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 bmr11108_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.87 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.56 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 6.30 _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 89 ILE 1.72 -2.21 0 10 ALA 0.34 0.26 1 12 ALA -0.20 0.09 1 13 ALA 0.15 0.10 1 14 GLU -0.24 0.08 1 15 ALA -0.19 -0.10 1 16 ALA -0.11 -0.06 1 17 VAL -0.28 -0.18 1 18 ALA -0.58 -0.22 1 19 ALA -1.50 -0.35 1 20 VAL 0.10 -0.60 1 21 GLU -1.58 -0.03 1 22 GLU -3.26 -1.39 1 23 VAL -0.32 -0.45 1 25 SER -3.76 -1.17 1 26 ALA 3.60 2.70 1 28 GLN 3.42 2.70 1 29 PHE 5.16 4.53 1 30 GLU 3.51 2.85 1 31 GLU 2.80 2.44 1 32 LEU 3.58 3.00 1 33 LEU 3.24 2.54 1 34 ARG 3.03 2.83 1 35 LEU 2.25 2.50 1 36 LYS 0.17 -2.58 1 37 ALA 2.43 3.21 1 38 LYS 1.41 0.27 1 39 SER -2.81 -1.18 1 40 LEU -0.03 -0.02 1 41 LEU -5.45 -1.86 1 42 VAL -1.53 -1.16 1 43 VAL -3.97 -2.34 1 44 HIS -5.26 -2.60 1 45 PHE 0.47 0.16 1 46 TRP -6.28 -3.23 1 47 ALA -3.42 -0.34 1 49 TRP -2.26 -3.11 1 50 ALA -2.64 -1.31 1 52 GLN 3.72 2.81 1 54 ALA 4.72 3.16 1 55 GLN 4.45 3.16 1 56 MET 1.98 0.43 1 57 ASN 4.54 2.93 1 58 GLU 3.79 2.91 1 59 VAL 4.88 3.69 1 60 MET 3.65 4.12 1 61 ALA 3.65 2.39 1 62 GLU 3.03 2.36 1 63 LEU 2.37 2.41 1 64 ALA 2.90 1.73 1 65 LYS 2.33 2.04 1 66 GLU 0.22 1.22 1 67 LEU -1.59 -0.90 1 69 GLN 2.36 0.61 1 70 VAL -0.12 -0.44 1 71 SER -1.14 -0.19 1 72 PHE -2.06 -0.63 1 73 VAL -6.87 -3.15 1 74 LYS -4.87 -2.07 1 75 LEU -4.03 -0.48 1 76 GLU 0.58 -0.44 1 77 ALA 3.71 3.28 1 78 GLU 0.51 0.79 1 80 VAL 0.94 -0.91 1 82 GLU 3.71 3.17 1 83 VAL 4.21 3.41 1 84 SER 5.25 3.62 1 85 GLU 2.81 2.48 1 86 LYS 3.90 2.97 1 87 TYR 0.94 0.39 1 88 GLU 3.59 0.31 1 90 SER -1.28 -0.42 1 91 SER -2.11 -1.02 1 92 VAL -3.81 -2.44 1 94 THR -1.22 1.85 1 95 PHE -4.03 -1.95 1 96 LEU -6.35 -1.75 1 97 PHE -3.30 -2.20 1 98 PHE -5.25 -0.86 1 99 LYS -3.27 1.02 1 100 ASN 3.15 1.68 1 101 SER 4.35 1.97 1 102 GLN -4.24 -2.09 1 103 LYS 2.16 0.09 1 104 ILE -1.81 -0.39 1 105 ASP -2.13 -1.28 1 106 ARG -4.08 -0.62 1 107 LEU -5.86 -0.99 1 108 ASP -0.56 0.24 1 110 ALA -0.60 -1.57 1 111 HIS -3.18 -1.37 1 112 ALA 8.13 6.75 1 114 GLU 3.09 2.58 1 115 LEU 5.25 3.79 1 116 THR 6.99 5.82 1 117 LYS 3.80 3.38 1 118 LYS 2.98 4.20 1 119 VAL 6.94 5.45 1 120 GLN 5.06 3.45 1 121 ARG 3.88 2.87 1 122 HIS -0.99 2.97 1 123 ALA 1.07 1.23 1 124 SER -0.08 0.21 1 125 SER -0.30 0.16 1 128 SER 0.01 0.09 1 129 SER -0.40 0.