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 bmr11087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 -2.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 4.91 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 HIS -3.79 1.26 0 10 GLU -5.70 -2.10 1 11 LEU -3.53 -1.33 1 12 LYS -3.68 -2.05 1 13 ASP -5.24 -0.19 1 14 HIS 1.41 2.62 1 15 LEU -5.26 -1.80 1 16 ARG -2.42 -0.73 1 17 ILE -3.72 -1.33 1 18 PHE -4.49 -2.71 1 19 ARG -3.44 -1.79 1 21 ARG 1.75 0.40 1 22 LYS -0.14 -1.39 1 23 LEU 1.98 1.30 1 24 THR 1.21 0.75 1 25 LEU -0.45 -0.60 1 26 LYS -0.13 0.02 1 28 TYR 0.69 1.31 1 29 ARG -4.04 -1.40 1 30 GLN 1.40 1.86 1 32 TRP -3.26 -1.24 1 33 VAL -0.76 -0.74 1 34 VAL -3.62 -1.05 1 35 PHE -5.83 -2.89 1 36 LYS -3.38 -0.82 1 37 GLU 5.70 2.63 1 38 THR 0.00 -1.11 1 39 THR -0.57 0.75 1 40 LEU -4.42 -0.74 1 41 SER -3.50 -1.34 1 42 TYR -6.40 -2.66 1 43 TYR -5.86 -0.80 1 44 LYS 4.59 4.03 1 45 SER -3.98 -1.30 1 46 GLN 4.33 2.98 1 47 ASP 2.86 1.92 1 48 GLU -0.12 0.78 1 49 ALA -0.28 -0.68 1 52 ASP -0.70 0.01 1 54 ILE 3.97 2.83 1 55 GLN -5.46 -0.71 1 56 GLN -3.19 -0.57 1 57 LEU -3.97 -1.62 1 58 ASN 0.52 -0.47 1 59 LEU 0.85 0.42 1 60 LYS 4.26 3.01 1 63 GLU -3.14 -1.19 1 64 VAL -1.50 -1.23 1 65 VAL -4.33 -0.97 1 67 ASP -0.28 -0.02 1 68 VAL -5.19 -2.60 1 69 ASN -1.40 -0.47 1 70 VAL 6.24 5.03 1 71 SER 4.49 3.13 1 73 GLN 3.66 0.77 1 74 LYS -2.11 -1.32 1 75 PHE -1.50 -2.01 1 77 ILE -2.95 0.01 1 78 LYS -1.05 -0.82 1 79 LEU -3.75 -2.05 1 80 LEU -1.03 -0.99 1 81 VAL -2.69 -0.73 1 83 SER -1.03 1.05 1 85 GLU -0.06 -0.27 1 87 MET -0.80 -0.45 1 88 SER -1.33 -0.42 1 89 GLU -4.47 -1.72 1 90 ILE -3.79 -0.87 1 91 TYR -4.07 -2.80 1 92 LEU -3.08 -1.87 1 93 ARG -1.90 -0.13 1 95 GLN 1.20 2.09 1 96 ASP -3.41 -1.85 1 97 GLU 3.86 3.10 1 98 GLN 5.45 3.62 1 99 GLN 1.64 3.93 1 100 TYR 3.33 3.60 1 101 ALA 3.53 3.51 1 102 ARG 4.06 3.53 1 103 TRP 5.51 3.98 1 104 MET 4.54 3.00 1 105 ALA 2.22 3.29 1 108 ARG 4.73 4.20 1 109 LEU 6.18 4.22 1 110 ALA 1.98 2.45 1 111 SER 3.06 2.64 1 112 LYS -0.42 -1.18 1 114 ARG -3.45 -1.68 1 115 THR -4.78 -2.48 1 116 MET 1.88 2.18 1 117 ALA -0.17 -0.33 1 118 ASP -1.88 1.21 1 119 SER 3.90 2.95 1 120 SER 1.12 1.65 1 121 TYR 6.04 5.32 1 122 THR 6.39 4.82 1 123 SER 4.42 3.06 1 124 GLU 3.47 2.54 1 125 VAL 5.91 4.94 1 126 GLN 4.21 2.88 1 127 ALA 3.58 2.52 1 128 ILE 4.89 4.37 1 129 LEU 4.36 3.34 1 130 ALA 3.86 2.63 1 131 PHE 3.67 3.17 1 132 LEU 3.33 2.49 1 133 SER 3.30 2.68 1 134 LEU 1.41 0.98 1 135 GLN 0.65 -0.08 1 136 ARG 0.39 0.40 1 137 THR 0.50 1.46 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 4.