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 bmr19931_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 -2.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.51 _LACS_plot.Line_2_terminator_val_y_2 4.52 _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 50 TRP 5.42 6.65 0 14 LEU 1.48 -0.25 1 32 GLU 4.59 2.51 1 33 TRP -0.24 -0.30 1 34 THR -0.74 0.91 1 35 PHE -1.41 -0.23 1 36 PHE -0.14 1.09 1 37 GLN 2.64 0.67 1 39 ASN -5.83 -0.91 1 41 TYR -3.90 -0.90 1 42 PHE -2.76 -2.41 1 43 MET -1.55 -1.82 1 44 SER 2.39 0.64 1 45 ASN -1.62 -0.81 1 46 SER -2.87 -1.71 1 47 GLN -3.27 -0.79 1 48 ARG -6.81 -0.79 1 49 ASN 1.20 -0.40 1 51 HIS 4.33 5.29 1 52 ASP 3.67 1.86 1 53 SER 6.51 4.71 1 54 ILE 5.83 4.03 1 55 THR 5.96 4.39 1 56 ALA 3.83 2.47 1 58 LYS 4.66 3.99 1 59 GLU 2.39 2.45 1 60 VAL -0.76 -2.52 1 62 ALA -8.31 -2.68 1 63 GLN -5.98 -1.91 1 64 LEU 1.80 2.41 1 65 VAL 2.28 2.84 1 66 VAL -2.47 -2.09 1 69 SER -1.12 -0.72 1 70 ALA 3.04 2.53 1 71 GLU 4.32 3.76 1 72 GLU 3.19 2.94 1 73 GLN 6.07 2.63 1 74 ASN 3.97 3.31 1 75 PHE 3.02 2.54 1 76 LEU 1.50 1.75 1 77 GLN 3.22 3.01 1 78 LEU 3.04 2.19 1 79 GLN 4.43 2.09 1 80 SER 4.00 3.22 1 81 SER 3.53 2.71 1 82 ARG 3.41 2.44 1 83 SER -0.28 -0.19 1 84 ASN 2.51 0.95 1 85 ARG -1.92 -0.58 1 86 PHE 1.99 -0.46 1 87 THR -3.80 -0.54 1 88 TRP -4.10 0.38 1 89 MET -7.48 -2.35 1 91 LEU -4.36 -0.26 1 92 SER -3.85 0.31 1 93 ASP 0.91 -2.62 1 94 LEU 0.08 2.10 1 95 ASN 3.48 2.86 1 96 GLN -1.32 -0.31 1 99 THR 0.69 -0.21 1 100 TRP 0.47 0.17 1 101 GLN -5.74 -1.23 1 102 TRP -3.00 -0.73 1 103 VAL 3.09 2.16 1 104 ASP -0.05 -0.82 1 106 SER 1.08 0.73 1 108 LEU -0.27 -0.10 1 109 LEU -0.35 -1.21 1 111 SER 3.22 1.85 1 112 PHE 0.56 0.05 1 113 LYS 4.18 3.00 1 114 GLN 1.56 0.57 1 115 TYR 4.24 0.21 1 116 TRP -0.36 0.36 1 117 ASN -0.23 -0.01 1 118 ARG 2.70 1.35 1 123 ASN 0.01 0.15 1 124 VAL 0.72 0.38 1 126 GLU -0.35 0.10 1 128 ASP -2.80 -2.67 1 130 ALA -3.57 -0.98 1 131 GLU -7.46 -4.02 1 132 PHE 0.39 0.69 1 133 SER -2.16 -2.09 1 135 ASN -0.60 0.12 1 137 TRP -8.03 -4.82 1 138 ASN -4.59 -1.26 1 139 ASP -2.91 -2.11 1 140 ASP -7.59 -2.83 1 141 LYS 2.74 1.98 1 143 ASN 1.93 0.94 1 144 LEU -0.68 -0.12 1 145 ALA -0.42 -1.30 1 146 LYS -4.62 -1.20 1 147 PHE 2.70 2.06 1 148 TRP -1.41 1.28 1 149 ILE -6.77 -2.06 1 151 LYS -6.83 -1.37 1 152 LYS -4.71 -1.18 1 153 SER 1.35 1.32 1 154 ALA -1.77 -0.46 1 155 ALA -0.72 -0.33 1 156 SER -6.31 0.37 1 159 ARG 1.48 0.88 1 160 ASP 0.62 0.69 1 161 GLU 0.04 0.37 1 162 GLU 0.25 0.51 1 163 GLN 0.27 0.32 1 165 LEU -0.52 -0.26 1 166 SER -0.29 -0.16 1 170 ALA -0.35 -0.17 1 171 THR -2.41 -2.42 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19931_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 5.