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 bmr10165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.24 _LACS_plot.Line_1_terminator_val_y_1 -2.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 6.68 _LACS_plot.Line_2_terminator_val_y_2 4.39 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 ASN 4.74 0.12 0 72 TRP 6.68 1.41 0 117 TYR -8.24 -5.53 0 10 SER 0.00 0.13 1 11 GLU -1.16 -0.37 1 12 SER -0.72 0.05 1 13 PHE -3.79 -0.85 1 14 VAL -5.48 -2.06 1 15 LEU 2.28 -0.30 1 16 ASP -2.54 -1.37 1 17 PHE -1.76 -2.21 1 18 SER -1.42 -1.25 1 19 GLN 1.13 0.32 1 21 SER 1.99 0.59 1 22 ALA 2.07 1.47 1 23 ASP -1.54 -2.05 1 24 TYR 4.15 3.81 1 25 LEU 3.60 2.59 1 26 ASP 1.57 3.42 1 27 PHE 3.61 3.62 1 28 ARG 4.43 3.05 1 29 ASN 4.04 2.76 1 30 ARG 3.70 3.71 1 31 LEU 4.01 2.95 1 32 GLN 3.04 2.32 1 33 ALA 0.74 1.56 1 34 ASP 0.07 0.95 1 35 HIS 5.87 3.34 1 36 VAL -3.88 -3.65 1 38 LEU 3.07 2.86 1 39 GLU -1.15 0.84 1 40 ASN -5.37 -0.95 1 42 VAL -4.34 -1.74 1 43 LEU -1.94 -0.89 1 44 LYS -2.22 -1.17 1 45 ASP 3.64 2.32 1 46 LYS 2.13 -0.04 1 47 ALA -4.33 -0.69 1 48 ILE -5.09 -2.08 1 49 ALA -5.96 -2.41 1 51 THR -5.62 -2.68 1 52 VAL -4.92 -0.83 1 53 LYS -7.28 -2.53 1 54 VAL -6.25 -4.52 1 55 GLN -0.50 0.32 1 56 ASN 2.14 0.09 1 57 LEU -1.11 0.12 1 58 ALA -2.83 -0.81 1 59 PHE 1.61 2.40 1 60 GLU 0.86 0.53 1 61 LYS -5.05 -0.26 1 62 THR -1.27 0.54 1 63 VAL -3.80 -1.49 1 64 LYS -5.59 -1.35 1 65 ILE -2.05 -3.21 1 66 ARG -0.68 -0.07 1 67 MET -5.81 -1.18 1 68 THR -4.19 -2.90 1 69 PHE -2.08 -1.93 1 70 ASP -0.84 -1.91 1 71 THR 5.29 2.02 1 73 LYS 6.34 4.26 1 74 SER -3.33 -0.76 1 75 TYR -2.68 -0.74 1 76 THR -2.57 0.30 1 77 ASP -2.19 -1.78 1 78 PHE -1.30 -0.02 1 81 GLN -2.89 -1.08 1 82 TYR 1.31 0.86 1 83 VAL -0.17 -0.51 1 84 LYS 0.87 -0.06 1 85 ASP -1.43 -0.85 1 86 THR 2.01 1.47 1 87 TYR 0.65 0.15 1 88 ALA 0.57 0.60 1 90 SER 0.07 0.14 1 91 ASP 1.27 0.81 1 92 ARG -2.98 -1.06 1 93 ASP -5.70 -0.79 1 94 THR 0.28 0.49 1 95 PHE -5.75 -1.87 1 96 SER -5.30 -1.91 1 97 PHE -4.11 -1.70 1 98 ASP -0.59 0.59 1 99 ILE -3.96 -0.65 1 100 SER 0.87 0.55 1 101 LEU 0.60 -0.67 1 103 GLU 1.09 1.53 1 104 LYS -1.22 -0.89 1 105 ILE -1.35 -0.46 1 106 GLN 1.22 0.54 1 107 SER 2.84 2.23 1 108 TYR 0.14 -1.17 1 109 GLU -2.49 -1.03 1 110 ARG -1.83 -0.33 1 111 MET -4.08 -1.25 1 112 GLU -7.99 -2.69 1 113 PHE -5.90 -1.84 1 114 ALA -5.67 -1.64 1 115 VAL -2.63 -0.82 1 116 TYR -2.55 -2.42 1 118 GLU -4.62 -2.42 