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 bmr18394_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.73 _LACS_plot.Line_1_terminator_val_y_1 -3.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.29 _LACS_plot.Line_2_terminator_val_x_2 6.61 _LACS_plot.Line_2_terminator_val_y_2 5.19 _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 70 GLU -9.73 -4.01 0 20 LEU -8.56 -2.16 0 10 ILE 0.79 0.35 1 11 LYS 0.03 0.09 1 12 GLU -0.24 0.25 1 13 ALA -0.68 -0.20 1 14 SER 0.01 0.27 1 15 ILE -1.54 -0.56 1 16 ILE 0.09 -0.89 1 17 ASP 0.10 0.44 1 18 ILE -1.79 0.25 1 19 GLN -1.68 -1.07 1 21 LYS -1.99 -0.11 1 22 ASP -3.51 -2.00 1 23 LEU 2.92 3.14 1 24 LYS -0.50 -0.80 1 26 ASN -0.96 -0.67 1 27 THR 4.05 2.79 1 28 ARG -2.09 -3.32 1 29 SER -3.57 -2.09 1 30 LEU 2.83 2.38 1 31 THR 3.17 2.47 1 32 ASP 2.08 1.99 1 33 LEU -1.59 -1.46 1 34 LYS 3.89 3.01 1 36 LYS -1.62 -0.92 1 37 VAL 0.43 0.70 1 38 VAL -5.94 -2.63 1 39 LEU -3.99 -1.35 1 40 ILE -1.30 -0.29 1 41 ASP -6.16 -1.71 1 42 PHE -1.55 -0.16 1 43 THR -3.61 -2.56 1 44 VAL -3.29 -0.96 1 45 TYR 0.03 -1.03 1 46 ASN 1.16 -1.11 1 47 ASN -2.23 0.29 1 48 ALA 2.70 2.55 1 49 MET 1.29 0.62 1 50 SER 4.01 3.46 1 51 ALA 4.44 3.55 1 52 ALA 2.69 2.54 1 53 HIS 4.48 4.24 1 54 ASN 4.22 2.30 1 55 LEU 4.13 3.52 1 56 ALA 4.16 2.54 1 57 LEU 4.33 2.86 1 58 ARG 4.59 3.97 1 59 GLU 3.62 3.13 1 60 LEU 2.09 2.48 1 61 TYR 4.73 5.87 1 62 ASN 3.39 2.32 1 63 LYS 2.98 3.13 1 64 TYR -0.89 1.00 1 65 ALA 6.53 4.39 1 66 SER 3.56 2.36 1 67 GLN -0.45 0.34 1 69 PHE -7.03 -2.87 1 71 ILE -2.68 -1.29 1 72 TYR -2.73 -0.95 1 73 GLN -3.21 -0.44 1 74 ILE -1.88 -0.86 1 75 SER -2.22 -1.60 1 76 LEU -0.18 -2.46 1 77 ASP 1.27 2.04 1 79 ASP -2.80 -1.38 1 80 GLU 2.78 3.54 1 81 HIS 4.06 4.96 1 82 PHE 3.72 3.64 1 83 TRP 6.62 4.91 1 84 LYS 4.47 3.69 1 85 THR 4.12 3.17 1 86 SER 3.08 3.06 1 87 ALA 0.22 0.09 1 88 ASP 1.98 2.62 1 89 ASN -0.93 -0.66 1 90 LEU 0.40 -1.54 1 92 TRP -0.55 -1.95 1 93 VAL 3.71 2.45 1 95 VAL -6.49 -3.66 1 96 ARG -2.67 -2.30 1 97 ASP -2.81 -1.73 1 98 ALA 1.85 1.43 1 99 ASN 1.32 0.85 1 101 ALA 2.28 1.22 1 102 TYR 0.50 -1.01 1 103 SER -0.37 0.22 1 104 SER 4.09 2.80 1 105 TYR 4.91 3.91 1 106 ILE 4.47 2.62 1 107 SER 3.53 2.34 1 108 LEU 2.36 2.76 1 109 TYR 2.44 1.36 1 110 ASN 2.60 0.97 1 111 VAL 1.83 1.07 1 112 THR -0.39 -0.31 1 113 ASN -2.99 -0.45 1 114 LEU -4.00 -1.51 1 116 SER -3.52 0.50 1 117 VAL -4.76 -2.49 1 118 PHE -4.53 -0.76 1 119 LEU -4.28 -1.37 1 120 VAL -3.35 -1.56 1 121 ASN -1.75 -1.40 1 122 ARG 3.52 3.33 1 123 ASN 0.04 -0.41 1 124 ASN -0.25 1.81 1 125 GLU -3.85 -2.64 1 126 LEU 2.24 1.67 1 127 SER 0.10 1.39 1 128 ALA -4.05 -0.23 1 129 ARG -2.70 -0.85 1 131 GLU 3.23 2.03 1 132 ASN -1.55 -0.51 1 133 ILE -0.61 -0.30 1 134 LYS 2.41 1.81 1 135 ASP -2.23 -0.86 1 136 LEU 2.99 3.07 1 137 ASP 3.14 4.14 1 138 GLU 2.31 2.29 1 139 ALA 2.63 2.48 1 140 ILE 5.75 4.93 1 141 LYS 5.43 4.42 1 142 LYS 3.46 2.82 1 143 LEU 1.60 1.94 1 144 LEU 1.69 1.86 1 145 GLU 0.15 0.58 1 151 HIS -0.83 1.28 1 152 HIS 0.70 2.47 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18394_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.73 _LACS_plot.Line_1_terminator_val_y_1 5.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.71 _LACS_plot.Line_2_terminator_val_x_2 6.61 _LACS_plot.Line_2_terminator_val_y_2 -1.42 _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 70 GLU -9.73 5.72 0 20 LEU -8.56 6.40 0 10 ILE 0.79 -0.44 1 11 LYS 0.03 0.06 1 12 GLU -0.24 0.49 1 13 ALA -0.68 0.48 1 14 SER 0.01 0.26 1 15 ILE -1.54 0.98 1 16 ILE 0.09 -0.98 1 17 ASP 0.10 0.34 1 18 ILE -1.79 2.04 1 19 GLN -1.68 0.61 1 21 LYS -1.99 1.88 1 22 ASP -3.51 1.51 1 23 LEU 2.92 0.22 1 24 LYS -0.50 -0.30 1 26 ASN -0.96 0.29 1 27 THR 4.05 -1.26 1 28 ARG -2.09 -1.23 1 29 SER -3.57 1.48 1 30 LEU 2.83 -0.45 1 31 THR 3.17 -0.70 1 32 ASP 2.08 -0.09 1 33 LEU -1.59 0.13 1 34 LYS 3.89 -0.88 1 36 LYS -1.62 0.70 1 37 VAL 0.43 0.27 1 38 VAL -5.94 3.31 1 39 LEU -3.99 2.64 1 40 ILE -1.30 1.01 1 41 ASP -6.16 4.45 1 42 PHE -1.55 1.39 1 43 THR -3.61 1.05 1 44 VAL -3.29 2.33 1 45 TYR 0.03 -1.06 1 46 ASN 1.16 -2.27 1 47 ASN -2.23 2.52 1 48 ALA 2.70 -0.15 1 49 MET 1.29 -0.67 1 50 SER 4.01 -0.55 1 51 ALA 4.44 -0.89 1 52 ALA 2.69 -0.15 1 53 HIS 4.48 -0.24 1 54 ASN 4.22 -1.92 1 55 LEU 4.13 -0.61 1 56 ALA 4.16 -1.62 1 57 LEU 4.33 -1.47 1 58 ARG 4.59 -0.62 1 59 GLU 3.62 -0.49 1 60 LEU 2.09 0.39 1 61 TYR 4.73 1.14 1 62 ASN 3.39 -1.07 1 63 LYS 2.98 0.15 1 64 TYR -0.89 1.89 1 65 ALA 6.53 -2.14 1 66 SER 3.56 -1.20 1 67 GLN -0.45 0.79 1 69 PHE -7.03 4.16 1 71 ILE -2.68 1.39 1 72 TYR -2.73 1.78 1 73 GLN -3.21 2.77 1 74 ILE -1.88 1.02 1 75 SER -2.22 0.62 1 76 LEU -0.18 -2.28 1 77 ASP 1.27 0.77 1 79 ASP -2.80 1.42 1 80 GLU 2.78 0.76 1 81 HIS 4.06 0.90 1 82 PHE 3.72 -0.08 1 83 