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.51 _LACS_plot.Line_2_terminator_val_y_2 -1.99 _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 50 TRP 5.42 1.23 0 14 LEU 1.48 -1.73 1 32 GLU 4.59 -2.08 1 33 TRP -0.24 -0.06 1 34 THR -0.74 1.65 1 35 PHE -1.41 1.18 1 36 PHE -0.14 1.23 1 37 GLN 2.64 -1.97 1 39 ASN -5.83 4.92 1 41 TYR -3.90 3.00 1 42 PHE -2.76 0.35 1 43 MET -1.55 -0.27 1 44 SER 2.39 -1.75 1 45 ASN -1.62 0.81 1 46 SER -2.87 1.16 1 47 GLN -3.27 2.48 1 48 ARG -6.81 6.02 1 49 ASN 1.20 -1.60 1 51 HIS 4.33 0.96 1 52 ASP 3.67 -1.81 1 53 SER 6.51 -1.80 1 54 ILE 5.83 -1.80 1 55 THR 5.96 -1.57 1 56 ALA 3.83 -1.36 1 58 LYS 4.66 -0.67 1 59 GLU 2.39 0.06 1 60 VAL -0.76 -1.76 1 62 ALA -8.31 5.63 1 63 GLN -5.98 4.07 1 64 LEU 1.80 0.61 1 65 VAL 2.28 0.56 1 66 VAL -2.47 0.38 1 69 SER -1.12 0.40 1 70 ALA 3.04 -0.51 1 71 GLU 4.32 -0.56 1 72 GLU 3.19 -0.25 1 73 GLN 6.07 -3.44 1 74 ASN 3.97 -0.66 1 75 PHE 3.02 -0.48 1 76 LEU 1.50 0.25 1 77 GLN 3.22 -0.21 1 78 LEU 3.04 -0.85 1 79 GLN 4.43 -2.34 1 80 SER 4.00 -0.78 1 81 SER 3.53 -0.82 1 82 ARG 3.41 -0.97 1 83 SER -0.28 0.09 1 84 ASN 2.51 -1.56 1 85 ARG -1.92 1.34 1 86 PHE 1.99 -2.45 1 87 THR -3.80 3.26 1 88 TRP -4.10 4.48 1 89 MET -7.48 5.13 1 91 LEU -4.36 4.10 1 92 SER -3.85 4.16 1 93 ASP 0.91 -3.53 1 94 LEU 0.08 2.02 1 95 ASN 3.48 -0.62 1 96 GLN -1.32 1.01 1 99 THR 0.69 -0.90 1 100 TRP 0.47 -0.30 1 101 GLN -5.74 4.51 1 102 TRP -3.00 2.27 1 103 VAL 3.09 -0.93 1 104 ASP -0.05 -0.77 1 106 SER 1.08 -0.35 1 108 LEU -0.27 0.17 1 109 LEU -0.35 -0.86 1 111 SER 3.22 -1.37 1 112 PHE 0.56 -0.51 1 113 LYS 4.18 -1.18 1 114 GLN 1.56 -0.99 1 115 TYR 4.24 -4.03 1 116 TRP -0.36 0.72 1 117 ASN -0.23 0.22 1 118 ARG 2.70 -1.35 1 123 ASN 0.01 0.14 1 124 VAL 0.72 -0.34 1 126 GLU -0.35 0.45 1 128 ASP -2.80 0.13 1 130 ALA -3.57 2.59 1 131 GLU -7.46 3.44 1 132 PHE 0.39 0.30 1 133 SER -2.16 0.07 1 135 ASN -0.60 0.72 1 137 TRP -8.03 3.21 1 138 ASN -4.59 3.33 1 139 ASP -2.91 0.80 1 140 ASP -7.59 4.76 1 141 LYS 2.74 -0.76 1 143 ASN 1.93 -0.99 1 144 LEU -0.68 0.56 1 145 ALA -0.42 -0.88 1 146 LYS -4.62 3.42 1 147 PHE 2.70 -0.64 1 148 TRP -1.41 2.69 1 149 ILE -6.77 4.71 1 151 LYS -6.83 5.46 1 152 LYS -4.71 3.53 1 153 SER 1.35 -0.03 1 154 ALA -1.77 1.31 1 155 ALA -0.72 0.39 1 156 SER -6.31 6.68 1 159 ARG 1.48 -0.60 1 160 ASP 0.62 0.07 1 161 GLU 0.04 0.33 1 162 GLU 0.25 0.26 1 163 GLN 0.27 0.05 1 165 LEU -0.52 0.26 1 166 SER -0.29 0.13 1 170 ALA -0.35 0.18 1 171 THR -2.41 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19931_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.31 _LACS_plot.Line_1_terminator_val_y_1 -2.