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 bmr15593_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 -2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 6.12 _LACS_plot.Y_axis_chem_shift_offset -0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 ILE 2.70 -1.43 0 10 ALA 0.34 0.84 1 11 SER -0.12 0.58 1 12 SER -0.15 0.55 1 13 LEU 0.79 0.80 1 14 ASN -0.08 0.33 1 15 GLU -0.95 0.01 1 16 ASP 0.08 0.57 1 18 GLU -0.16 0.61 1 20 SER -0.85 -0.10 1 21 ARG 2.22 1.38 1 22 ILE -1.25 0.34 1 23 THR -0.82 0.36 1 24 TYR -1.14 0.27 1 25 VAL -3.67 -1.02 1 26 LYS -1.06 -1.64 1 28 ASP -1.90 -0.65 1 29 LEU 1.25 2.16 1 30 PHE 5.10 2.65 1 31 ALA -0.62 -0.84 1 34 LYS 3.44 2.88 1 35 THR 0.49 -0.40 1 36 ASP 1.55 1.16 1 37 SER 1.81 3.49 1 38 LEU -7.16 -0.70 1 39 ALA -7.01 -1.21 1 40 HIS -1.41 1.24 1 42 ILE -5.38 -0.53 1 43 SER -5.01 -2.21 1 44 GLU 2.25 3.20 1 45 ASP 0.83 0.48 1 47 ARG 2.76 2.51 1 50 ALA -4.92 -1.02 1 52 ILE 2.18 2.65 1 53 ALA 4.16 3.47 1 54 VAL 4.47 3.98 1 55 LEU 3.55 2.83 1 56 PHE 5.29 5.53 1 57 LYS 6.02 4.97 1 58 LYS 3.30 3.61 1 59 LYS 3.20 2.90 1 60 PHE -1.89 -0.47 1 63 VAL 7.39 6.06 1 64 GLN 4.45 3.48 1 65 GLU 3.60 3.29 1 66 LEU 2.88 3.11 1 67 LEU 3.35 3.46 1 68 ASN 2.06 1.65 1 69 GLN 3.29 2.82 1 70 GLN 3.55 1.43 1 71 LYS -1.54 -1.70 1 72 LYS -5.05 -2.21 1 73 SER 1.78 2.92 1 75 GLU -4.95 -2.19 1 76 VAL -5.46 -2.30 1 77 ALA -4.27 -1.75 1 78 VAL -4.26 -0.64 1 79 LEU -5.75 -1.43 1 80 LYS -1.62 -0.75 1 81 ARG -6.12 -2.58 1 82 ASP 1.40 1.12 1 84 ARG -4.17 -2.65 1 85 TYR -1.53 0.60 1 86 ILE -0.31 -1.11 1 87 TYR 0.46 1.91 1 88 TYR 0.44 -1.97 1 89 LEU 1.96 0.79 1 91 THR 0.36 0.36 1 92 LYS -2.42 -0.94 1 93 LYS 3.45 4.27 1 94 ARG -5.52 -3.14 1 95 ALA 3.25 3.75 1 96 SER 0.65 0.40 1 97 HIS -4.41 -0.06 1 98 LYS -0.60 -0.07 1 100 THR -4.93 -3.09 1 101 TYR 6.81 5.80 1 102 GLU 4.45 4.12 1 103 ASN 3.43 2.60 1 104 LEU 4.63 3.77 1 105 GLN 7.52 5.83 1 106 LYS 4.17 4.50 1 107 SER 6.32 5.58 1 108 LEU 2.87 3.69 1 109 GLU 3.68 3.29 1 110 ALA 4.17 3.11 1 111 MET 4.26 4.77 1 112 LYS 6.52 4.60 1 113 SER 4.78 3.72 1 114 HIS 5.28 7.26 1 116 LEU 2.71 2.66 1 117 LYS 2.07 2.55 1 118 ASN -0.33 1.11 1 120 VAL 1.98 1.94 1 121 THR -0.61 0.46 1 122 ASP -2.47 0.80 1 123 LEU -7.75 -1.91 1 124 SER -2.49 1.27 1 125 MET -1.80 0.87 1 127 ARG -2.12 0.00 1 128 ILE 0.68 2.13 1 132 LEU -0.40 1.01 1 133 ASP 1.13 1.90 1 134 ARG 4.33 2.02 