TRP 6.62 -1.71 1 84 LYS 4.47 -0.78 1 85 THR 4.12 -0.95 1 86 SER 3.08 -0.02 1 87 ALA 0.22 -0.13 1 88 ASP 1.98 0.64 1 89 ASN -0.93 0.27 1 90 LEU 0.40 -1.94 1 92 TRP -0.55 -1.40 1 93 VAL 3.71 -1.26 1 95 VAL -6.49 2.83 1 96 ARG -2.67 0.37 1 97 ASP -2.81 1.08 1 98 ALA 1.85 -0.42 1 99 ASN 1.32 -0.47 1 101 ALA 2.28 -1.06 1 102 TYR 0.50 -1.51 1 103 SER -0.37 0.59 1 104 SER 4.09 -1.29 1 105 TYR 4.91 -1.00 1 106 ILE 4.47 -1.85 1 107 SER 3.53 -1.19 1 108 LEU 2.36 0.40 1 109 TYR 2.44 -1.08 1 110 ASN 2.60 -1.63 1 111 VAL 1.83 -0.76 1 112 THR -0.39 0.08 1 113 ASN -2.99 2.54 1 114 LEU -4.00 2.49 1 116 SER -3.52 4.02 1 117 VAL -4.76 2.27 1 118 PHE -4.53 3.77 1 119 LEU -4.28 2.91 1 120 VAL -3.35 1.79 1 121 ASN -1.75 0.35 1 122 ARG 3.52 -0.19 1 123 ASN 0.04 -0.45 1 124 ASN -0.25 2.06 1 125 GLU -3.85 1.21 1 126 LEU 2.24 -0.57 1 127 SER 0.10 1.29 1 128 ALA -4.05 3.82 1 129 ARG -2.70 1.85 1 131 GLU 3.23 -1.20 1 132 ASN -1.55 1.04 1 133 ILE -0.61 0.31 1 134 LYS 2.41 -0.60 1 135 ASP -2.23 1.37 1 136 LEU 2.99 0.08 1 137 ASP 3.14 1.00 1 138 GLU 2.31 -0.02 1 139 ALA 2.63 -0.15 1 140 ILE 5.75 -0.82 1 141 LYS 5.43 -1.01 1 142 LYS 3.46 -0.64 1 143 LEU 1.60 0.34 1 144 LEU 1.69 0.17 1 145 GLU 0.15 0.43 1 151 HIS -0.83 2.11 1 152 HIS 0.70 1.77 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18394_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.73 _LACS_plot.Line_1_terminator_val_y_1 1.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.61 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 SER -3.57 1.57 0 65 ALA 6.53 0.43 0 117 VAL -4.76 1.78 0 10 ILE 0.79 -0.07 1 11 LYS 0.03 0.01 1 12 GLU -0.24 -0.09 1 13 ALA -0.68 0.10 1 14 SER 0.01 0.04 1 15 ILE -1.54 0.05 1 16 ILE 0.09 -0.04 1 17 ASP 0.10 -0.16 1 18 ILE -1.79 -0.43 1 19 GLN -1.68 0.60 1 20 LEU -8.56 0.59 1 21 LYS -1.99 0.76 1 22 ASP -3.51 0.93 1 23 LEU 2.92 -0.30 1 24 LYS -0.50 0.11 1 26 ASN -0.96 0.20 1 27 THR 4.05 -0.30 1 28 ARG -2.09 0.53 1 30 LEU 2.83 -0.58 1 31 THR 3.17 0.04 1 32 ASP 2.08 -0.07 1 33 LEU -1.59 0.04 1 34 LYS 3.89 -0.20 1 36 LYS -1.62 0.33 1 37 VAL 0.43 0.08 1 38 VAL -5.94 0.99 1 39 LEU -3.99 1.02 1 40 ILE -1.30 0.66 1 41 ASP -6.16 1.12 1 42 PHE -1.55 0.48 1 43 THR -3.61 0.23 1 44 VAL -3.29 0.02 1 45 TYR 0.03 0.92 1 46 ASN 1.16 0.01 1 47 ASN -2.23 -0.12 1 48 ALA 2.70 0.00 1 49 MET 1.29 0.22 1 50 SER 4.01 -0.17 1 51 ALA 4.44 -0.05 1 52 ALA 2.69 -0.03 