35 1 13 LEU 0.54 -0.10 1 14 SER 0.08 0.07 1 15 ALA -0.15 0.32 1 16 GLU -0.27 0.44 1 17 THR -0.45 0.25 1 18 PHE -0.56 0.49 1 19 GLU -0.17 0.39 1 20 SER 0.55 0.20 1 21 ASP 0.32 -0.15 1 22 LEU -1.17 0.75 1 23 ASP -1.49 1.53 1 24 GLU -3.52 1.57 1 25 THR -0.31 0.42 1 26 ARG -5.21 2.35 1 27 VAL 3.30 -2.92 1 29 GLU -2.63 1.59 1 30 VAL -1.32 0.97 1 32 SER 2.29 0.42 1 33 SER -1.42 1.78 1 34 LEU -3.25 3.09 1 35 HIS -3.96 4.02 1 36 VAL -5.69 2.28 1 37 ARG -4.63 2.92 1 39 LEU 1.73 -2.48 1 40 VAL 3.58 -0.25 1 41 THR -2.87 -0.06 1 42 SER -5.64 2.94 1 43 ILE -5.61 5.25 1 44 VAL 0.73 -0.24 1 45 VAL -2.10 1.16 1 46 SER -3.07 2.33 1 47 TRP -3.18 2.86 1 48 THR -1.89 -0.04 1 51 GLU 2.29 0.20 1 52 ASN 1.51 -1.71 1 53 GLN 1.29 -0.65 1 54 ASN 1.37 0.40 1 55 ILE -1.45 0.25 1 56 VAL 1.49 0.70 1 57 VAL -1.86 1.74 1 58 ARG -0.75 0.11 1 60 TYR -4.13 2.64 1 61 ALA -4.36 1.71 1 62 ILE -2.21 1.15 1 64 TYR -5.17 3.44 1 66 ILE 2.48 -1.77 1 68 SER -1.98 0.87 1 70 HIS -0.77 1.78 1 71 ALA 2.38 0.14 1 72 GLN -3.66 2.74 1 73 THR -2.36 1.95 1 74 ILE -4.28 2.67 1 75 LYS -2.46 1.47 1 76 VAL -6.26 2.73 1 77 ASP -1.03 1.50 1 78 TYR 1.47 -0.60 1 79 LYS 1.42 -0.77 1 80 GLN 0.15 -0.36 1 81 ARG -4.13 1.00 1 82 TYR -4.34 2.22 1 84 THR 1.25 -1.14 1 85 ILE 1.00 -0.37 1 86 GLU -4.92 3.39 1 87 ASN 3.40 -1.98 1 88 LEU -0.94 -1.08 1 89 ASP -0.41 0.38 1 91 SER 1.47 -1.32 1 92 SER -3.09 3.07 1 93 HIS -1.61 1.80 1 94 TYR -2.35 2.91 1 95 VAL -1.03 0.68 1 96 ILE -5.80 3.31 1 97 THR -6.33 2.52 1 98 LEU -7.22 5.19 1 99 LYS -5.87 3.60 1 100 ALA -4.30 2.08 1 101 PHE -6.16 4.21 1 102 ASN -0.21 -0.53 1 103 ASN 3.81 -1.45 1 104 VAL 3.29 -1.53 1 106 GLU -4.01 2.18 1 108 ILE -0.10 0.34 1 110 LEU -4.05 3.04 1 111 TYR -4.47 3.39 1 113 SER -2.80 2.09 1 114 ALA -5.40 4.04 1 115 VAL -2.57 -0.08 1 116 THR 0.52 -0.50 1 117 ARG 0.82 0.02 1 119 HIS -0.13 2.38 1 120 THR -0.59 0.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11112_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.88 _LACS_plot.Line_1_terminator_val_y_1 0.