1 135 LEU 2.13 0.02 1 136 GLN -1.73 -0.54 1 137 TRP 2.23 2.98 1 138 GLU 5.34 4.52 1 139 ASN 2.49 2.66 1 140 VAL 6.23 5.44 1 141 SER 5.74 3.55 1 142 ALA 3.94 2.80 1 143 MET 2.51 3.89 1 144 ILE 6.24 5.92 1 145 GLU 4.34 3.83 1 146 GLU 2.88 3.23 1 147 VAL 4.77 4.24 1 148 PHE 3.58 2.29 1 149 GLU 2.79 2.65 1 150 ALA 2.41 0.97 1 151 THR -3.98 -0.83 1 152 ASP -0.28 -0.20 1 153 ILE 1.65 1.58 1 154 LYS -1.33 -0.33 1 155 ILE -2.74 -0.67 1 156 THR 0.20 0.11 1 157 VAL -1.68 -1.74 1 158 TYR -2.34 -0.57 1 159 THR -1.53 0.03 1 160 LEU 1.55 2.64 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15593_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 5.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.09 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 -1.39 _LACS_plot.Y_axis_chem_shift_offset -0.47 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 ILE 2.70 -4.13 0 10 ALA 0.34 0.50 1 11 SER -0.12 0.70 1 12 SER -0.15 0.70 1 13 LEU 0.79 0.01 1 14 ASN -0.08 0.41 1 15 GLU -0.95 0.96 1 16 ASP 0.08 0.49 1 18 GLU -0.16 0.77 1 20 SER -0.85 0.75 1 21 ARG 2.22 -0.84 1 22 ILE -1.25 1.59 1 23 THR -0.82 1.18 1 24 TYR -1.14 1.41 1 25 VAL -3.67 2.65 1 26 LYS -1.06 -0.58 1 28 ASP -1.90 1.25 1 29 LEU 1.25 0.91 1 30 PHE 5.10 -2.45 1 31 ALA -0.62 -0.22 1 34 LYS 3.44 -0.56 1 35 THR 0.49 -0.89 1 36 ASP 1.55 -0.39 1 37 SER 1.81 1.68 1 38 LEU -7.16 6.46 1 39 ALA -7.01 5.80 1 40 HIS -1.41 2.65 1 42 ILE -5.38 4.85 1 43 SER -5.01 2.80 1 44 GLU 2.25 0.95 1 45 ASP 0.83 -0.35 1 47 ARG 2.76 -0.25 1 50 ALA -4.92 3.90 1 52 ILE 2.18 0.47 1 53 ALA 4.16 -0.69 1 54 VAL 4.47 -0.49 1 55 LEU 3.55 -0.72 1 56 PHE 5.29 0.24 1 57 LYS 6.02 -1.05 1 58 LYS 3.30 0.31 1 59 LYS 3.20 -0.30 1 60 PHE -1.89 1.42 1 63 VAL 7.39 -1.33 1 64 GLN 4.45 -0.97 1 65 GLU 3.60 -0.31 1 66 LEU 2.88 0.23 1 67 LEU 3.35 0.11 1 68 ASN 2.06 -0.41 1 69 GLN 3.29 -0.47 1 70 GLN 3.55 -2.12 1 71 LYS -1.54 -0.16 1 72 LYS -5.05 2.84 1 73 SER 1.78 1.14 1 75 GLU -4.95 2.76 1 76 VAL -5.46 3.16 1 77 ALA -4.27 2.52 1 78 VAL -4.26 3.62 1 79 LEU -5.75 4.32 1 80 LYS -1.62 0.87 1 81 ARG -6.12 3.54 1 82 ASP 1.40 -0.28 1 84 ARG -4.17 1.52 1 85 TYR -1.53 2.13 1 86 ILE -0.31 -0.80 1 87 TYR 0.46 1.45 1 88 TYR 0.44 -2.41 1 89 LEU 1.96 -1.17 1 91 THR 0.36 0.00 1 92 LYS -2.42 1.48 1 93 LYS 3.45 0.82 1 94 ARG -5.52 2.38 1 95 ALA 3.25 0.50 1 96 SER 0.65 -0.25 1 97 HIS -4.41 4.35 1 98 LYS -0.60 0.53 1 