1 120 ASN 1.66 0.63 1 122 GLN -4.14 -2.08 1 123 THR -0.06 0.14 1 124 TYR -3.40 -1.51 1 125 TRP -3.99 -0.56 1 126 ASP -1.77 -0.23 1 127 SER -3.25 -3.18 1 129 ARG 4.56 0.80 1 131 LYS 0.52 1.14 1 132 ASN 1.06 1.62 1 133 TYR 3.28 0.43 1 134 ARG -1.81 0.02 1 135 ILE -1.10 -0.02 1 136 ILE -5.11 -1.74 1 137 ARG 0.54 0.34 1 138 ALA -0.13 0.31 1 139 GLU -0.25 -0.01 1 140 LEU 0.20 0.09 1 141 LYS 0.40 0.28 1 142 SER 0.08 0.12 1 143 THR 0.37 0.20 1 144 GLN 0.87 0.78 1 146 MET 0.00 0.19 1 147 THR 0.08 0.16 1 148 LYS -0.06 -0.01 1 150 HIS -0.31 1.26 1 151 SER -0.62 -0.28 1 154 ASP 0.35 0.23 1 155 LEU 0.16 -0.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.24 _LACS_plot.Line_1_terminator_val_y_1 5.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.87 _LACS_plot.Line_2_terminator_val_x_2 6.68 _LACS_plot.Line_2_terminator_val_y_2 -2.29 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 ASN 4.74 -4.62 0 72 TRP 6.68 -5.27 0 117 TYR -8.24 2.71 0 10 SER 0.00 0.13 1 11 GLU -1.16 0.79 1 12 SER -0.72 0.77 1 13 PHE -3.79 2.94 1 14 VAL -5.48 3.42 1 15 LEU 2.28 -2.58 1 16 ASP -2.54 1.17 1 17 PHE -1.76 -0.45 1 18 SER -1.42 0.17 1 19 GLN 1.13 -0.81 1 21 SER 1.99 -1.40 1 22 ALA 2.07 -0.60 1 23 ASP -1.54 -0.51 1 24 TYR 4.15 -0.34 1 25 LEU 3.60 -1.01 1 26 ASP 1.57 1.85 1 27 PHE 3.61 0.01 1 28 ARG 4.43 -1.38 1 29 ASN 4.04 -1.28 1 30 ARG 3.70 0.01 1 31 LEU 4.01 -1.06 1 32 GLN 3.04 -0.72 1 33 ALA 0.74 0.82 1 34 ASP 0.07 0.88 1 35 HIS 5.87 -2.53 1 36 VAL -3.88 0.23 1 38 LEU 3.07 -0.21 1 39 GLU -1.15 1.99 1 40 ASN -5.37 4.42 1 42 VAL -4.34 2.60 1 43 LEU -1.94 1.05 1 44 LYS -2.22 1.05 1 45 ASP 3.64 -1.32 1 46 LYS 2.13 -2.17 1 47 ALA -4.33 3.64 1 48 ILE -5.09 3.01 1 49 ALA -5.96 3.55 1 51 THR -5.62 2.94 1 52 VAL -4.92 4.09 1 53 LYS -7.28 4.75 1 54 VAL -6.25 1.73 1 55 GLN -0.50 0.82 1 56 ASN 2.14 -2.05 1 57 LEU -1.11 1.23 1 58 ALA -2.83 2.02 1 59 PHE 1.61 0.79 1 60 GLU 0.86 -0.33 1 61 LYS -5.05 4.79 1 62 THR -1.27 1.81 1 63 VAL -3.80 2.31 1 64 LYS -5.59 4.24 1 65 ILE -2.05 -1.16 1 66 ARG -0.68 0.61 1 67 MET -5.81 4.63 1 68 THR -4.19 1.29 1 69 PHE -2.08 0.15 1 70 ASP -0.84 -1.07 1 71 THR 5.29 -3.27 1 73 LYS 6.34 -2.08 1 74 SER -3.33 2.57 1 75 TYR -2.68 1.94 1 76 THR -2.57 2.87 1 77 ASP -2.19 0.41 1 78 PHE -1.30 1.28 1 81 GLN -2.89 1.81 1 82 TYR 1.31 -0.45 1 83 VAL -0.17 -0.34 1 84 LYS 0.87 -0.93 1 85 ASP -1.43 0.58 1 86 THR 2.01 -0.54 1 87 TYR 0.65 -0.50 1 88 ALA 0.57 