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 bmr15601_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 -3.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 7.02 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 THR 9.45 5.26 0 104 ASN -3.61 -0.46 0 69 HIS -5.13 -1.86 0 24 ASP 3.81 0.47 0 10 ILE 1.69 2.44 1 11 ASN 1.82 1.90 1 12 PHE 2.10 2.08 1 14 LYS 4.35 3.24 1 15 ALA 2.64 2.59 1 16 LEU 4.52 3.41 1 17 ASP 4.35 3.45 1 18 THR 6.88 5.38 1 20 LYS 5.33 4.18 1 21 LYS 3.01 2.37 1 22 GLU 2.06 2.65 1 23 LEU -0.94 -0.89 1 25 LEU 0.63 -0.26 1 27 ASP 3.52 2.96 1 28 SER 1.53 0.85 1 29 ILE 0.56 -0.08 1 30 ASN 6.34 4.44 1 31 GLU 3.03 2.50 1 32 ASP 4.41 3.47 1 33 PHE 4.25 4.38 1 34 TYR 4.71 3.87 1 35 LYS 4.02 3.63 1 36 PHE 4.24 3.06 1 37 TRP 0.09 0.14 1 38 LYS 0.38 1.22 1 39 GLU -1.53 -1.11 1 40 ASP 1.23 0.57 1 41 TYR -1.11 -0.71 1 42 GLU -0.68 -0.58 1 43 ILE -0.33 -0.36 1 44 THR -0.63 -0.82 1 45 ASN -1.51 -0.54 1 46 ARG 4.27 3.49 1 47 LEU 5.03 3.08 1 51 ALA 5.60 3.71 1 52 ILE 6.31 5.56 1 53 LYS 3.40 2.92 1 55 LEU 3.01 3.58 1 56 SER 3.40 3.11 1 57 GLU 0.01 -0.57 1 58 LYS -1.69 -1.83 1 59 LEU 5.06 3.23 1 60 GLU 3.84 1.92 1 61 MET 0.34 1.55 1 62 VAL 2.36 1.59 1 63 ASP -3.25 -1.62 1 64 ALA 1.56 1.40 1 65 ASP 0.49 0.62 1 67 LYS -0.23 -0.61 1 68 LEU -0.56 0.02 1 70 HIS 4.84 3.24 1 72 ASN 0.37 0.38 1 73 ALA -1.02 -0.89 1 74 ARG 5.82 5.27 1 75 GLU 4.03 3.33 1 76 PHE 3.67 3.78 1 77 ALA 5.32 3.28 1 78 MET 2.71 2.52 1 79 LYS 1.72 0.73 1 80 HIS 1.03 0.40 1 82 ALA -1.60 -1.20 1 83 ASP -2.16 -2.29 1 84 ASP 2.79 3.99 1 85 ALA 3.82 2.76 1 86 MET 2.58 2.86 1 87 ALA 5.01 3.31 1 88 LYS 3.49 2.97 1 89 GLN 3.88 3.45 1 90 LEU 4.34 3.52 1 91 VAL 5.23 3.37 1 92 ASP 5.13 3.51 1 93 LEU 2.40 2.58 1 94 ILE 6.62 4.62 1 95 HIS 3.14 2.22 1 98 GLU 4.22 2.61 1 99 LYS 1.18 1.20 1 100 SER 0.40 0.99 1 101 ILE 0.65 0.23 1 105 ASP 2.43 1.68 1 106 ASP -1.49 -2.11 1 107 ARG 2.96 1.65 1 109 MET 2.48 0.46 1 110 GLU 3.23 3.33 1 111 VAL 6.48 4.75 1 112 LEU 3.04 3.09 1 113 SER 6.59 4.54 1 114 ILE 5.97 5.54 1 115 ALA 3.99 3.53 1 116 MET 3.89 4.11 1 118 PHE 1.80 2.40 1 119 LYS 4.86 4.10 1 120 LYS 4.40 3.46 1 121 GLU 2.26 1.73 1 122 ILE 4.29 2.67 1 123 HIS 3.86 2.87 1 124 ASN 0.40 0.42 1 125 LEU -0.54 -0.32 1 126 LYS 2.64 0.65 1 127 TRP -3.55 -2.79 1 128 ALA -2.43 -1.42 1 130 ASN -0.28 -0.12 1 131 MET 3.55 3.06 1 132 GLU 5.69 4.15 1 133 VAL 6.34 4.81 1 134 VAL 6.70 5.59 1 135 VAL 5.88 4.05 1 137 GLU 4.61 2.27 1 138 VAL 6.25 4.75 1 139 LEU 3.41 2.38 1 140 ALA 0.48 1.55 1 141 GLU -2.15 -0.43 1 142 VAL 1.33 0.83 