100 THR -4.93 1.84 1 101 TYR 6.81 -1.01 1 102 GLU 4.45 -0.33 1 103 ASN 3.43 -0.83 1 104 LEU 4.63 -0.86 1 105 GLN 7.52 -1.69 1 106 LYS 4.17 0.33 1 107 SER 6.32 -0.74 1 108 LEU 2.87 0.82 1 109 GLU 3.68 -0.39 1 110 ALA 4.17 -1.06 1 111 MET 4.26 0.51 1 112 LYS 6.52 -1.92 1 113 SER 4.78 -1.06 1 114 HIS 5.28 1.98 1 116 LEU 2.71 -0.05 1 117 LYS 2.07 0.48 1 118 ASN -0.33 1.44 1 120 VAL 1.98 -0.04 1 121 THR -0.61 1.07 1 122 ASP -2.47 3.27 1 123 LEU -7.75 5.84 1 124 SER -2.49 3.76 1 125 MET -1.80 2.67 1 127 ARG -2.12 2.12 1 128 ILE 0.68 1.45 1 132 LEU -0.40 1.41 1 133 ASP 1.13 0.77 1 134 ARG 4.33 -2.31 1 135 LEU 2.13 -2.11 1 136 GLN -1.73 1.19 1 137 TRP 2.23 0.75 1 138 GLU 5.34 -0.82 1 139 ASN 2.49 0.17 1 140 VAL 6.23 -0.79 1 141 SER 5.74 -2.19 1 142 ALA 3.94 -1.14 1 143 MET 2.51 1.38 1 144 ILE 6.24 -0.32 1 145 GLU 4.34 -0.51 1 146 GLU 2.88 0.35 1 147 VAL 4.77 -0.53 1 148 PHE 3.58 -1.29 1 149 GLU 2.79 -0.14 1 150 ALA 2.41 -1.44 1 151 THR -3.98 3.15 1 152 ASP -0.28 0.08 1 153 ILE 1.65 -0.07 1 154 LYS -1.33 1.00 1 155 ILE -2.74 2.07 1 156 THR 0.20 -0.09 1 157 VAL -1.68 -0.06 1 158 TYR -2.34 1.77 1 159 THR -1.53 1.56 1 160 LEU 1.55 1.09 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15593_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 0.87 _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 7.51 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _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 29 LEU 1.25 -1.87 0 10 ALA 0.34 0.02 1 11 SER -0.12 0.01 1 12 SER -0.15 0.05 1 13 LEU 0.79 0.02 1 14 ASN -0.08 -0.01 1 15 GLU -0.95 -0.01 1 16 ASP 0.08 -0.02 1 18 GLU -0.16 -0.03 1 20 SER -0.85 0.14 1 21 ARG 2.22 -0.01 1 22 ILE -1.25 0.45 1 23 THR -0.82 0.05 1 24 TYR -1.14 0.60 1 25 VAL -3.67 -0.06 1 26 LYS -1.06 0.84 1 28 ASP -1.90 -0.22 1 30 PHE 5.10 -0.67 1 31 ALA -0.62 0.23 1 34 LYS 3.44 -0.18 1 35 THR 0.49 -0.16 1 36 ASP 1.55 -0.07 1 37 SER 1.81 0.68 1 38 LEU -7.16 1.67 1 39 ALA -7.01 1.55 1 40 HIS -1.41 -0.14 1 42 ILE -5.38 0.66 1 43 SER -5.01 0.70 1 44 GLU 2.25 -0.56 1 45 ASP 0.83 -0.27 1 47 ARG 2.76 -0.31 1 50 ALA -4.92 0.40 1 52 ILE 2.18 0.18 1 53 ALA 4.16 0.10 1 54 VAL 4.47 -0.25 1 55 LEU 3.55 -0.34 1 56 PHE 5.29 -0.59 1 57 LYS 6.02 -0.11 1 58 LYS 3.30 -0.34 1 59 LYS 3.20 -0.59 1 60 PHE -1.89 0.44 1 63 VAL 7.39 -0.75 1 64 GLN 4.45 -0.36 1 65 GLU 3.60 -0.32 1 66 LEU 2.88 -0.43 1 67 LEU 3.35 -0.33 