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 3.80 _LACS_plot.Line_2_terminator_val_y_2 -0.38 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 ARG -4.13 -1.61 0 10 THR 0.13 -0.13 1 11 ASP 0.41 -0.04 1 12 TRP 0.37 -0.05 1 13 LEU 0.54 -0.13 1 14 SER 0.08 -0.11 1 15 ALA -0.15 0.01 1 16 GLU -0.27 -0.07 1 17 THR -0.45 0.00 1 18 PHE -0.56 0.04 1 19 GLU -0.17 -0.09 1 20 SER 0.55 -0.07 1 21 ASP 0.32 0.02 1 22 LEU -1.17 0.10 1 23 ASP -1.49 -0.06 1 24 GLU -3.52 0.22 1 25 THR -0.31 0.08 1 26 ARG -5.21 0.38 1 27 VAL 3.30 -0.10 1 29 GLU -2.63 -0.05 1 30 VAL -1.32 0.20 1 32 SER 2.29 -0.16 1 33 SER -1.42 -0.06 1 34 LEU -3.25 0.72 1 35 HIS -3.96 0.29 1 36 VAL -5.69 1.11 1 37 ARG -4.63 0.35 1 39 LEU 1.73 0.34 1 40 VAL 3.58 0.16 1 41 THR -2.87 0.05 1 42 SER -5.64 0.83 1 43 ILE -5.61 0.17 1 44 VAL 0.73 0.26 1 45 VAL -2.10 0.78 1 46 SER -3.07 0.78 1 47 TRP -3.18 0.46 1 48 THR -1.89 -0.24 1 51 GLU 2.29 -0.36 1 52 ASN 1.51 -0.10 1 53 GLN 1.29 -0.03 1 54 ASN 1.37 -0.08 1 55 ILE -1.45 0.63 1 56 VAL 1.49 -0.66 1 57 VAL -1.86 -0.27 1 58 ARG -0.75 0.04 1 60 TYR -4.13 0.50 1 61 ALA -4.36 1.01 1 62 ILE -2.21 0.69 1 64 TYR -5.17 1.63 1 66 ILE 2.48 -0.04 1 70 HIS -0.77 -0.22 1 71 ALA 2.38 -0.24 1 72 GLN -3.66 0.13 1 73 THR -2.36 1.00 1 74 ILE -4.28 0.18 1 75 LYS -2.46 1.21 1 76 VAL -6.26 0.78 1 77 ASP -1.03 0.27 1 78 TYR 1.47 -0.22 1 79 LYS 1.42 -0.19 1 80 GLN 0.15 -0.28 1 82 TYR -4.34 0.51 1 83 TYR -2.75 -0.21 1 84 THR 1.25 0.40 1 85 ILE 1.00 -0.34 1 86 GLU -4.92 0.31 1 87 ASN 3.40 -0.36 1 88 LEU -0.94 0.08 1 89 ASP -0.41 0.19 1 91 SER 1.47 -0.43 1 92 SER -3.09 0.49 1 93 HIS -1.61 0.18 1 94 TYR -2.35 0.33 1 95 VAL -1.03 0.35 1 96 ILE -5.80 1.28 1 97 THR -6.33 1.01 1 98 LEU -7.22 0.75 1 99 LYS -5.87 0.34 1 100 ALA -4.30 0.44 1 101 PHE -6.16 0.82 1 102 ASN -0.21 -0.48 1 103 ASN 3.81 -0.27 1 104 VAL 3.29 -0.31 1 106 GLU -4.01 0.32 1 108 ILE -0.10 -0.20 1 110 LEU -4.05 0.37 1 111 TYR -4.47 0.76 1 112 GLU -7.88 0.37 1 113 SER -2.80 0.90 1 114 ALA -5.40 0.37 1 115 VAL -2.57 1.13 1 116 THR 0.52 -0.03 1 117 ARG 0.82 -0.29 1 119 HIS -0.13 -0.18 1 120 THR -0.59 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11112_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.88 _LACS_plot.Line_1_terminator_val_y_1 -2.