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 bmr15927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 -2.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _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 6.00 _LACS_plot.Line_2_terminator_val_y_2 4.25 _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 112 TYR 3.40 -2.63 0 11 ALA 2.08 1.29 1 12 SER -0.24 0.09 1 13 LEU 3.34 1.73 1 14 THR -6.91 -2.56 1 15 PHE 4.24 1.74 1 16 GLU 5.01 3.73 1 17 VAL 4.73 4.18 1 18 LEU 4.89 2.64 1 19 ASP 4.63 3.57 1 20 LYS 4.73 3.53 1 21 VAL 6.00 4.03 1 22 LEU 3.29 3.15 1 24 GLU 2.34 0.82 1 25 LEU -0.97 0.72 1 27 LYS 2.47 0.21 1 28 VAL -1.98 -1.14 1 29 SER 2.68 2.71 1 30 ARG -3.83 -3.25 1 31 LYS -4.32 -1.43 1 32 ILE -5.45 -2.93 1 33 ALA -8.77 -2.52 1 34 VAL -4.26 -1.86 1 36 ILE -2.66 -1.50 1 37 ASP -1.62 -0.96 1 38 ASN 2.80 0.04 1 39 GLU -0.06 -3.52 1 40 SER -0.06 2.13 1 43 THR 1.10 1.49 1 44 TRP -8.28 -4.89 1 45 THR -3.18 -1.57 1 46 ALA 1.31 2.05 1 47 LEU 2.23 0.32 1 48 ASN -0.62 0.06 1 49 ALA -5.93 -1.44 1 50 TYR -2.99 -1.47 1 51 PHE -0.37 -0.83 1 52 ARG 0.60 0.38 1 53 SER -2.43 -0.24 1 55 THR -1.52 -2.78 1 56 THR -1.85 -2.79 1 57 ASP -2.07 -0.22 1 58 VAL -4.67 -2.55 1 59 ILE -1.79 -1.07 1 60 LEU -0.44 0.12 1 62 GLU 4.30 4.05 1 63 VAL -3.39 -1.14 1 64 VAL -1.46 -0.96 1 66 ASN 1.07 1.65 1 67 THR 4.51 3.66 1 68 LYS -2.84 -3.33 1 69 ALA -8.07 -3.81 1 70 LEU -3.28 -2.01 1 71 LEU -4.55 -2.23 1 72 TYR -5.58 -1.73 1 73 SER -4.76 -2.27 1 75 ARG -3.76 -1.11 1 76 LYS -0.06 -0.47 1 77 SER 1.38 1.26 1 78 SER 1.05 0.92 1 81 VAL 0.19 -0.31 1 82 ALA 0.30 -1.27 1 83 THR -3.84 -1.72 1 85 ALA -1.23 -1.60 1 86 VAL -4.14 -1.39 1 87 ALA -5.38 -1.61 1 88 ALA -5.69 -2.34 1 89 PHE -3.95 -1.47 1 90 ALA -6.92 -1.79 1 91 TYR -4.83 0.07 1 92 TYR -1.66 -1.34 1 93 MET -1.25 0.59 1 94 SER 3.87 3.17 1 95 ASN 0.77 -0.21 1 97 ASN -4.12 -1.61 1 98 THR -0.72 1.71 1 99 LEU -1.84 -1.10 1 101 VAL -3.11 -1.60 1 102 MET -2.46 -1.80 1 103 PHE -4.99 -1.07 1 104 SER -0.40 -0.21 1 105 VAL -1.13 -0.84 1 107 PHE 3.23 3.60 1 108 ASP -1.68 -0.93 1 109 TYR 3.11 2.20 1 110 ASN 3.96 2.74 1 111 TRP -3.64 -1.00 1 113 SER -0.08 0.03 1 114 ASN 1.40 0.81 1 115 TRP -7.52 -0.47 1 116 TRP -3.75 -1.09 1 117 ASP -2.53 -0.91 1 118 VAL -5.07 -1.46 1 119 LYS -4.31 -0.08 1 120 ILE -1.06 -1.55 1 121 TYR -2.83 -0.68 1 124 LYS -0.02 -0.32 1 125 ARG -3.30 -2.10 1 126 ARG 0.70 0.51 1 127 ALA -0.56 0.01 1 128 ASP -1.80 -2.03 1 129 GLN 5.57 3.93 1 131 MET 2.34 4.04 1 132 TYR 5.28 4.26 1 133 GLU 4.27 3.42 1 134 ASP 1.48 3.03 1 135 MET 0.61 3.12 1 136 TYR 4.87 4.92 1 137 TYR 2.59 -0.30 1 139 ASN 0.58 0.57 1 141 TYR -1.04 -0.81 1 142 ARG -0.53 0.03 1 144 ASP -2.66 -2.01 1 145 ASN 3.03 2.58 1 147 TRP -1.23 -0.53 1 148 TYR -4.14 0.11 1 149 GLN -4.99 -1.35 1 150 LYS -3.99 -0.21 1 151 ASN 1.00 0.43 1 152 LEU -1.18 0.15 1 154 TYR 5.85 1.57 1 156 LEU -4.84 -1.44 1 157 ARG -4.11 -1.20 1 158 MET -5.64 -1.84 1 159 LYS -3.21 0.15 1 161 ILE -5.14 -2.36 1 162 MET -5.80 -1.81 1 163 THR -0.78 -0.47 1 164 SER -1.11 0.99 1 165 ALA -3.56 -1.32 1 167 GLU -0.31 -2.48 1 168 ALA -2.27 -0.30 1 169 LYS -4.55 -1.52 1 170 MET -6.79 -1.02 1 171 GLN -4.24 -1.54 1 172 ILE -6.16 -1.71 1 173 LYS -2.90 -0.26 1 174 ILE -1.97 -3.66 1 175 SER -4.77 -1.27 1 176 ARG 0.89 1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 5.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.88 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -1.75 _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 112 TYR 3.40 -6.03 0 11 ALA 2.08 -0.79 1 12 SER -0.24 0.33 1 13 LEU 3.34 -1.61 1 14 THR -6.91 4.35 1 15 PHE 4.24 -2.50 1 16 GLU 5.01 -1.28 1 17 VAL 4.73 -0.55 1 18 LEU 4.89 -2.25 1 19 ASP 4.63 -1.06 1 20 LYS 4.73 -1.20 1 21 VAL 6.00 -1.97 1 22 LEU 3.29 -0.14 1 24 GLU 2.34 -1.52 1 25 LEU -0.97 1.69 1 27 LYS 2.47 -2.26 1 28 VAL -1.98 0.84 1 29 SER 2.68 0.03 1 30 ARG -3.83 0.58 1 31 LYS -4.32 2.89 1 32 ILE -5.45 2.52 1 33 ALA -8.77 6.25 1 34 VAL -4.26 2.40 1 36 ILE -2.66 1.16 1 37 ASP -1.62 0.66 1 38 ASN 2.80 -2.76 1 39 GLU -0.06 -3.46 1 40 SER -0.06 2.19 1 43 THR 1.10 0.39 1 44 TRP -8.28 3.39 1 45 THR -3.18 1.61 1 46 ALA 1.31 0.74 1 47 LEU 2.23 -1.91 1 48 ASN -0.62 0.68 1 49 ALA -5.93 4.49 1 50 TYR -2.99 1.52 1 51 PHE -0.37 -0.46 1 52 ARG 0.60 -0.22 1 53 SER -2.43 