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 bmr4046_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _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 1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.32 _LACS_plot.Line_2_terminator_val_x_2 9.95 _LACS_plot.Line_2_terminator_val_y_2 7.47 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 HIS -3.74 2.57 0 10 ALA -0.07 0.02 1 11 ALA -0.21 -0.05 1 12 ILE 0.41 0.12 1 14 SER 1.78 1.52 1 16 VAL 0.42 0.80 1 18 ALA 3.86 3.27 1 19 PHE 3.66 4.89 1 20 LEU 0.02 0.98 1 21 ALA 3.75 3.10 1 22 LYS 3.18 2.94 1 23 LEU 3.64 2.80 1 25 ARG 4.59 3.61 1 26 ILE -7.69 -3.49 1 28 ASP 0.56 2.97 1 29 ASP 0.72 0.80 1 30 ALA 2.36 1.86 1 31 ASP 3.03 2.57 1 32 THR -0.44 -1.05 1 33 ASN 2.91 2.02 1 34 ARG 3.64 2.36 1 35 LEU -3.32 0.62 1 36 ILE -2.26 -2.24 1 38 TRP -2.72 -0.08 1 39 THR -0.13 0.15 1 40 LYS 5.00 4.18 1 41 ASP 0.30 -0.13 1 43 GLN -0.46 -0.37 1 44 SER -2.42 -1.19 1 45 PHE -5.83 -1.71 1 46 VAL -7.03 -3.66 1 47 ILE -0.90 -0.93 1 48 GLN 0.85 1.68 1 49 ASN -0.09 0.12 1 50 GLN 4.76 5.36 1 51 ALA 3.75 2.95 1 52 GLN 3.66 2.68 1 53 PHE 4.51 5.09 1 54 ALA 2.28 2.01 1 55 LYS 1.09 1.96 1 56 GLU -0.83 1.41 1 57 LEU 0.53 0.77 1 58 LEU 9.96 6.86 1 60 LEU 0.94 1.57 1 61 ASN -1.34 2.52 1 62 TYR -1.81 -0.39 1 63 LYS 5.25 1.53 1 64 HIS -2.65 0.61 1 65 ASN -2.21 -1.38 1 66 ASN -1.30 -0.17 1 67 MET 2.69 2.33 1 68 ALA 4.62 3.14 1 69 SER 3.98 2.98 1 70 PHE 3.17 3.54 1 71 ILE 5.41 4.12 1 72 ARG 4.91 3.93 1 73 GLN 4.55 3.35 1 74 LEU 5.21 2.99 1 75 ASN 3.82 3.64 1 76 MET 3.78 3.02 1 77 TYR 1.68 2.03 1 79 PHE 0.89 1.42 1 80 HIS -3.29 -0.58 1 81 LYS -0.84 -0.59 1 82 ILE -0.53 -0.93 1 83 THR -0.94 -0.42 1 84 SER -0.15 0.01 1 85 ILE 0.36 0.41 1 86 ASP -0.28 0.13 1 87 ASN 0.52 0.40 1 90 LEU 0.40 0.35 1 91 ARG -0.26 -0.24 1 92 PHE 0.15 0.09 1 93 ASP 0.15 0.17 1 94 ARG -0.50 0.03 1 95 ASP -0.09 0.25 1 96 GLU -2.67 -0.90 1 97 ILE -3.37 -0.44 1 98 GLU -6.33 -2.76 1 99 PHE -7.56 -1.62 1 100 SER -5.87 -2.02 1 103 PHE -1.53 -2.65 1 104 PHE -3.80 -0.51 1 105 LYS -4.65 0.61 1 110 PHE 1.66 -0.51 1 111 LEU 0.22 0.56 1 112 LEU 1.88 2.74 1 113 ASP 2.26 1.43 1 114 GLN 0.03 -0.20 1 115 ILE 4.95 2.72 1 116 LYS -3.69 -1.83 1 117 ARG 0.01 0.21 1 118 LYS 0.19 0.31 1 119 ILE -0.39 -0.20 1 120 SER -0.57 -0.26 1 121 ASN 0.07 0.15 1 122 ASN 0.29 0.31 1 123 LYS 0.85 0.51 1 124 ASN 0.21 0.39 1 126 ASP -0.04 0.20 1 127 ASP 0.35 0.33 1 128 LYS 1.01 0.46 1 130 VAL 0.29 0.12 1 131 LEU 0.03 -0.04 1 132 LYS -0.29 -0.18 1 134 ALA -0.38 -0.06 1 135 ALA -0.54 -0.11 1 136 GLU -0.12 1.37 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4046_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 4.