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.26 _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 6.51 _LACS_plot.Line_2_terminator_val_y_2 1.80 _LACS_plot.Y_axis_chem_shift_offset 0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 TRP -3.00 5.10 0 14 LEU 1.48 -1.07 1 32 GLU 4.59 -0.42 1 33 TRP -0.24 -0.11 1 34 THR -0.74 -0.83 1 35 PHE -1.41 -0.84 1 37 GLN 2.64 -1.43 1 39 ASN -5.83 -3.71 1 41 TYR -3.90 -1.52 1 42 PHE -2.76 -3.10 1 43 MET -1.55 -2.23 1 45 ASN -1.62 -0.61 1 46 SER -2.87 -3.64 1 47 GLN -3.27 0.04 1 48 ARG -6.81 0.51 1 49 ASN 1.20 0.62 1 50 TRP 5.42 1.05 1 51 HIS 4.33 4.90 1 52 ASP 3.67 2.99 1 53 SER 6.51 0.11 1 55 THR 5.96 0.62 1 56 ALA 3.83 3.62 1 59 GLU 2.39 1.36 1 60 VAL -0.76 -0.68 1 62 ALA -8.31 -3.64 1 63 GLN -5.98 -0.44 1 64 LEU 1.80 1.32 1 65 VAL 2.28 -3.71 1 69 SER -1.12 1.87 1 70 ALA 3.04 1.80 1 71 GLU 4.32 2.64 1 72 GLU 3.19 0.57 1 73 GLN 6.07 0.47 1 74 ASN 3.97 1.90 1 75 PHE 3.02 1.12 1 76 LEU 1.50 1.32 1 77 GLN 3.22 2.97 1 78 LEU 3.04 1.36 1 79 GLN 4.43 2.81 1 80 SER 4.00 1.41 1 81 SER 3.53 3.63 1 82 ARG 3.41 1.01 1 83 SER -0.28 -1.00 1 84 ASN 2.51 -1.51 1 85 ARG -1.92 0.18 1 86 PHE 1.99 1.01 1 87 THR -3.80 -1.23 1 88 TRP -4.10 -0.98 1 89 MET -7.48 0.28 1 91 LEU -4.36 -3.89 1 92 SER -3.85 -1.57 1 94 LEU 0.08 0.95 1 95 ASN 3.48 0.11 1 96 GLN -1.32 -3.76 1 99 THR 0.69 -2.44 1 100 TRP 0.47 -0.41 1 101 GLN -5.74 -0.23 1 103 VAL 3.09 -0.18 1 104 ASP -0.05 0.46 1 108 LEU -0.27 -0.84 1 111 SER 3.22 0.61 1 112 PHE 0.56 -0.48 1 113 LYS 4.18 1.00 1 114 GLN 1.56 -0.92 1 115 TYR 4.24 0.05 1 116 TRP -0.36 1.50 1 117 ASN -0.23 0.39 1 123 ASN 0.01 -0.16 1 124 VAL 0.72 0.18 1 128 ASP -2.80 -2.44 1 130 ALA -3.57 -3.42 1 131 GLU -7.46 -0.53 1 132 PHE 0.39 -0.12 1 133 SER -2.16 -0.13 1 135 ASN -0.60 -0.69 1 137 TRP -8.03 1.11 1 138 ASN -4.59 -0.61 1 139 ASP -2.91 -2.51 1 140 ASP -7.59 -1.38 1 141 LYS 2.74 -1.30 1 143 ASN 1.93 -0.08 1 144 LEU -0.68 -2.50 1 145 ALA -0.42 -1.31 1 147 PHE 2.70 -2.85 1 148 TRP -1.41 -2.79 1 149 ILE -6.77 0.14 1 151 LYS -6.83 -1.20 1 154 ALA -1.77 -0.32 1 155 ALA -0.72 -2.09 1 159 ARG 1.48 0.49 1 160 ASP 0.62 0.12 1 161 GLU 0.04 -0.50 1 162 GLU 0.25 0.01 1 163 GLN 0.27 -1.51 1 165 LEU -0.52 -0.90 1 170 ALA -0.35 -0.21 1 stop_ save_