1 53 HIS 4.48 -0.12 1 54 ASN 4.22 0.02 1 55 LEU 4.13 -0.07 1 56 ALA 4.16 -0.06 1 57 LEU 4.33 -0.48 1 58 ARG 4.59 0.03 1 59 GLU 3.62 -0.14 1 60 LEU 2.09 -0.29 1 61 TYR 4.73 -0.31 1 62 ASN 3.39 -0.20 1 63 LYS 2.98 -0.39 1 64 TYR -0.89 0.30 1 66 SER 3.56 -0.14 1 67 GLN -0.45 0.20 1 69 PHE -7.03 1.27 1 70 GLU -9.73 0.72 1 71 ILE -2.68 0.49 1 72 TYR -2.73 0.24 1 73 GLN -3.21 0.74 1 74 ILE -1.88 -0.27 1 75 SER -2.22 0.30 1 76 LEU -0.18 0.47 1 77 ASP 1.27 -0.29 1 79 ASP -2.80 0.35 1 80 GLU 2.78 -0.38 1 81 HIS 4.06 -0.32 1 82 PHE 3.72 -0.55 1 83 TRP 6.62 -0.38 1 84 LYS 4.47 -1.32 1 85 THR 4.12 -0.54 1 86 SER 3.08 -0.56 1 87 ALA 0.22 -0.31 1 88 ASP 1.98 -0.59 1 89 ASN -0.93 -0.12 1 90 LEU 0.40 -0.65 1 92 TRP -0.55 0.53 1 93 VAL 3.71 -0.20 1 95 VAL -6.49 1.13 1 96 ARG -2.67 0.51 1 97 ASP -2.81 0.29 1 98 ALA 1.85 -0.40 1 99 ASN 1.32 -0.03 1 101 ALA 2.28 -0.38 1 102 TYR 0.50 0.00 1 103 SER -0.37 -0.36 1 104 SER 4.09 -0.20 1 105 TYR 4.91 -0.14 1 106 ILE 4.47 -0.68 1 107 SER 3.53 -0.02 1 108 LEU 2.36 -0.26 1 109 TYR 2.44 -0.48 1 110 ASN 2.60 -0.36 1 111 VAL 1.83 -0.16 1 112 THR -0.39 0.00 1 113 ASN -2.99 0.05 1 114 LEU -4.00 -0.07 1 116 SER -3.52 0.53 1 118 PHE -4.53 0.38 1 119 LEU -4.28 1.16 1 120 VAL -3.35 0.64 1 121 ASN -1.75 -0.03 1 122 ARG 3.52 -0.23 1 123 ASN 0.04 0.10 1 124 ASN -0.25 -0.80 1 125 GLU -3.85 0.18 1 126 LEU 2.24 -0.10 1 127 SER 0.10 0.24 1 128 ALA -4.05 0.45 1 129 ARG -2.70 0.39 1 131 GLU 3.23 -0.06 1 132 ASN -1.55 0.28 1 133 ILE -0.61 -0.06 1 134 LYS 2.41 -0.06 1 135 ASP -2.23 0.17 1 136 LEU 2.99 -0.41 1 137 ASP 3.14 -0.57 1 138 GLU 2.31 -0.48 1 139 ALA 2.63 -0.28 1 140 ILE 5.75 -0.93 1 141 LYS 5.43 -0.82 1 142 LYS 3.46 -0.24 1 143 LEU 1.60 -0.06 1 144 LEU 1.69 -0.30 1 145 GLU 0.15 -0.09 1 151 HIS -0.83 -0.10 1 152 HIS 0.70 -0.29 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18394_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.73 _LACS_plot.Line_1_terminator_val_y_1 -4.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 6.61 _LACS_plot.Line_2_terminator_val_y_2 2.67 _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 70 GLU -9.73 -4.30 0 22 ASP -3.51 3.10 0 152 HIS 0.70 5.17 0 10 ILE 0.79 -0.18 1 11 LYS 0.03 -0.21 1 12 GLU -0.24 -0.63 1 13 ALA -0.68 -0.56 1 14 SER 0.01 -0.75 1 15 ILE -1.54 -1.68 1 16 ILE 0.09 -1.24 1 17 ASP 0.10 -1.10 1 18 ILE -1.79 -2.53 1 19 GLN -1.68 -1.75 