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15601_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 2.02 _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 0.75 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 -2.43 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 THR 9.45 -4.19 0 104 ASN -3.61 3.15 0 69 HIS -5.13 3.27 0 24 ASP 3.81 -3.34 0 10 ILE 1.69 0.75 1 11 ASN 1.82 0.08 1 12 PHE 2.10 -0.02 1 14 LYS 4.35 -1.11 1 15 ALA 2.64 -0.05 1 16 LEU 4.52 -1.11 1 17 ASP 4.35 -0.90 1 18 THR 6.88 -1.50 1 20 LYS 5.33 -1.15 1 21 LYS 3.01 -0.64 1 22 GLU 2.06 0.59 1 23 LEU -0.94 0.05 1 25 LEU 0.63 -0.89 1 27 ASP 3.52 -0.56 1 28 SER 1.53 -0.68 1 29 ILE 0.56 -0.64 1 30 ASN 6.34 -1.90 1 31 GLU 3.03 -0.53 1 32 ASP 4.41 -0.94 1 33 PHE 4.25 0.13 1 34 TYR 4.71 -0.84 1 35 LYS 4.02 -0.39 1 36 PHE 4.24 -1.18 1 37 TRP 0.09 0.05 1 38 LYS 0.38 0.84 1 39 GLU -1.53 0.42 1 40 ASP 1.23 -0.66 1 41 TYR -1.11 0.40 1 42 GLU -0.68 0.10 1 43 ILE -0.33 -0.03 1 44 THR -0.63 -0.19 1 45 ASN -1.51 0.97 1 46 ARG 4.27 -0.78 1 47 LEU 5.03 -1.95 1 51 ALA 5.60 -1.89 1 52 ILE 6.31 -0.75 1 53 LYS 3.40 -0.48 1 55 LEU 3.01 0.57 1 56 SER 3.40 -0.29 1 57 GLU 0.01 -0.58 1 58 LYS -1.69 -0.14 1 59 LEU 5.06 -1.83 1 60 GLU 3.84 -1.92 1 61 MET 0.34 1.21 1 62 VAL 2.36 -0.77 1 63 ASP -3.25 1.63 1 64 ALA 1.56 -0.16 1 65 ASP 0.49 0.13 1 67 LYS -0.23 -0.38 1 68 LEU -0.56 0.58 1 70 HIS 4.84 -1.60 1 72 ASN 0.37 0.01 1 73 ALA -1.02 0.13 1 74 ARG 5.82 -0.55 1 75 GLU 4.03 -0.70 1 76 PHE 3.67 0.11 1 77 ALA 5.32 -2.04 1 78 MET 2.71 -0.19 1 79 LYS 1.72 -0.99 1 80 HIS 1.03 -0.63 1 82 ALA -1.60 0.40 1 83 ASP -2.16 -0.13 1 84 ASP 2.79 1.20 1 85 ALA 3.82 -1.06 1 86 MET 2.58 0.28 1 87 ALA 5.01 -1.70 1 88 LYS 3.49 -0.52 1 89 GLN 3.88 -0.43 1 90 LEU 4.34 -0.82 1 91 VAL 5.23 -1.86 1 92 ASP 5.13 -1.62 1 93 LEU 2.40 0.18 1 94 ILE 6.62 -2.00 1 95 HIS 3.14 -0.92 1 98 GLU 4.22 -1.61 1 99 LYS 1.18 0.02 1 100 SER 0.40 0.59 1 101 ILE 0.65 -0.42 1 105 ASP 2.43 -0.75 1 106 ASP -1.49 -0.62 1 107 ARG 2.96 -1.31 1 109 MET 2.48 -2.02 1 110 GLU 3.23 0.10 1 111 VAL 6.48 -1.73 1 112 LEU 3.04 0.05 1 113 SER 6.59 -2.05 1 114 ILE 5.97 -0.43 1 115 ALA 3.99 -0.46 1 116 MET 3.89 0.22 1 118 PHE 1.80 0.60 1 119 LYS 4.86 -0.76 1 120 LYS 4.40 -0.94 1 121 GLU 2.26 -0.53 1 122 ILE 4.29 -1.62 1 123 HIS 3.86 -0.99 1 124 ASN 0.40 0.02 1 125 LEU -0.54 0.22 1 126 LYS 2.64 -1.99 1 127 TRP -3.55 0.76 1 128 ALA -2.43 1.01 1 130 ASN -0.28 0.16 1 131 MET 3.55 -0.49 1 132 GLU 5.69 -1.54 1 133 VAL 6.34 -1.53 1 134 VAL 6.70 -1.11 1 135 VAL 5.88 -1.83 1 137 GLU 4.61 -2.34 1 138 VAL 6.25 -1.50 1 139 LEU 3.41 -1.03 1 140 ALA 0.48 1.07 1 141 GLU -2.15 1.72 1 142 VAL 1.33 -0.50 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15601_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 0.