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.41 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -1.48 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 HIS -3.79 5.05 0 10 GLU -5.70 3.60 1 11 LEU -3.53 2.20 1 12 LYS -3.68 1.63 1 13 ASP -5.24 5.05 1 14 HIS 1.41 1.21 1 15 LEU -5.26 3.46 1 16 ARG -2.42 1.69 1 17 ILE -3.72 2.39 1 18 PHE -4.49 1.78 1 19 ARG -3.44 1.65 1 21 ARG 1.75 -1.35 1 22 LYS -0.14 -1.25 1 23 LEU 1.98 -0.68 1 24 THR 1.21 -0.46 1 25 LEU -0.45 -0.15 1 26 LYS -0.13 0.15 1 28 TYR 0.69 0.62 1 29 ARG -4.04 2.64 1 30 GLN 1.40 0.46 1 32 TRP -3.26 2.02 1 33 VAL -0.76 0.02 1 34 VAL -3.62 2.57 1 35 PHE -5.83 2.94 1 36 LYS -3.38 2.56 1 37 GLU 5.70 -3.07 1 38 THR 0.00 -1.11 1 39 THR -0.57 1.32 1 40 LEU -4.42 3.68 1 41 SER -3.50 2.16 1 42 TYR -6.40 3.74 1 43 TYR -5.86 5.06 1 44 LYS 4.59 -0.56 1 45 SER -3.98 2.68 1 46 GLN 4.33 -1.35 1 47 ASP 2.86 -0.94 1 48 GLU -0.12 0.90 1 49 ALA -0.28 -0.40 1 52 ASP -0.70 0.71 1 54 ILE 3.97 -1.14 1 55 GLN -5.46 4.75 1 56 GLN -3.19 2.62 1 57 LEU -3.97 2.35 1 58 ASN 0.52 -0.99 1 59 LEU 0.85 -0.43 1 60 LYS 4.26 -1.25 1 63 GLU -3.14 1.95 1 64 VAL -1.50 0.27 1 65 VAL -4.33 3.36 1 67 ASP -0.28 0.26 1 68 VAL -5.19 2.59 1 69 ASN -1.40 0.93 1 70 VAL 6.24 -1.21 1 71 SER 4.49 -1.36 1 73 GLN 3.66 -2.89 1 74 LYS -2.11 0.79 1 75 PHE -1.50 -0.51 1 77 ILE -2.95 2.96 1 78 LYS -1.05 0.23 1 79 LEU -3.75 1.70 1 80 LEU -1.03 0.04 1 81 VAL -2.69 1.96 1 83 SER -1.03 2.08 1 85 GLU -0.06 -0.21 1 87 MET -0.80 0.35 1 88 SER -1.33 0.91 1 89 GLU -4.47 2.75 1 90 ILE -3.79 2.92 1 91 TYR -4.07 1.27 1 92 LEU -3.08 1.21 1 93 ARG -1.90 1.77 1 95 GLN 1.20 0.89 1 96 ASP -3.41 1.56 1 97 GLU 3.86 -0.76 1 98 GLN 5.45 -1.83 1 99 GLN 1.64 2.29 1 100 TYR 3.33 0.27 1 101 ALA 3.53 -0.02 1 102 ARG 4.06 -0.53 1 103 TRP 5.51 -1.53 1 104 MET 4.54 -1.54 1 105 ALA 2.22 1.07 1 108 ARG 4.73 -0.53 1 109 LEU 6.18 -1.96 1 110 ALA 1.98 0.47 1 111 SER 3.06 -0.42 1 112 LYS -0.42 -0.76 1 114 ARG -3.45 1.77 1 115 THR -4.78 2.30 1 116 MET 1.88 0.30 1 117 ALA -0.17 -0.16 1 118 ASP -1.88 3.09 1 119 SER 3.90 -0.95 1 120 SER 1.12 0.53 1 121 TYR 6.04 -0.72 1 122 THR 6.39 -1.57 1 123 SER 4.42 -1.36 1 124 GLU 3.47 -0.93 1 125 VAL 5.91 -0.97 1 126 GLN 4.21 -1.33 1 127 ALA 3.58 -1.06 1 128 ILE 4.89 -0.52 1 129 LEU 4.36 -1.02 1 130 ALA 3.86 -1.23 1 131 PHE 3.67 -0.50 1 132 LEU 3.33 -0.84 1 133 SER 3.30 -0.62 1 134 LEU 1.41 -0.43 1 135 GLN 0.65 -0.73 1 136 ARG 0.39 0.01 1 137 THR 0.50 0.96 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.40 _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 -0.14 _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 6.39 _LACS_plot.Line_2_terminator_val_y_2 -0.59 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 TYR -6.40 1.42 0 55 GLN -5.46 -0.15 0 97 GLU 3.86 -1.27 0 46 GLN 4.33 -1.33 0 14 HIS 1.41 0.96 0 10 GLU -5.70 0.43 1 11 LEU -3.53 0.15 1 12 LYS -3.68 1.16 1 13 ASP -5.24 0.07 1 15 LEU -5.26 0.41 1 16 ARG -2.42 0.67 1 17 ILE -3.72 1.26 1 18 PHE -4.49 0.20 1 19 ARG -3.44 0.09 1 21 ARG 1.75 -0.16 1 22 LYS -0.14 0.15 1 23 LEU 1.98 -0.10 1 24 THR 1.21 -0.11 1 25 LEU -0.45 0.16 1 26 LYS -0.13 0.07 1 28 TYR 0.69 -0.13 1 30 GLN 1.40 0.31 1 31 HIS -3.79 0.32 1 32 TRP -3.26 0.43 1 33 VAL -0.76 0.71 1 34 VAL -3.62 0.71 1 35 PHE -5.83 0.98 1 36 LYS -3.38 -0.16 1 37 GLU 5.70 -0.83 1 38 THR 0.00 0.48 1 39 THR -0.57 0.83 1 40 LEU -4.42 0.76 1 41 SER -3.50 1.05 1 43 TYR -5.86 0.34 1 44 LYS 4.59 -0.05 1 45 SER -3.98 0.33 1 47 ASP 2.86 -0.37 1 48 GLU -0.12 -0.01 1 49 ALA -0.28 -0.47 1 52 ASP -0.70 0.45 1 54 ILE 3.97 -0.60 1 56 GLN -3.19 0.60 1 57 LEU -3.97 0.33 1 58 ASN 0.52 0.18 1 59 LEU 0.85 -0.20 1 60 LYS 4.26 0.08 1 63 GLU -3.14 0.42 1 64 VAL -1.50 0.58 1 65 VAL -4.33 0.35 1 67 ASP -0.28 0.06 1 68 VAL -5.19 0.47 1 69 ASN -1.40 0.00 1 70 VAL 6.24 -0.85 1 71 SER 4.49 -0.26 1 73 GLN 3.66 -0.95 1 74 LYS -2.11 -0.26 1 75 PHE -1.50 -0.29 1 77 ILE -2.95 0.01 1 78 LYS -1.05 0.30 1 79 LEU -3.75 0.86 1 80 LEU -1.03 0.69 1 81 VAL -2.69 0.14 1 83 SER -1.03 0.23 1 85 GLU -0.06 0.01 1 87 MET -0.80 0.26 1 88 SER -1.33 0.30 1 89 GLU -4.47 0.94 1 90 ILE -3.79 0.35 1 91 TYR -4.07 1.08 1 92 LEU -3.08 0.70 1 93 ARG -1.90 0.76 1 95 GLN 1.20 -0.11 1 96 ASP -3.41 -0.41 1 98 GLN 5.45 -0.43 1 99 GLN 1.64 -0.10 1 100 TYR 3.33 0.15 1 101 ALA 3.53 -0.55 1 102 ARG 4.06 -0.30 1 103 TRP 5.51 -0.84 1 104 MET 4.54 -0.41 1 105 ALA 2.22 -0.45 1 108 ARG 4.73 -0.55 1 109 LEU 6.18 -0.46 1 110 ALA 1.98 0.30 1 111 SER 3.06 0.41 1 112 LYS -0.42 0.29 1 114 ARG -3.45 0.27 1 115 THR -4.78 0.31 1 116 MET 1.88 -0.96 1 117 ALA -0.17 -0.16 1 118 ASP -1.88 -0.24 1 119 SER 3.90 -0.20 1 120 SER 1.12 0.02 1 121 TYR 6.04 -0.60 1 122 THR 6.39 -0.81 1 123 SER 4.42 -0.27 1 124 GLU 3.47 -0.21 1 125 VAL 5.91 -0.90 1 126 GLN 4.21 -0.45 1 127 ALA 3.58 -0.11 1 128 ILE 4.89 -0.25 1 129 LEU 4.36 -0.32 1 130 ALA 3.86 -0.17 1 131 PHE 3.67 -0.22 1 132 LEU 3.33 -0.39 1 133 SER 3.30 -0.22 1 134 LEU 1.41 -0.09 1 135 GLN 0.65 -0.11 1 136 ARG 0.39 0.03 1 137 THR 0.50 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11087_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.40 _LACS_plot.Line_1_terminator_val_y_1 -2.