1 68 ASN 2.06 -0.14 1 69 GLN 3.29 -0.12 1 70 GLN 3.55 -0.30 1 71 LYS -1.54 0.16 1 72 LYS -5.05 0.22 1 73 SER 1.78 -0.50 1 75 GLU -4.95 0.22 1 76 VAL -5.46 1.07 1 77 ALA -4.27 0.60 1 78 VAL -4.26 1.15 1 79 LEU -5.75 0.51 1 80 LYS -1.62 0.51 1 81 ARG -6.12 0.42 1 82 ASP 1.40 -0.33 1 84 ARG -4.17 0.24 1 85 TYR -1.53 0.50 1 86 ILE -0.31 0.25 1 87 TYR 0.46 0.09 1 88 TYR 0.44 -0.35 1 89 LEU 1.96 -0.18 1 90 ILE 2.70 0.24 1 91 THR 0.36 0.02 1 92 LYS -2.42 0.37 1 93 LYS 3.45 -0.42 1 94 ARG -5.52 0.40 1 95 ALA 3.25 -0.38 1 96 SER 0.65 -0.10 1 97 HIS -4.41 0.06 1 98 LYS -0.60 0.22 1 100 THR -4.93 0.42 1 101 TYR 6.81 -0.46 1 102 GLU 4.45 -0.22 1 103 ASN 3.43 -0.03 1 104 LEU 4.63 -0.22 1 105 GLN 7.52 -0.61 1 106 LYS 4.17 -0.28 1 107 SER 6.32 -0.73 1 108 LEU 2.87 -0.44 1 109 GLU 3.68 -0.68 1 110 ALA 4.17 -0.05 1 111 MET 4.26 -0.72 1 112 LYS 6.52 -0.69 1 113 SER 4.78 -0.36 1 114 HIS 5.28 -0.71 1 116 LEU 2.71 -0.07 1 117 LYS 2.07 -0.16 1 118 ASN -0.33 0.14 1 120 VAL 1.98 0.00 1 121 THR -0.61 0.21 1 122 ASP -2.47 0.91 1 123 LEU -7.75 0.91 1 124 SER -2.49 1.61 1 125 MET -1.80 0.72 1 127 ARG -2.12 -0.42 1 128 ILE 0.68 -0.08 1 132 LEU -0.40 -0.42 1 133 ASP 1.13 -0.44 1 134 ARG 4.33 -0.30 1 135 LEU 2.13 0.23 1 136 GLN -1.73 0.50 1 137 TRP 2.23 -0.07 1 138 GLU 5.34 -0.53 1 139 ASN 2.49 -0.26 1 140 VAL 6.23 -0.59 1 141 SER 5.74 -1.30 1 142 ALA 3.94 -0.22 1 143 MET 2.51 -0.34 1 144 ILE 6.24 -0.68 1 145 GLU 4.34 -0.44 1 146 GLU 2.88 -0.24 1 147 VAL 4.77 -0.52 1 148 PHE 3.58 -0.39 1 149 GLU 2.79 -0.15 1 150 ALA 2.41 0.01 1 151 THR -3.98 0.55 1 152 ASP -0.28 0.36 1 153 ILE 1.65 0.03 1 154 LYS -1.33 0.18 1 155 ILE -2.74 0.80 1 156 THR 0.20 0.65 1 157 VAL -1.68 0.95 1 158 TYR -2.34 0.75 1 159 THR -1.53 0.12 1 160 LEU 1.55 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15593_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.75 _LACS_plot.Line_1_terminator_val_y_1 -2.50 _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 -0.70 _LACS_plot.Line_2_terminator_val_x_2 7.51 _LACS_plot.Line_2_terminator_val_y_2 2.46 _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 65 GLU 3.60 -116.58 0 10 ALA 0.34 0.17 1 11 SER -0.12 0.33 1 12 SER -0.15 -0.01 1 13 LEU 0.79 -0.44 1 14 ASN -0.08 -0.21 1 15 GLU -0.95 -0.69 1 16 ASP 0.08 0.95 1 18 GLU -0.16 0.72 1 20 SER -0.85 0.35 1 21 ARG 2.22 -0.71 1 22 ILE -1.25 -0.26 1 23 THR -0.82 -2.76 