0.03 1 90 SER 0.07 0.07 1 91 ASP 1.27 -0.46 1 92 ARG -2.98 1.92 1 93 ASP -5.70 4.91 1 94 THR 0.28 0.21 1 95 PHE -5.75 3.88 1 96 SER -5.30 3.39 1 97 PHE -4.11 2.41 1 98 ASP -0.59 1.18 1 99 ILE -3.96 3.31 1 100 SER 0.87 -0.32 1 101 LEU 0.60 -1.27 1 103 GLU 1.09 0.44 1 104 LYS -1.22 0.33 1 105 ILE -1.35 0.89 1 106 GLN 1.22 -0.68 1 107 SER 2.84 -0.61 1 108 TYR 0.14 -1.31 1 109 GLU -2.49 1.46 1 110 ARG -1.83 1.50 1 111 MET -4.08 2.83 1 112 GLU -7.99 5.30 1 113 PHE -5.90 4.06 1 114 ALA -5.67 4.03 1 115 VAL -2.63 1.81 1 116 TYR -2.55 0.13 1 118 GLU -4.62 2.20 1 120 ASN 1.66 -1.03 1 122 GLN -4.14 2.06 1 123 THR -0.06 0.20 1 124 TYR -3.40 1.89 1 125 TRP -3.99 3.43 1 126 ASP -1.77 1.54 1 127 SER -3.25 0.07 1 129 ARG 4.56 -3.76 1 131 LYS 0.52 0.62 1 132 ASN 1.06 0.56 1 133 TYR 3.28 -2.85 1 134 ARG -1.81 1.83 1 135 ILE -1.10 1.08 1 136 ILE -5.11 3.37 1 137 ARG 0.54 -0.20 1 138 ALA -0.13 0.44 1 139 GLU -0.25 0.24 1 140 LEU 0.20 -0.11 1 141 LYS 0.40 -0.12 1 142 SER 0.08 0.04 1 143 THR 0.37 -0.17 1 144 GLN 0.87 -0.09 1 146 MET 0.00 0.19 1 147 THR 0.08 0.08 1 148 LYS -0.06 0.05 1 150 HIS -0.31 1.57 1 151 SER -0.62 0.34 1 154 ASP 0.35 -0.12 1 155 LEU 0.16 -0.24 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.24 _LACS_plot.Line_1_terminator_val_y_1 1.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.68 _LACS_plot.Line_2_terminator_val_y_2 -0.83 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 132 ASN 1.06 -1.05 0 113 PHE -5.90 1.64 0 66 ARG -0.68 1.10 0 73 LYS 6.34 -0.15 0 21 SER 1.99 -1.20 0 82 TYR 1.31 -1.15 0 68 THR -4.19 -0.40 0 10 SER 0.00 -0.04 1 11 GLU -1.16 0.02 1 12 SER -0.72 -0.01 1 13 PHE -3.79 0.76 1 14 VAL -5.48 0.34 1 15 LEU 2.28 0.06 1 16 ASP -2.54 0.44 1 17 PHE -1.76 0.32 1 18 SER -1.42 0.20 1 19 GLN 1.13 -0.09 1 22 ALA 2.07 -0.12 1 23 ASP -1.54 0.25 1 24 TYR 4.15 -0.35 1 25 LEU 3.60 -0.37 1 26 ASP 1.57 -0.27 1 27 PHE 3.61 -0.53 1 28 ARG 4.43 -0.75 1 29 ASN 4.04 -0.38 1 30 ARG 3.70 -0.43 1 31 LEU 4.01 -0.93 1 32 GLN 3.04 -0.45 1 33 ALA 0.74 -0.22 1 34 ASP 0.07 0.06 1 35 HIS 5.87 -0.19 1 36 VAL -3.88 0.75 1 38 LEU 3.07 -0.17 1 39 GLU -1.15 0.17 1 40 ASN -5.37 0.61 1 42 VAL -4.34 0.33 1 43 LEU -1.94 0.71 1 44 LYS -2.22 0.23 1 45 ASP 3.64 -0.32 1 46 LYS 2.13 -0.24 1 47 ALA -4.33 0.79 1 48 ILE -5.09 1.06 1 49 ALA -5.96 0.45 1 51 THR -5.62 1.24 1 52 VAL -4.92 0.34 1 53 LYS -7.28 1.28 1 54 VAL -6.25 0.71 1 55 GLN -0.50 0.12 1 56 ASN 2.14 -0.16 1 57 LEU -1.11 -0.01 1 58 ALA -2.83 0.02 1 59 PHE 1.61 -0.19 1 60 GLU 0.86 -0.04 1 61 LYS -5.05 0.72 1 62 THR -1.27 0.08 1 63 VAL -3.80 0.63 1 64 LYS -5.59 0.68 1 65 ILE -2.05 0.28 1 67 MET -5.81 0.84 1 69 PHE -2.08 0.16 1 70 ASP -0.84 0.02 1 71 THR 5.29 -1.17 1 72 TRP 6.68 -0.71 1 74 SER -3.33 0.09 1 75 TYR -2.68 0.68 1 76 THR -2.57 -0.03 1 77 ASP -2.19 1.23 1 78 PHE -1.30 0.05 1 81 GLN -2.89 0.57 1 83 VAL -0.17 -0.36 1 84 LYS 0.87 -0.30 1 85 ASP -1.43 0.04 1 86 THR 2.01 -0.26 1 87 TYR 0.65 -0.02 1 88 ALA 0.57 0.07 1 90 SER 0.07 0.10 1 91 ASP 1.27 0.04 1 92 ARG -2.98 0.68 1 93 ASP -5.70 0.47 1 94 THR 0.28 0.88 1 95 PHE -5.75 0.70 1 96 SER -5.30 1.11 1 97 PHE -4.11 0.63 1 98 ASP -0.59 0.37 1 99 ILE -3.96 -0.15 1 100 SER 0.87 0.06 1 101 LEU 0.60 -0.30 1 103 GLU 1.09 -0.34 1 104 LYS -1.22 0.15 1 105 ILE -1.35 0.02 1 106 GLN 1.22 -0.10 1 107 SER 2.84 -0.32 1 108 TYR 0.14 0.11 1 109 GLU -2.49 0.23 1 110 ARG -1.83 0.45 1 111 MET -4.08 0.69 1 112 GLU -7.99 1.31 1 114 ALA -5.67 0.71 1 115 VAL -2.63 0.68 1 116 TYR -2.55 0.53 1 117 TYR -8.24 0.98 1 118 GLU -4.62 0.73 1 120 ASN 1.66 -0.40 1 122 GLN -4.14 0.05 1 123 THR -0.06 0.27 1 124 TYR -3.40 0.41 1 125 TRP -3.99 0.73 1 126 ASP -1.77 0.57 1 127 SER -3.25 0.34 1 128 ASN 4.74 -0.67 1 129 ARG 4.56 -0.57 1 131 LYS 0.52 -0.19 1 133 TYR 3.28 -0.67 1 134 ARG -1.81 0.70 1 135 ILE -1.10 0.63 1 136 ILE -5.11 0.86 1 137 ARG 0.54 0.06 1 138 ALA -0.13 -0.19 1 139 GLU -0.25 -0.08 1 140 LEU 0.20 0.00 1 141 LYS 0.40 -0.01 1 142 SER 0.08 0.06 1 143 THR 0.37 0.04 1 144 GLN 0.87 -0.03 1 146 MET 0.00 0.06 1 147 THR 0.08 -0.03 1 148 LYS -0.06 0.01 1 150 HIS -0.31 -0.10 1 151 SER -0.62 0.00 1 154 ASP 0.35 -0.06 1 155 LEU 0.16 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10165_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.24 _LACS_plot.Line_1_terminator_val_y_1 -2.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.12 _LACS_plot.Line_2_terminator_val_x_2 6.68 _LACS_plot.Line_2_terminator_val_y_2 1.42 _LACS_plot.Y_axis_chem_shift_offset 0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 35 HIS 5.87 -2.59 0 38 LEU 3.07 -4.41 0 10 SER 0.00 -0.33 1 11 GLU -1.16 -0.80 1 12 SER -0.72 -1.29 1 13 PHE -3.79 -1.30 1 14 VAL -5.48 -1.63 1 15 LEU 2.28 -0.60 1 16 ASP -2.54 -1.66 1 17 PHE -1.76 -2.05 1 18 SER -1.42 0.84 1 19 GLN 1.13 3.24 1 21 SER 1.99 -0.18 1 22 ALA 2.07 -0.18 1 23 ASP -1.54 -1.27 1 24 TYR 