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 2.43 _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 73 GLN 3.66 -2.72 0 137 THR 0.50 4.49 0 37 GLU 5.70 -1.94 0 10 GLU -5.70 -1.38 1 11 LEU -3.53 -2.98 1 12 LYS -3.68 -1.85 1 13 ASP -5.24 -1.26 1 14 HIS 1.41 1.45 1 15 LEU -5.26 -1.74 1 16 ARG -2.42 -1.20 1 17 ILE -3.72 -0.89 1 18 PHE -4.49 -2.84 1 19 ARG -3.44 -1.53 1 21 ARG 1.75 -0.09 1 22 LYS -0.14 -0.18 1 23 LEU 1.98 0.31 1 24 THR 1.21 -0.09 1 25 LEU -0.45 -1.05 1 26 LYS -0.13 0.52 1 28 TYR 0.69 1.03 1 29 ARG -4.04 0.08 1 30 GLN 1.40 -1.60 1 31 HIS -3.79 -0.88 1 32 TRP -3.26 -1.83 1 33 VAL -0.76 -3.21 1 34 VAL -3.62 -1.73 1 35 PHE -5.83 -2.72 1 36 LYS -3.38 -1.94 1 38 THR 0.00 -1.80 1 39 THR -0.57 -2.61 1 40 LEU -4.42 -2.91 1 41 SER -3.50 -2.77 1 42 TYR -6.40 -2.98 1 43 TYR -5.86 0.61 1 44 LYS 4.59 0.08 1 45 SER -3.98 -1.00 1 46 GLN 4.33 1.25 1 47 ASP 2.86 0.51 1 48 GLU -0.12 -2.47 1 49 ALA -0.28 0.05 1 52 ASP -0.70 -3.10 1 54 ILE 3.97 0.57 1 55 GLN -5.46 -2.91 1 56 GLN -3.19 -1.64 1 57 LEU -3.97 -3.29 1 58 ASN 0.52 0.96 1 59 LEU 0.85 -0.08 1 60 LYS 4.26 1.94 1 63 GLU -3.14 -1.60 1 64 VAL -1.50 -0.71 1 65 VAL -4.33 -1.43 1 67 ASP -0.28 0.74 1 68 VAL -5.19 -0.11 1 69 ASN -1.40 0.01 1 70 VAL 6.24 3.20 1 71 SER 4.49 1.08 1 74 LYS -2.11 -3.04 1 75 PHE -1.50 -2.05 1 77 ILE -2.95 -2.30 1 78 LYS -1.05 -2.24 1 79 LEU -3.75 -2.04 1 80 LEU -1.03 -1.15 1 81 VAL -2.69 -1.04 1 83 SER -1.03 0.62 1 85 GLU -0.06 -0.87 1 87 MET -0.80 0.24 1 88 SER -1.33 -2.13 1 89 GLU -4.47 -1.32 1 90 ILE -3.79 -3.90 1 91 TYR -4.07 -0.60 1 92 LEU -3.08 -1.93 1 93 ARG -1.90 0.08 1 95 GLN 1.20 -0.54 1 96 ASP -3.41 -2.02 1 97 GLU 3.86 0.40 1 98 GLN 5.45 2.21 1 99 GLN 1.64 2.31 1 100 TYR 3.33 0.22 1 101 ALA 3.53 1.34 1 102 ARG 4.06 4.04 1 103 TRP 5.51 2.12 1 104 MET 4.54 1.71 1 105 ALA 2.22 1.91 1 108 ARG 4.73 3.87 1 109 LEU 6.18 1.71 1 110 ALA 1.98 3.75 1 111 SER 3.06 2.93 1 112 LYS -0.42 0.04 1 114 ARG -3.45 -2.63 1 115 THR -4.78 0.70 1 116 MET 1.88 -1.81 1 117 ALA -0.17 0.00 1 118 ASP -1.88 1.61 1 119 SER 3.90 0.92 1 120 SER 1.12 0.75 1 121 TYR 6.04 0.57 1 122 THR 6.39 2.28 1 123 SER 4.42 2.39 1 124 GLU 3.47 2.24 1 125 VAL 5.91 1.94 1 126 GLN 4.21 2.80 1 127 ALA 3.58 3.51 1 128 ILE 4.89 1.92 1 129 LEU 4.36 2.59 1 130 ALA 3.86 2.61 1 131 PHE 3.67 2.83 1 132 LEU 3.33 2.00 1 133 SER 3.30 1.30 1 134 LEU 1.41 0.38 1 135 GLN 0.65 -0.26 1 136 ARG 0.39 -0.74 1 stop_ save_