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 135 VAL 5.88 -1.53 0 10 ILE 1.69 -0.24 1 11 ASN 1.82 -0.08 1 12 PHE 2.10 -0.17 1 14 LYS 4.35 -0.17 1 15 ALA 2.64 -0.26 1 16 LEU 4.52 -0.78 1 17 ASP 4.35 -0.28 1 18 THR 6.88 -0.12 1 20 LYS 5.33 -0.61 1 21 LYS 3.01 -0.12 1 22 GLU 2.06 -0.39 1 23 LEU -0.94 0.07 1 24 ASP 3.81 -0.22 1 25 LEU 0.63 -0.16 1 27 ASP 3.52 -0.41 1 28 SER 1.53 -0.18 1 29 ILE 0.56 0.06 1 30 ASN 6.34 -0.63 1 31 GLU 3.03 -0.10 1 32 ASP 4.41 -0.32 1 33 PHE 4.25 -0.70 1 34 TYR 4.71 -0.27 1 35 LYS 4.02 -0.52 1 36 PHE 4.24 -0.83 1 37 TRP 0.09 -0.76 1 38 LYS 0.38 -0.18 1 39 GLU -1.53 -0.04 1 40 ASP 1.23 -0.31 1 41 TYR -1.11 -0.10 1 42 GLU -0.68 -0.14 1 43 ILE -0.33 0.04 1 44 THR -0.63 -0.09 1 45 ASN -1.51 -0.12 1 46 ARG 4.27 -0.49 1 47 LEU 5.03 -0.41 1 48 THR 9.45 -0.40 1 51 ALA 5.60 -0.56 1 52 ILE 6.31 -0.67 1 53 LYS 3.40 -0.48 1 55 LEU 3.01 -0.69 1 56 SER 3.40 0.02 1 57 GLU 0.01 0.11 1 58 LYS -1.69 0.57 1 59 LEU 5.06 -0.62 1 60 GLU 3.84 -0.16 1 61 MET 0.34 -0.22 1 62 VAL 2.36 -0.33 1 63 ASP -3.25 0.29 1 64 ALA 1.56 -0.09 1 65 ASP 0.49 -0.03 1 67 LYS -0.23 -0.02 1 68 LEU -0.56 -0.11 1 69 HIS -5.13 0.18 1 70 HIS 4.84 -0.20 1 72 ASN 0.37 0.16 1 73 ALA -1.02 0.34 1 74 ARG 5.82 -0.47 1 75 GLU 4.03 -0.35 1 76 PHE 3.67 -0.54 1 77 ALA 5.32 -0.47 1 78 MET 2.71 0.36 1 79 LYS 1.72 -0.21 1 80 HIS 1.03 -0.21 1 82 ALA -1.60 0.26 1 83 ASP -2.16 0.03 1 84 ASP 2.79 -0.38 1 85 ALA 3.82 -0.31 1 86 MET 2.58 -0.44 1 87 ALA 5.01 -0.53 1 88 LYS 3.49 -0.29 1 89 GLN 3.88 -0.17 1 90 LEU 4.34 -0.19 1 91 VAL 5.23 -0.64 1 92 ASP 5.13 -0.25 1 93 LEU 2.40 -0.06 1 94 ILE 6.62 -0.56 1 95 HIS 3.14 -0.15 1 98 GLU 4.22 -0.48 1 99 LYS 1.18 -0.03 1 100 SER 0.40 0.00 1 101 ILE 0.65 0.02 1 104 ASN -3.61 -0.10 1 105 ASP 2.43 -0.32 1 106 ASP -1.49 0.04 1 107 ARG 2.96 -0.24 1 109 MET 2.48 -0.06 1 110 GLU 3.23 -0.29 1 111 VAL 6.48 -0.56 1 112 LEU 3.04 -0.58 1 113 SER 6.59 -0.31 1 114 ILE 5.97 -0.70 1 115 ALA 3.99 -0.16 1 116 MET 3.89 -0.50 1 118 PHE 1.80 -0.37 1 119 LYS 4.86 -0.73 1 120 LYS 4.40 -0.36 1 121 GLU 2.26 -0.19 1 122 ILE 4.29 -0.71 1 123 HIS 3.86 -0.40 1 124 ASN 0.40 -0.11 1 125 LEU -0.54 -0.14 1 126 LYS 2.64 -0.21 1 127 TRP -3.55 0.10 1 128 ALA -2.43 0.01 1 130 ASN -0.28 -0.16 1 131 MET 3.55 -0.42 1 132 GLU 5.69 -0.53 1 133 VAL 6.34 -0.54 1 134 VAL 6.70 -0.70 1 137 GLU 4.61 -0.57 1 138 VAL 6.25 -0.83 1 139 LEU 3.41 -0.60 1 140 ALA 0.48 -0.36 1 141 GLU -2.15 0.01 1 142 VAL 1.33 0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15601_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.13 _LACS_plot.Line_1_terminator_val_y_1 -1.