2.19 1 55 THR -1.52 -1.26 1 56 THR -1.85 -0.94 1 57 ASP -2.07 1.85 1 58 VAL -4.67 2.12 1 59 ILE -1.79 0.72 1 60 LEU -0.44 0.56 1 62 GLU 4.30 -0.25 1 63 VAL -3.39 2.25 1 64 VAL -1.46 0.50 1 66 ASN 1.07 0.58 1 67 THR 4.51 -0.85 1 68 LYS -2.84 -0.49 1 69 ALA -8.07 4.26 1 70 LEU -3.28 1.27 1 71 LEU -4.55 2.32 1 72 TYR -5.58 3.85 1 73 SER -4.76 2.49 1 75 ARG -3.76 2.65 1 76 LYS -0.06 -0.41 1 77 SER 1.38 -0.12 1 78 SER 1.05 -0.13 1 81 VAL 0.19 -0.50 1 82 ALA 0.30 -1.57 1 83 THR -3.84 2.12 1 85 ALA -1.23 -0.37 1 86 VAL -4.14 2.75 1 87 ALA -5.38 3.77 1 88 ALA -5.69 3.35 1 89 PHE -3.95 2.48 1 90 ALA -6.92 5.13 1 91 TYR -4.83 4.90 1 92 TYR -1.66 0.32 1 93 MET -1.25 1.84 1 94 SER 3.87 -0.70 1 95 ASN 0.77 -0.98 1 97 ASN -4.12 2.51 1 98 THR -0.72 2.43 1 99 LEU -1.84 0.74 1 101 VAL -3.11 1.51 1 102 MET -2.46 0.66 1 103 PHE -4.99 3.92 1 104 SER -0.40 0.19 1 105 VAL -1.13 0.29 1 107 PHE 3.23 0.37 1 108 ASP -1.68 0.75 1 109 TYR 3.11 -0.91 1 110 ASN 3.96 -1.22 1 111 TRP -3.64 2.64 1 113 SER -0.08 0.11 1 114 ASN 1.40 -0.59 1 115 TRP -7.52 7.05 1 116 TRP -3.75 2.66 1 117 ASP -2.53 1.62 1 118 VAL -5.07 3.61 1 119 LYS -4.31 4.23 1 120 ILE -1.06 -0.49 1 121 TYR -2.83 2.15 1 124 LYS -0.02 -0.30 1 125 ARG -3.30 1.20 1 126 ARG 0.70 -0.19 1 127 ALA -0.56 0.57 1 128 ASP -1.80 -0.23 1 129 GLN 5.57 -1.64 1 131 MET 2.34 1.70 1 132 TYR 5.28 -1.02 1 133 GLU 4.27 -0.85 1 134 ASP 1.48 1.55 1 135 MET 0.61 2.51 1 136 TYR 4.87 0.05 1 137 TYR 2.59 -2.89 1 139 ASN 0.58 -0.01 1 141 TYR -1.04 0.23 1 142 ARG -0.53 0.56 1 144 ASP -2.66 0.65 1 145 ASN 3.03 -0.45 1 147 TRP -1.23 0.70 1 148 TYR -4.14 4.25 1 149 GLN -4.99 3.64 1 150 LYS -3.99 3.78 1 151 ASN 1.00 -0.57 1 152 LEU -1.18 1.33 1 154 TYR 5.85 -4.28 1 156 LEU -4.84 3.40 1 157 ARG -4.11 2.91 1 158 MET -5.64 3.80 1 159 LYS -3.21 3.36 1 161 ILE -5.14 2.78 1 162 MET -5.80 3.99 1 163 THR -0.78 0.31 1 164 SER -1.11 2.10 1 165 ALA -3.56 2.24 1 167 GLU -0.31 -2.17 1 168 ALA -2.27 1.97 1 169 LYS -4.55 3.03 1 170 MET -6.79 5.77 1 171 GLN -4.24 2.70 1 172 ILE -6.16 4.45 1 173 LYS -2.90 2.64 1 174 ILE -1.97 -1.69 1 175 SER -4.77 3.50 1 176 ARG 0.89 0.61 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15927_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.77 _LACS_plot.Line_1_terminator_val_y_1 1.