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 3.80 _LACS_plot.Line_2_terminator_val_y_2 0.63 _LACS_plot.Y_axis_chem_shift_offset 0.43 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 SER -1.42 -3.98 0 40 VAL 3.58 -2.32 0 27 VAL 3.30 -2.54 0 10 THR 0.13 -0.21 1 11 ASP 0.41 -0.11 1 12 TRP 0.37 0.27 1 13 LEU 0.54 -0.18 1 14 SER 0.08 -0.24 1 15 ALA -0.15 -0.06 1 16 GLU -0.27 -0.07 1 17 THR -0.45 -0.71 1 18 PHE -0.56 -0.27 1 19 GLU -0.17 0.05 1 20 SER 0.55 -0.50 1 21 ASP 0.32 -0.30 1 22 LEU -1.17 -1.47 1 23 ASP -1.49 -0.81 1 24 GLU -3.52 -1.20 1 25 THR -0.31 -0.49 1 26 ARG -5.21 -2.33 1 29 GLU -2.63 -1.76 1 30 VAL -1.32 -1.16 1 32 SER 2.29 -0.19 1 34 LEU -3.25 -4.01 1 35 HIS -3.96 -0.09 1 36 VAL -5.69 -2.15 1 37 ARG -4.63 -1.25 1 39 LEU 1.73 -2.16 1 41 THR -2.87 -0.87 1 42 SER -5.64 -1.86 1 43 ILE -5.61 -2.50 1 44 VAL 0.73 -0.68 1 45 VAL -2.10 -2.25 1 46 SER -3.07 -1.49 1 47 TRP -3.18 -2.08 1 48 THR -1.89 -0.86 1 51 GLU 2.29 0.59 1 52 ASN 1.51 0.79 1 53 GLN 1.29 -0.12 1 54 ASN 1.37 -1.12 1 55 ILE -1.45 0.07 1 56 VAL 1.49 -2.10 1 57 VAL -1.86 -0.68 1 58 ARG -0.75 0.61 1 60 TYR -4.13 -2.15 1 61 ALA -4.36 -1.52 1 62 ILE -2.21 -1.72 1 64 TYR -5.17 -1.45 1 66 ILE 2.48 2.15 1 68 SER -1.98 -0.64 1 70 HIS -0.77 1.71 1 71 ALA 2.38 -0.22 1 72 GLN -3.66 -1.78 1 73 THR -2.36 -0.84 1 74 ILE -4.28 -1.87 1 75 LYS -2.46 -0.58 1 76 VAL -6.26 -0.83 1 77 ASP -1.03 0.22 1 78 TYR 1.47 0.00 1 79 LYS 1.42 0.37 1 80 GLN 0.15 0.26 1 81 ARG -4.13 -3.88 1 82 TYR -4.34 -1.39 1 83 TYR -2.75 -2.65 1 84 THR 1.25 -2.49 1 85 ILE 1.00 -1.10 1 86 GLU -4.92 -1.37 1 87 ASN 3.40 -0.14 1 88 LEU -0.94 -1.60 1 91 SER 1.47 -0.17 1 92 SER -3.09 -4.00 1 93 HIS -1.61 -0.24 1 94 TYR -2.35 -0.89 1 95 VAL -1.03 -2.01 1 96 ILE -5.80 -1.07 1 97 THR -6.33 -1.04 1 98 LEU -7.22 -2.85 1 99 LYS -5.87 -1.73 1 100 ALA -4.30 -1.77 1 101 PHE -6.16 -2.03 1 102 ASN -0.21 0.00 1 103 ASN 3.81 2.10 1 104 VAL 3.29 0.07 1 106 GLU -4.01 0.23 1 108 ILE -0.10 0.32 1 110 LEU -4.05 -1.77 1 111 TYR -4.47 0.52 1 112 GLU -7.88 -1.38 1 113 SER -2.80 -1.87 1 114 ALA -5.40 -3.69 1 115 VAL -2.57 1.26 1 116 THR 0.52 1.29 1 117 ARG 0.82 -0.80 1 119 HIS -0.13 2.21 1 120 THR -0.59 -0.54 1 stop_ save_