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.96 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.68 _LACS_plot.Line_2_terminator_val_x_2 9.95 _LACS_plot.Line_2_terminator_val_y_2 -2.48 _LACS_plot.Y_axis_chem_shift_offset -0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 101 HIS -3.74 6.31 0 10 ALA -0.07 0.09 1 11 ALA -0.21 0.16 1 12 ILE 0.41 -0.29 1 14 SER 1.78 -0.26 1 16 VAL 0.42 0.38 1 18 ALA 3.86 -0.59 1 19 PHE 3.66 1.23 1 20 LEU 0.02 0.96 1 21 ALA 3.75 -0.65 1 22 LYS 3.18 -0.24 1 23 LEU 3.64 -0.84 1 25 ARG 4.59 -0.98 1 26 ILE -7.69 4.20 1 28 ASP 0.56 2.41 1 29 ASP 0.72 0.08 1 30 ALA 2.36 -0.50 1 31 ASP 3.03 -0.46 1 32 THR -0.44 -0.61 1 33 ASN 2.91 -0.89 1 34 ARG 3.64 -1.28 1 35 LEU -3.32 3.94 1 36 ILE -2.26 0.02 1 38 TRP -2.72 2.64 1 39 THR -0.13 0.28 1 40 LYS 5.00 -0.82 1 41 ASP 0.30 -0.43 1 43 GLN -0.46 0.09 1 44 SER -2.42 1.23 1 45 PHE -5.83 4.12 1 46 VAL -7.03 3.37 1 47 ILE -0.90 -0.03 1 48 GLN 0.85 0.83 1 49 ASN -0.09 0.21 1 50 GLN 4.76 0.60 1 51 ALA 3.75 -0.80 1 52 GLN 3.66 -0.98 1 53 PHE 4.51 0.58 1 54 ALA 2.28 -0.27 1 55 LYS 1.09 0.87 1 56 GLU -0.83 2.24 1 57 LEU 0.53 0.24 1 58 LEU 9.96 -3.10 1 60 LEU 0.94 0.63 1 61 ASN -1.34 3.86 1 62 TYR -1.81 1.42 1 63 LYS 5.25 -3.72 1 64 HIS -2.65 3.26 1 65 ASN -2.21 0.83 1 66 ASN -1.30 1.13 1 67 MET 2.69 -0.36 1 68 ALA 4.62 -1.48 1 69 SER 3.98 -1.00 1 70 PHE 3.17 0.37 1 71 ILE 5.41 -1.29 1 72 ARG 4.91 -0.98 1 73 GLN 4.55 -1.20 1 74 LEU 5.21 -2.22 1 75 ASN 3.82 -0.18 1 76 MET 3.78 -0.76 1 77 TYR 1.68 0.35 1 79 PHE 0.89 0.53 1 80 HIS -3.29 2.71 1 81 LYS -0.84 0.25 1 82 ILE -0.53 -0.40 1 83 THR -0.94 0.52 1 84 SER -0.15 0.16 1 85 ILE 0.36 0.05 1 86 ASP -0.28 0.41 1 87 ASN 0.52 -0.12 1 90 LEU 0.40 -0.05 1 91 ARG -0.26 0.02 1 92 PHE 0.15 -0.06 1 93 ASP 0.15 0.02 1 94 ARG -0.50 0.53 1 95 ASP -0.09 0.34 1 96 GLU -2.67 1.77 1 97 ILE -3.37 2.93 1 98 GLU -6.33 3.57 1 99 PHE -7.56 5.94 1 100 SER -5.87 3.85 1 103 PHE -1.53 -1.12 1 104 PHE -3.80 3.29 1 105 LYS -4.65 5.26 1 110 PHE 1.66 -2.17 1 111 LEU 0.22 0.34 1 112 LEU 1.88 0.86 1 113 ASP 2.26 -0.83 1 114 GLN 0.03 -0.23 1 115 ILE 4.95 -2.23 1 116 LYS -3.69 1.86 1 117 ARG 0.01 0.20 1 118 LYS 0.19 0.12 1 119 ILE -0.39 0.19 1 120 SER -0.57 0.31 1 121 ASN 0.07 0.08 1 122 ASN 0.29 0.02 1 123 LYS 0.85 -0.34 1 124 ASN 0.21 0.18 1 126 ASP -0.04 0.24 1 127 ASP 0.35 -0.02 1 128 LYS 1.01 -0.55 1 130 VAL 0.29 -0.17 1 131 LEU 0.03 -0.07 1 132 LYS -0.29 0.11 1 134 ALA -0.38 0.32 1 135 ALA -0.54 0.43 1 136 GLU -0.12 1.49 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4046_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 0.80 _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 0.17 _LACS_plot.Line_2_terminator_val_x_2 9.95 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _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 26 ILE -7.69 -0.12 0 36 ILE -2.26 1.44 0 10 ALA -0.07 -0.06 1 11 ALA -0.21 -0.07 1 12 ILE 0.41 -0.28 1 14 SER 1.78 -0.16 1 16 VAL 0.42 -0.25 1 18 ALA 3.86 -0.15 1 19 PHE 3.66 -0.28 1 20 LEU 0.02 -0.43 1 21 ALA 3.75 -0.30 1 22 LYS 3.18 -0.43 1 23 LEU 3.64 -0.53 1 25 ARG 4.59 -0.48 1 28 ASP 0.56 -0.41 1 29 ASP 0.72 -0.30 1 30 ALA 2.36 -0.14 1 31 ASP 3.03 -0.14 1 32 THR -0.44 0.34 1 33 ASN 2.91 0.13 1 34 ARG 3.64 -0.23 1 35 LEU -3.32 0.45 1 38 TRP -2.72 0.53 1 39 THR -0.13 0.14 1 40 LYS 5.00 -0.27 1 41 ASP 0.30 0.10 1 43 GLN -0.46 0.26 1 44 SER -2.42 1.09 1 45 PHE -5.83 1.23 1 46 VAL -7.03 1.01 1 47 ILE -0.90 0.48 1 48 GLN 0.85 -0.07 1 49 ASN -0.09 -0.03 1 50 GLN 4.76 -0.49 1 51 ALA 3.75 -0.10 1 52 GLN 3.66 -0.26 1 53 PHE 4.51 -0.69 1 54 ALA 2.28 -0.58 1 55 LYS 1.09 -0.17 1 56 GLU -0.83 -0.01 1 57 LEU 0.53 0.08 1 58 LEU 9.96 -0.78 1 60 LEU 0.94 -0.33 1 61 ASN -1.34 -0.35 1 62 TYR -1.81 0.30 1 63 LYS 5.25 -0.15 1 64 HIS -2.65 -0.07 1 65 ASN -2.21 0.19 1 66 ASN -1.30 0.11 1 67 MET 2.69 -0.09 1 68 ALA 4.62 -0.19 1 69 SER 3.98 -0.35 1 70 PHE 3.17 -0.23 1 71 ILE 5.41 -0.97 1 72 ARG 4.91 -0.32 1 73 GLN 4.55 -0.62 1 74 LEU 5.21 -0.65 1 75 ASN 3.82 -0.15 1 76 MET 3.78 -0.14 1 77 TYR 1.68 0.16 1 79 PHE 0.89 0.06 1 80 HIS -3.29 0.31 1 81 LYS -0.84 0.00 1 82 ILE -0.53 -0.01 1 83 THR -0.94 0.08 1 84 SER -0.15 0.02 1 85 ILE 0.36 0.00 1 86 ASP -0.28 -0.03 1 87 ASN 0.52 -0.06 1 90 LEU 0.40 -0.05 1 91 ARG -0.26 -0.03 1 92 PHE 0.15 0.02 1 93 ASP 0.15 0.14 1 94 ARG -0.50 0.10 1 95 ASP -0.09 -0.02 1 96 GLU -2.67 0.61 1 97 ILE -3.37 0.22 1 98 GLU -6.33 0.82 1 99 PHE -7.56 0.90 1 100 SER -5.87 1.14 1 101 HIS -3.74 -0.38 1 103 PHE -1.53 0.44 1 104 PHE -3.80 0.43 1 105 LYS -4.65 0.29 1 110 PHE 1.66 -0.19 1 111 LEU 0.22 -0.09 1 112 LEU 1.88 -0.33 1 113 ASP 2.26 -0.37 1 114 GLN 0.03 -0.24 1 115 ILE 4.95 -0.23 1 116 LYS -3.69 0.48 1 117 ARG 0.01 -0.16 1 118 LYS 0.19 -0.01 1 119 ILE -0.39 0.04 1 120 SER -0.57 0.02 1 121 ASN 0.07 0.00 1 122 ASN 0.29 -0.05 1 123 LYS 0.85 -0.02 1 124 ASN 0.21 -0.03 1 126 ASP -0.04 -0.02 1 127 ASP 0.35 -0.07 1 128 LYS 1.01 -0.04 1 130 VAL 0.29 -0.03 