1 24 TYR -1.14 0.16 1 25 VAL -3.67 -2.12 1 26 LYS -1.06 -0.43 1 28 ASP -1.90 -0.04 1 29 LEU 1.25 -1.77 1 30 PHE 5.10 0.17 1 31 ALA -0.62 -0.87 1 34 LYS 3.44 -0.74 1 35 THR 0.49 1.62 1 36 ASP 1.55 1.51 1 37 SER 1.81 -2.01 1 38 LEU -7.16 -1.36 1 39 ALA -7.01 -3.21 1 40 HIS -1.41 -1.47 1 42 ILE -5.38 -2.95 1 43 SER -5.01 1.57 1 44 GLU 2.25 1.01 1 45 ASP 0.83 -0.28 1 47 ARG 2.76 1.04 1 50 ALA -4.92 -0.84 1 52 ILE 2.18 1.00 1 53 ALA 4.16 1.50 1 54 VAL 4.47 2.08 1 55 LEU 3.55 2.49 1 56 PHE 5.29 4.80 1 57 LYS 6.02 2.72 1 58 LYS 3.30 1.69 1 59 LYS 3.20 1.72 1 60 PHE -1.89 0.59 1 63 VAL 7.39 1.41 1 64 GLN 4.45 2.12 1 66 LEU 2.88 3.42 1 67 LEU 3.35 3.72 1 68 ASN 2.06 1.74 1 69 GLN 3.29 -0.03 1 70 GLN 3.55 -0.80 1 71 LYS -1.54 0.43 1 72 LYS -5.05 -1.38 1 73 SER 1.78 1.20 1 75 GLU -4.95 -1.89 1 76 VAL -5.46 -4.05 1 77 ALA -4.27 -1.66 1 78 VAL -4.26 0.08 1 79 LEU -5.75 -2.68 1 80 LYS -1.62 0.95 1 81 ARG -6.12 -0.74 1 82 ASP 1.40 -0.18 1 84 ARG -4.17 -3.05 1 85 TYR -1.53 -2.14 1 86 ILE -0.31 -2.05 1 87 TYR 0.46 -1.50 1 88 TYR 0.44 -1.51 1 89 LEU 1.96 -2.10 1 90 ILE 2.70 0.34 1 91 THR 0.36 -1.45 1 92 LYS -2.42 -1.13 1 93 LYS 3.45 -0.46 1 94 ARG -5.52 1.21 1 95 ALA 3.25 0.60 1 96 SER 0.65 0.97 1 97 HIS -4.41 0.54 1 98 LYS -0.60 0.40 1 100 THR -4.93 1.13 1 101 TYR 6.81 2.30 1 102 GLU 4.45 2.43 1 103 ASN 3.43 3.15 1 104 LEU 4.63 0.31 1 105 GLN 7.52 2.13 1 106 LYS 4.17 3.36 1 107 SER 6.32 1.95 1 108 LEU 2.87 1.53 1 109 GLU 3.68 2.69 1 110 ALA 4.17 3.44 1 111 MET 4.26 0.55 1 112 LYS 6.52 0.97 1 113 SER 4.78 2.08 1 114 HIS 5.28 5.17 1 116 LEU 2.71 3.12 1 117 LYS 2.07 1.05 1 118 ASN -0.33 -0.56 1 120 VAL 1.98 -0.04 1 121 THR -0.61 -0.83 1 122 ASP -2.47 -3.30 1 123 LEU -7.75 -0.69 1 124 SER -2.49 -2.31 1 125 MET -1.80 -1.56 1 132 LEU -0.40 -1.89 1 133 ASP 1.13 0.64 1 134 ARG 4.33 -0.17 1 135 LEU 2.13 -1.91 1 136 GLN -1.73 1.92 1 137 TRP 2.23 1.12 1 138 GLU 5.34 1.45 1 139 ASN 2.49 2.26 1 140 VAL 6.23 1.05 1 141 SER 5.74 1.55 1 142 ALA 3.94 2.30 1 143 MET 2.51 1.89 1 144 ILE 6.24 1.67 1 145 GLU 4.34 2.45 1 146 GLU 2.88 3.03 1 147 VAL 4.77 1.46 1 148 PHE 3.58 1.68 1 149 GLU 2.79 -0.40 1 150 ALA 2.41 -0.76 1 151 THR -3.98 -0.20 1 152 ASP -0.28 -0.85 1 153 ILE 1.65 -0.87 1 154 LYS -1.33 -1.61 1 155 ILE -2.74 -1.00 1 156 THR 0.20 -1.41 1 157 VAL -1.68 -0.56 1 158 TYR -2.34 1.54 1 159 THR -1.53 -1.72 1 160 LEU 1.55 -7.97 1 stop_ save_