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11108_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.87 _LACS_plot.Line_1_terminator_val_y_1 4.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.44 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 -1.83 _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 89 ILE 1.72 -3.93 0 10 ALA 0.34 -0.08 1 12 ALA -0.20 0.29 1 13 ALA 0.15 -0.05 1 14 GLU -0.24 0.32 1 15 ALA -0.19 0.09 1 16 ALA -0.11 0.05 1 17 VAL -0.28 0.10 1 18 ALA -0.58 0.36 1 19 ALA -1.50 1.15 1 20 VAL 0.10 -0.70 1 21 GLU -1.58 1.55 1 22 GLU -3.26 1.87 1 23 VAL -0.32 -0.13 1 25 SER -3.76 2.59 1 26 ALA 3.60 -0.90 1 28 GLN 3.42 -0.72 1 29 PHE 5.16 -0.63 1 30 GLU 3.51 -0.66 1 31 GLU 2.80 -0.36 1 32 LEU 3.58 -0.58 1 33 LEU 3.24 -0.70 1 34 ARG 3.03 -0.20 1 35 LEU 2.25 0.25 1 36 LYS 0.17 -2.75 1 37 ALA 2.43 0.78 1 38 LYS 1.41 -1.14 1 39 SER -2.81 1.63 1 40 LEU -0.03 0.01 1 41 LEU -5.45 3.59 1 42 VAL -1.53 0.37 1 43 VAL -3.97 1.63 1 44 HIS -5.26 2.66 1 45 PHE 0.47 -0.31 1 46 TRP -6.28 3.05 1 47 ALA -3.42 3.08 1 49 TRP -2.26 -0.85 1 50 ALA -2.64 1.33 1 52 GLN 3.72 -0.91 1 54 ALA 4.72 -1.56 1 55 GLN 4.45 -1.29 1 56 MET 1.98 -1.55 1 57 ASN 4.54 -1.61 1 58 GLU 3.79 -0.88 1 59 VAL 4.88 -1.19 1 60 MET 3.65 0.47 1 61 ALA 3.65 -1.26 1 62 GLU 3.03 -0.67 1 63 LEU 2.37 0.04 1 64 ALA 2.90 -1.17 1 65 LYS 2.33 -0.29 1 66 GLU 0.22 1.00 1 67 LEU -1.59 0.69 1 69 GLN 2.36 -1.75 1 70 VAL -0.12 -0.32 1 71 SER -1.14 0.95 1 72 PHE -2.06 1.43 1 73 VAL -6.87 3.72 1 74 LYS -4.87 2.80 1 75 LEU -4.03 3.55 1 76 GLU 0.58 -1.02 1 77 ALA 3.71 -0.43 1 78 GLU 0.51 0.28 1 80 VAL 0.94 -1.85 1 82 GLU 3.71 -0.54 1 83 VAL 4.21 -0.80 1 84 SER 5.25 -1.63 1 85 GLU 2.81 -0.33 1 86 LYS 3.90 -0.93 1 87 TYR 0.94 -0.55 1 88 GLU 3.59 -3.28 1 90 SER -1.28 0.86 1 91 SER -2.11 1.09 1 92 VAL -3.81 1.37 1 94 THR -1.22 3.07 1 95 PHE -4.03 2.08 1 96 LEU -6.35 4.60 1 97 PHE -3.30 1.10 1 98 PHE -5.25 4.39 1 99 LYS -3.27 4.29 1 100 ASN 3.15 -1.47 1 101 SER 4.35 -2.38 1 102 GLN -4.24 2.15 1 103 LYS 2.16 -2.07 1 104 ILE -1.81 1.42 1 105 ASP -2.13 0.85 1 106 ARG -4.08 3.46 1 107 LEU -5.86 4.87 1 108 ASP -0.56 0.80 1 110 ALA -0.60 -0.97 1 111 HIS -3.18 1.81 1 112 ALA 8.13 -1.38 1 114 GLU 3.09 -0.51 1 115 LEU 5.25 -1.46 1 116 THR 6.99 -1.17 1 117 LYS 3.80 -0.42 1 118 LYS 2.98 1.22 1 119 VAL 6.94 -1.49 1 120 GLN 5.06 -1.61 1 121 ARG 3.88 -1.01 1 122 HIS -0.99 3.96 1 123 ALA 1.07 0.16 1 124 SER -0.08 0.29 1 125 SER -0.30 0.46 1 128 SER 0.01 0.08 1 129 SER -0.40 0.43 