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.36 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 2.90 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 LEU -0.56 -4.04 0 11 ASN 1.82 1.23 1 12 PHE 2.10 0.47 1 14 LYS 4.35 3.39 1 15 ALA 2.64 1.39 1 16 LEU 4.52 0.77 1 17 ASP 4.35 2.94 1 18 THR 6.88 1.90 1 20 LYS 5.33 1.62 1 21 LYS 3.01 2.59 1 22 GLU 2.06 1.72 1 23 LEU -0.94 -1.65 1 24 ASP 3.81 -0.62 1 27 ASP 3.52 1.01 1 28 SER 1.53 0.99 1 29 ILE 0.56 -0.84 1 30 ASN 6.34 0.61 1 31 GLU 3.03 2.28 1 32 ASP 4.41 2.25 1 33 PHE 4.25 -0.18 1 34 TYR 4.71 2.54 1 35 LYS 4.02 1.13 1 36 PHE 4.24 0.14 1 37 TRP 0.09 0.45 1 38 LYS 0.38 0.27 1 39 GLU -1.53 -0.67 1 40 ASP 1.23 -0.88 1 41 TYR -1.11 -0.71 1 42 GLU -0.68 -1.24 1 43 ILE -0.33 -0.46 1 44 THR -0.63 -1.49 1 45 ASN -1.51 0.03 1 46 ARG 4.27 1.32 1 47 LEU 5.03 1.93 1 48 THR 9.45 2.49 1 51 ALA 5.60 0.29 1 52 ILE 6.31 0.16 1 53 LYS 3.40 2.23 1 55 LEU 3.01 1.45 1 56 SER 3.40 -0.23 1 57 GLU 0.01 0.40 1 58 LYS -1.69 1.05 1 59 LEU 5.06 1.62 1 60 GLU 3.84 0.59 1 61 MET 0.34 0.65 1 63 ASP -3.25 -0.24 1 64 ALA 1.56 0.52 1 65 ASP 0.49 0.91 1 67 LYS -0.23 0.18 1 69 HIS -5.13 -0.27 1 70 HIS 4.84 2.69 1 72 ASN 0.37 -1.44 1 73 ALA -1.02 -0.74 1 74 ARG 5.82 1.00 1 75 GLU 4.03 2.79 1 76 PHE 3.67 1.59 1 77 ALA 5.32 2.26 1 78 MET 2.71 2.85 1 79 LYS 1.72 0.09 1 80 HIS 1.03 -0.23 1 82 ALA -1.60 -1.84 1 83 ASP -2.16 -1.06 1 84 ASP 2.79 1.71 1 85 ALA 3.82 3.21 1 86 MET 2.58 1.58 1 87 ALA 5.01 2.36 1 88 LYS 3.49 1.37 1 89 GLN 3.88 3.31 1 90 LEU 4.34 0.66 1 91 VAL 5.23 1.22 1 92 ASP 5.13 4.08 1 93 LEU 2.40 3.07 1 94 ILE 6.62 1.42 1 95 HIS 3.14 4.12 1 98 GLU 4.22 1.08 1 99 LYS 1.18 0.77 1 100 SER 0.40 0.15 1 104 ASN -3.61 -0.91 1 105 ASP 2.43 -0.32 1 106 ASP -1.49 0.04 1 107 ARG 2.96 2.38 1 109 MET 2.48 2.49 1 110 GLU 3.23 1.97 1 111 VAL 6.48 1.20 1 112 LEU 3.04 0.94 1 113 SER 6.59 3.10 1 114 ILE 5.97 0.76 1 115 ALA 3.99 1.24 1 116 MET 3.89 1.94 1 118 PHE 1.80 0.88 1 119 LYS 4.86 2.13 1 120 LYS 4.40 2.84 1 121 GLU 2.26 3.53 1 122 ILE 4.29 1.74 1 123 HIS 3.86 1.08 1 124 ASN 0.40 0.57 1 125 LEU -0.54 -0.45 1 126 LYS 2.64 -0.98 1 127 TRP -3.55 -2.51 1 130 ASN -0.28 1.37 1 131 MET 3.55 1.21 1 132 GLU 5.69 1.94 1 133 VAL 6.34 0.53 1 134 VAL 6.70 0.51 1 135 VAL 5.88 2.13 1 137 GLU 4.61 1.11 1 138 VAL 6.25 1.39 1 139 LEU 3.41 0.43 1 140 ALA 0.48 0.58 1 141 GLU -2.15 0.39 1 stop_ save_