4.15 1.53 1 25 LEU 3.60 1.17 1 26 ASP 1.57 1.36 1 27 PHE 3.61 0.86 1 28 ARG 4.43 3.01 1 29 ASN 4.04 3.36 1 30 ARG 3.70 2.35 1 31 LEU 4.01 1.10 1 32 GLN 3.04 0.46 1 33 ALA 0.74 0.50 1 34 ASP 0.07 1.23 1 36 VAL -3.88 -4.35 1 39 GLU -1.15 -1.30 1 40 ASN -5.37 -1.28 1 42 VAL -4.34 -2.65 1 43 LEU -1.94 -1.45 1 44 LYS -2.22 -1.42 1 45 ASP 3.64 -0.96 1 46 LYS 2.13 -1.98 1 47 ALA -4.33 -2.29 1 48 ILE -5.09 -3.45 1 49 ALA -5.96 -1.99 1 51 THR -5.62 -0.61 1 52 VAL -4.92 -1.61 1 53 LYS -7.28 -1.90 1 54 VAL -6.25 -0.20 1 55 GLN -0.50 0.80 1 56 ASN 2.14 -0.45 1 57 LEU -1.11 -1.41 1 58 ALA -2.83 -1.95 1 59 PHE 1.61 0.87 1 60 GLU 0.86 -1.02 1 61 LYS -5.05 -1.09 1 62 THR -1.27 -2.54 1 63 VAL -3.80 -1.99 1 64 LYS -5.59 -3.25 1 65 ILE -2.05 -1.51 1 66 ARG -0.68 -2.14 1 67 MET -5.81 -2.87 1 68 THR -4.19 -3.92 1 69 PHE -2.08 -0.85 1 70 ASP -0.84 0.76 1 71 THR 5.29 -1.05 1 72 TRP 6.68 0.78 1 73 LYS 6.34 1.02 1 74 SER -3.33 -2.64 1 75 TYR -2.68 -1.64 1 76 THR -2.57 -3.36 1 77 ASP -2.19 -0.38 1 78 PHE -1.30 -0.79 1 81 GLN -2.89 -0.97 1 82 TYR 1.31 -0.49 1 83 VAL -0.17 -2.53 1 84 LYS 0.87 -0.99 1 85 ASP -1.43 0.54 1 86 THR 2.01 -0.11 1 87 TYR 0.65 -0.31 1 88 ALA 0.57 0.70 1 90 SER 0.07 -0.39 1 91 ASP 1.27 0.05 1 92 ARG -2.98 -2.23 1 93 ASP -5.70 -1.52 1 94 THR 0.28 -2.72 1 95 PHE -5.75 -1.02 1 96 SER -5.30 -1.52 1 97 PHE -4.11 -1.48 1 98 ASP -0.59 -1.34 1 99 ILE -3.96 -1.38 1 100 SER 0.87 -1.04 1 101 LEU 0.60 -1.34 1 103 GLU 1.09 0.27 1 104 LYS -1.22 -1.37 1 105 ILE -1.35 -0.31 1 106 GLN 1.22 1.59 1 107 SER 2.84 -0.38 1 108 TYR 0.14 -0.13 1 109 GLU -2.49 -0.59 1 110 ARG -1.83 -1.91 1 111 MET -4.08 -1.38 1 112 GLU -7.99 -2.12 1 113 PHE -5.90 -3.55 1 114 ALA -5.67 -2.90 1 115 VAL -2.63 -1.86 1 116 TYR -2.55 -3.69 1 117 TYR -8.24 -2.74 1 118 GLU -4.62 -1.04 1 120 ASN 1.66 -0.26 1 122 GLN -4.14 -1.97 1 123 THR -0.06 -2.10 1 124 TYR -3.40 -1.62 1 125 TRP -3.99 0.87 1 126 ASP -1.77 -0.26 1 127 SER -3.25 1.24 1 128 ASN 4.74 1.41 1 129 ARG 4.56 -0.17 1 131 LYS 0.52 1.21 1 132 ASN 1.06 -2.59 1 133 TYR 3.28 -0.87 1 134 ARG -1.81 -1.79 1 135 ILE -1.10 -1.12 1 136 ILE -5.11 -1.26 1 137 ARG 0.54 0.35 1 138 ALA -0.13 -0.16 1 139 GLU -0.25 -0.11 1 140 LEU 0.20 -0.14 1 141 LYS 0.40 0.13 1 142 SER 0.08 0.59 1 143 THR 0.37 0.24 1 144 GLN 0.87 0.54 1 146 MET 0.00 0.15 1 147 THR 0.08 -0.56 1 148 LYS -0.06 -0.41 1 151 SER -0.62 -0.35 1 154 ASP 0.35 -0.14 1 155 LEU 0.16 -0.61 1 stop_ save_