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11108_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.87 _LACS_plot.Line_1_terminator_val_y_1 0.82 _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 0.26 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 ALA -3.42 -0.92 0 10 ALA 0.34 -0.06 1 12 ALA -0.20 -0.04 1 13 ALA 0.15 -0.05 1 14 GLU -0.24 -0.16 1 15 ALA -0.19 -0.05 1 16 ALA -0.11 -0.04 1 17 VAL -0.28 -0.07 1 18 ALA -0.58 -0.03 1 19 ALA -1.50 0.00 1 20 VAL 0.10 0.08 1 21 GLU -1.58 -0.05 1 22 GLU -3.26 0.50 1 23 VAL -0.32 0.07 1 25 SER -3.76 0.33 1 26 ALA 3.60 -0.36 1 28 GLN 3.42 -0.21 1 29 PHE 5.16 -0.71 1 30 GLU 3.51 -0.69 1 31 GLU 2.80 -0.30 1 32 LEU 3.58 -0.48 1 33 LEU 3.24 -1.00 1 34 ARG 3.03 -0.37 1 35 LEU 2.25 -0.27 1 36 LYS 0.17 0.20 1 37 ALA 2.43 0.02 1 38 LYS 1.41 0.06 1 39 SER -2.81 0.32 1 40 LEU -0.03 0.34 1 41 LEU -5.45 0.79 1 42 VAL -1.53 0.25 1 43 VAL -3.97 0.55 1 44 HIS -5.26 0.06 1 45 PHE 0.47 0.81 1 46 TRP -6.28 0.39 1 49 TRP -2.26 -0.07 1 50 ALA -2.64 0.47 1 52 GLN 3.72 0.03 1 54 ALA 4.72 -0.02 1 55 GLN 4.45 -0.21 1 56 MET 1.98 0.00 1 57 ASN 4.54 -0.13 1 58 GLU 3.79 -0.30 1 59 VAL 4.88 -0.46 1 60 MET 3.65 -1.05 1 61 ALA 3.65 -0.60 1 62 GLU 3.03 -0.36 1 63 LEU 2.37 -0.45 1 64 ALA 2.90 -0.32 1 65 LYS 2.33 -0.31 1 66 GLU 0.22 -0.19 1 67 LEU -1.59 0.33 1 69 GLN 2.36 0.08 1 70 VAL -0.12 0.04 1 71 SER -1.14 0.37 1 72 PHE -2.06 0.61 1 73 VAL -6.87 1.06 1 74 LYS -4.87 0.85 1 75 LEU -4.03 0.21 1 76 GLU 0.58 -0.90 1 77 ALA 3.71 -0.48 1 78 GLU 0.51 -0.28 1 80 VAL 0.94 0.11 1 82 GLU 3.71 -0.22 1 83 VAL 4.21 -0.34 1 84 SER 5.25 -0.57 1 85 GLU 2.81 -0.30 1 86 LYS 3.90 -0.46 1 87 TYR 0.94 0.02 1 88 GLU 3.59 -0.52 1 89 ILE 1.72 -0.11 1 90 SER -1.28 0.08 1 91 SER -2.11 0.25 1 92 VAL -3.81 0.22 1 94 THR -1.22 0.63 1 95 PHE -4.03 1.52 1 96 LEU -6.35 0.79 1 97 PHE -3.30 0.66 1 98 PHE -5.25 1.02 1 99 LYS -3.27 0.43 1 100 ASN 3.15 -0.26 1 101 SER 4.35 -0.69 1 102 GLN -4.24 0.49 1 103 LYS 2.16 -0.39 1 104 ILE -1.81 0.39 1 105 ASP -2.13 0.04 1 106 ARG -4.08 1.04 1 107 LEU -5.86 0.67 1 108 ASP -0.56 0.55 1 110 ALA -0.60 0.07 1 111 HIS -3.18 0.33 1 112 ALA 8.13 -0.63 1 114 GLU 3.09 -0.31 1 115 LEU 5.25 -0.56 1 116 THR 6.99 -0.79 1 117 LYS 3.80 -0.37 1 118 LYS 2.98 -0.61 1 119 VAL 6.94 -0.56 1 120 GLN 5.06 -0.49 1 121 ARG 3.88 -0.40 1 122 HIS -0.99 -0.03 1 123 ALA 1.07 -0.10 1 124 SER -0.08 0.04 1 125 SER -0.30 0.08 1 128 SER 0.01 0.01 1 129 SER -0.40 0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11108_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.87 _LACS_plot.Line_1_terminator_val_y_1 -3.