1 131 LEU 0.03 0.01 1 132 LYS -0.29 0.00 1 134 ALA -0.38 -0.04 1 135 ALA -0.54 0.01 1 136 GLU -0.12 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4046_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.69 _LACS_plot.Line_1_terminator_val_y_1 -3.15 _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 -1.00 _LACS_plot.Line_2_terminator_val_x_2 5.40 _LACS_plot.Line_2_terminator_val_y_2 2.44 _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 26 ILE -7.69 2.25 0 10 ALA -0.07 -0.44 1 11 ALA -0.21 -0.64 1 12 ILE 0.41 0.35 1 14 SER 1.78 0.90 1 18 ALA 3.86 1.57 1 19 PHE 3.66 2.30 1 20 LEU 0.02 0.12 1 21 ALA 3.75 2.55 1 22 LYS 3.18 2.36 1 23 LEU 3.64 0.06 1 25 ARG 4.59 1.90 1 28 ASP 0.56 0.38 1 29 ASP 0.72 1.47 1 30 ALA 2.36 3.12 1 31 ASP 3.03 2.00 1 32 THR -0.44 1.22 1 33 ASN 2.91 0.43 1 34 ARG 3.64 -0.34 1 35 LEU -3.32 -1.75 1 36 ILE -2.26 -3.53 1 38 TRP -2.72 3.08 1 39 THR -0.13 2.67 1 40 LYS 5.00 1.72 1 41 ASP 0.30 1.69 1 43 GLN -0.46 0.16 1 44 SER -2.42 -2.90 1 45 PHE -5.83 -4.38 1 46 VAL -7.03 -1.57 1 47 ILE -0.90 -0.49 1 48 GLN 0.85 -0.96 1 49 ASN -0.09 0.25 1 50 GLN 4.76 1.12 1 51 ALA 3.75 3.28 1 52 GLN 3.66 2.20 1 53 PHE 4.51 1.26 1 54 ALA 2.28 -1.09 1 55 LYS 1.09 1.35 1 56 GLU -0.83 1.06 1 57 LEU 0.53 1.68 1 60 LEU 0.94 -0.29 1 61 ASN -1.34 -1.00 1 62 TYR -1.81 -1.19 1 63 LYS 5.25 -1.72 1 64 HIS -2.65 -2.02 1 66 ASN -1.30 -0.08 1 67 MET 2.69 1.48 1 68 ALA 4.62 3.45 1 69 SER 3.98 2.03 1 70 PHE 3.17 0.49 1 71 ILE 5.41 1.53 1 72 ARG 4.91 2.96 1 73 GLN 4.55 1.96 1 74 LEU 5.21 2.75 1 75 ASN 3.82 4.41 1 76 MET 3.78 0.75 1 77 TYR 1.68 -1.35 1 79 PHE 0.89 0.15 1 80 HIS -3.29 -0.37 1 81 LYS -0.84 -0.58 1 82 ILE -0.53 -0.46 1 83 THR -0.94 -0.50 1 84 SER -0.15 0.12 1 85 ILE 0.36 -0.29 1 86 ASP -0.28 -0.06 1 87 ASN 0.52 0.95 1 90 LEU 0.40 -0.36 1 91 ARG -0.26 -0.19 1 92 PHE 0.15 -0.26 1 93 ASP 0.15 -0.37 1 94 ARG -0.50 -0.51 1 95 ASP -0.09 -0.13 1 96 GLU -2.67 -0.43 1 97 ILE -3.37 -5.28 1 98 GLU -6.33 -2.59 1 99 PHE -7.56 -0.98 1 100 SER -5.87 -1.39 1 103 PHE -1.53 -2.07 1 104 PHE -3.80 -2.91 1 110 PHE 1.66 0.85 1 111 LEU 0.22 0.05 1 112 LEU 1.88 0.95 1 113 ASP 2.26 0.28 1 114 GLN 0.03 0.24 1 115 ILE 4.95 -1.62 1 116 LYS -3.69 -0.54 1 117 ARG 0.01 0.23 1 118 LYS 0.19 -0.44 1 119 ILE -0.39 -0.28 1 120 SER -0.57 -0.49 1 121 ASN 0.07 -0.31 1 122 ASN 0.29 0.16 1 123 LYS 0.85 -0.12 1 124 ASN 0.21 0.53 1 126 ASP -0.04 -0.15 1 127 ASP 0.35 0.37 1 128 LYS 1.01 0.78 1 130 VAL 0.29 -0.22 1 131 LEU 0.03 -0.78 1 134 ALA -0.38 -0.47 1 135 ALA -0.54 -1.18 1 stop_ save_