1 20 LEU -8.56 -2.77 1 21 LYS -1.99 0.44 1 23 LEU 2.92 0.64 1 24 LYS -0.50 0.08 1 26 ASN -0.96 0.14 1 27 THR 4.05 -0.84 1 28 ARG -2.09 -0.54 1 29 SER -3.57 1.18 1 30 LEU 2.83 3.12 1 31 THR 3.17 2.93 1 32 ASP 2.08 0.85 1 33 LEU -1.59 -1.84 1 34 LYS 3.89 -0.12 1 36 LYS -1.62 -1.09 1 37 VAL 0.43 -1.44 1 38 VAL -5.94 -1.77 1 39 LEU -3.99 -2.53 1 40 ILE -1.30 -2.06 1 41 ASP -6.16 -2.25 1 42 PHE -1.55 -1.06 1 43 THR -3.61 -3.71 1 44 VAL -3.29 -0.49 1 45 TYR 0.03 3.26 1 46 ASN 1.16 -0.74 1 47 ASN -2.23 0.75 1 48 ALA 2.70 0.93 1 49 MET 1.29 1.20 1 50 SER 4.01 2.45 1 51 ALA 4.44 3.35 1 52 ALA 2.69 3.09 1 53 HIS 4.48 2.55 1 54 ASN 4.22 3.41 1 55 LEU 4.13 1.52 1 56 ALA 4.16 3.89 1 57 LEU 4.33 1.21 1 58 ARG 4.59 1.86 1 59 GLU 3.62 3.16 1 60 LEU 2.09 0.69 1 61 TYR 4.73 2.38 1 62 ASN 3.39 2.56 1 63 LYS 2.98 2.24 1 64 TYR -0.89 1.57 1 65 ALA 6.53 3.93 1 66 SER 3.56 1.04 1 67 GLN -0.45 -1.14 1 69 PHE -7.03 -3.43 1 71 ILE -2.68 -4.05 1 72 TYR -2.73 -3.10 1 73 GLN -3.21 -3.12 1 74 ILE -1.88 -1.88 1 75 SER -2.22 1.09 1 76 LEU -0.18 -0.98 1 77 ASP 1.27 0.98 1 79 ASP -2.80 -0.50 1 80 GLU 2.78 0.74 1 81 HIS 4.06 3.94 1 82 PHE 3.72 3.00 1 83 TRP 6.62 -0.31 1 84 LYS 4.47 2.03 1 85 THR 4.12 1.75 1 86 SER 3.08 0.23 1 87 ALA 0.22 0.41 1 88 ASP 1.98 -0.31 1 89 ASN -0.93 -0.39 1 90 LEU 0.40 1.31 1 92 TRP -0.55 -2.13 1 93 VAL 3.71 -2.01 1 95 VAL -6.49 -2.42 1 96 ARG -2.67 -2.13 1 97 ASP -2.81 0.38 1 98 ALA 1.85 0.30 1 99 ASN 1.32 1.86 1 101 ALA 2.28 -0.78 1 102 TYR 0.50 -0.62 1 103 SER -0.37 3.33 1 104 SER 4.09 1.45 1 105 TYR 4.91 1.19 1 106 ILE 4.47 1.20 1 107 SER 3.53 3.56 1 108 LEU 2.36 0.54 1 109 TYR 2.44 -1.42 1 110 ASN 2.60 -1.24 1 111 VAL 1.83 0.23 1 112 THR -0.39 -0.90 1 113 ASN -2.99 -2.63 1 114 LEU -4.00 -0.75 1 116 SER -3.52 -2.13 1 117 VAL -4.76 -0.76 1 118 PHE -4.53 -1.67 1 119 LEU -4.28 -2.66 1 120 VAL -3.35 -1.18 1 121 ASN -1.75 0.80 1 122 ARG 3.52 1.05 1 123 ASN 0.04 -1.01 1 124 ASN -0.25 -2.84 1 125 GLU -3.85 -0.47 1 126 LEU 2.24 -1.40 1 127 SER 0.10 -0.07 1 128 ALA -4.05 -2.17 1 129 ARG -2.70 0.83 1 131 GLU 3.23 -0.09 1 132 ASN -1.55 -0.49 1 133 ILE -0.61 -0.87 1 134 LYS 2.41 0.02 1 136 LEU 2.99 -0.54 1 137 ASP 3.14 0.66 1 138 GLU 2.31 1.79 1 139 ALA 2.63 2.67 1 140 ILE 5.75 0.46 1 141 LYS 5.43 2.69 1 142 LYS 3.46 3.22 1 143 LEU 1.60 2.30 1 144 LEU 1.69 1.47 1 145 GLU 0.15 0.60 1 151 HIS -0.83 -0.08 1 stop_ save_