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 8.13 _LACS_plot.Line_2_terminator_val_y_2 3.11 _LACS_plot.Y_axis_chem_shift_offset 0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 112 ALA 8.13 0.18 0 10 ALA 0.34 0.62 1 12 ALA -0.20 -0.02 1 13 ALA 0.15 0.22 1 14 GLU -0.24 -0.25 1 15 ALA -0.19 -0.42 1 16 ALA -0.11 -0.17 1 17 VAL -0.28 -0.51 1 18 ALA -0.58 -1.26 1 19 ALA -1.50 -1.00 1 20 VAL 0.10 -0.49 1 21 GLU -1.58 -1.70 1 22 GLU -3.26 -0.24 1 23 VAL -0.32 -0.26 1 25 SER -3.76 -0.79 1 26 ALA 3.60 2.14 1 28 GLN 3.42 2.50 1 29 PHE 5.16 -0.32 1 30 GLU 3.51 2.94 1 31 GLU 2.80 1.50 1 32 LEU 3.58 0.52 1 33 LEU 3.24 1.98 1 34 ARG 3.03 3.25 1 35 LEU 2.25 2.34 1 36 LYS 0.17 0.14 1 37 ALA 2.43 0.91 1 38 LYS 1.41 -0.26 1 39 SER -2.81 -2.92 1 40 LEU -0.03 -3.84 1 41 LEU -5.45 -3.13 1 42 VAL -1.53 -2.50 1 43 VAL -3.97 -1.38 1 44 HIS -5.26 0.01 1 45 PHE 0.47 -1.91 1 46 TRP -6.28 -2.17 1 49 TRP -2.26 -0.74 1 50 ALA -2.64 0.18 1 52 GLN 3.72 3.24 1 54 ALA 4.72 2.86 1 55 GLN 4.45 3.37 1 56 MET 1.98 2.37 1 57 ASN 4.54 3.24 1 58 GLU 3.79 2.42 1 59 VAL 4.88 2.36 1 60 MET 3.65 -0.12 1 61 ALA 3.65 2.29 1 62 GLU 3.03 3.23 1 63 LEU 2.37 0.39 1 64 ALA 2.90 2.19 1 65 LYS 2.33 1.33 1 66 GLU 0.22 0.03 1 67 LEU -1.59 -1.87 1 69 GLN 2.36 0.21 1 70 VAL -0.12 -2.23 1 71 SER -1.14 -2.89 1 72 PHE -2.06 -0.62 1 73 VAL -6.87 -2.66 1 74 LYS -4.87 -3.17 1 75 LEU -4.03 -3.27 1 76 GLU 0.58 -0.06 1 77 ALA 3.71 2.23 1 78 GLU 0.51 0.66 1 80 VAL 0.94 -1.53 1 82 GLU 3.71 3.66 1 83 VAL 4.21 0.60 1 84 SER 5.25 1.37 1 85 GLU 2.81 3.31 1 86 LYS 3.90 1.12 1 87 TYR 0.94 -2.67 1 88 GLU 3.59 -0.73 1 89 ILE 1.72 -0.75 1 90 SER -1.28 -1.17 1 91 SER -2.11 -2.19 1 92 VAL -3.81 -1.56 1 94 THR -1.22 -2.93 1 95 PHE -4.03 -0.34 1 96 LEU -6.35 -3.61 1 97 PHE -3.30 -1.31 1 98 PHE -5.25 0.18 1 99 LYS -3.27 0.34 1 100 ASN 3.15 -0.81 1 101 SER 4.35 -1.83 1 102 GLN -4.24 -1.47 1 103 LYS 2.16 0.69 1 104 ILE -1.81 -1.40 1 105 ASP -2.13 -2.86 1 106 ARG -4.08 -3.04 1 107 LEU -5.86 -3.79 1 108 ASP -0.56 -0.75 1 110 ALA -0.60 -1.99 1 111 HIS -3.18 0.52 1 114 GLU 3.09 1.74 1 115 LEU 5.25 -0.06 1 116 THR 6.99 0.83 1 117 LYS 3.80 2.99 1 118 LYS 2.98 1.52 1 119 VAL 6.94 0.68 1 120 GLN 5.06 3.00 1 121 ARG 3.88 2.69 1 122 HIS -0.99 3.02 1 123 ALA 1.07 0.33 1 124 SER -0.08 -0.25 1 125 SER -0.30 0.07 1 128 SER 0.01 0.02 1 129 SER -0.40 -0.66 1 stop_ save_