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 128 ASP -1.80 -0.94 0 114 ASN 1.40 1.09 0 67 THR 4.51 0.48 0 33 ALA -8.77 0.37 0 112 TYR 3.40 0.86 0 11 ALA 2.08 -0.16 1 12 SER -0.24 0.01 1 13 LEU 3.34 -0.34 1 14 THR -6.91 0.55 1 15 PHE 4.24 -0.24 1 16 GLU 5.01 -0.11 1 17 VAL 4.73 -0.47 1 18 LEU 4.89 -0.38 1 19 ASP 4.63 -0.13 1 20 LYS 4.73 -0.19 1 21 VAL 6.00 -0.50 1 22 LEU 3.29 -0.37 1 24 GLU 2.34 -0.05 1 25 LEU -0.97 -0.11 1 27 LYS 2.47 0.01 1 28 VAL -1.98 0.32 1 29 SER 2.68 -0.20 1 30 ARG -3.83 1.11 1 31 LYS -4.32 0.60 1 32 ILE -5.45 1.06 1 34 VAL -4.26 0.85 1 36 ILE -2.66 1.19 1 37 ASP -1.62 -0.11 1 38 ASN 2.80 -0.31 1 39 GLU -0.06 0.63 1 40 SER -0.06 -0.46 1 43 THR 1.10 -0.18 1 44 TRP -8.28 1.28 1 45 THR -3.18 1.34 1 46 ALA 1.31 -1.27 1 47 LEU 2.23 0.30 1 48 ASN -0.62 -0.06 1 49 ALA -5.93 0.68 1 50 TYR -2.99 0.30 1 51 PHE -0.37 -0.32 1 52 ARG 0.60 -0.60 1 53 SER -2.43 0.14 1 55 THR -1.52 -0.93 1 56 THR -1.85 0.13 1 57 ASP -2.07 0.22 1 58 VAL -4.67 0.64 1 59 ILE -1.79 0.16 1 60 LEU -0.44 -0.65 1 62 GLU 4.30 -0.31 1 63 VAL -3.39 0.93 1 64 VAL -1.46 0.05 1 66 ASN 1.07 -0.54 1 68 LYS -2.84 0.65 1 69 ALA -8.07 1.52 1 70 LEU -3.28 0.64 1 71 LEU -4.55 1.31 1 72 TYR -5.58 0.31 1 73 SER -4.76 0.65 1 75 ARG -3.76 0.75 1 76 LYS -0.06 0.13 1 77 SER 1.38 -0.29 1 78 SER 1.05 -0.06 1 81 VAL 0.19 -0.14 1 82 ALA 0.30 -0.87 1 83 THR -3.84 0.21 1 85 ALA -1.23 0.51 1 86 VAL -4.14 0.72 1 87 ALA -5.38 0.35 1 88 ALA -5.69 1.45 1 89 PHE -3.95 0.72 1 90 ALA -6.92 1.63 1 91 TYR -4.83 -0.01 1 92 TYR -1.66 0.38 1 93 MET -1.25 0.31 1 94 SER 3.87 -0.29 1 95 ASN 0.77 -0.11 1 97 ASN -4.12 1.05 1 98 THR -0.72 0.64 1 99 LEU -1.84 0.13 1 101 VAL -3.11 0.53 1 102 MET -2.46 1.02 1 103 PHE -4.99 1.01 1 104 SER -0.40 0.58 1 105 VAL -1.13 0.54 1 107 PHE 3.23 -0.51 1 108 ASP -1.68 -0.04 1 109 TYR 3.11 0.60 1 110 ASN 3.96 -0.34 1 111 TRP -3.64 0.02 1 113 SER -0.08 -0.26 1 115 TRP -7.52 1.14 1 116 TRP -3.75 0.93 1 117 ASP -2.53 -0.03 1 118 VAL -5.07 1.02 1 119 LYS -4.31 0.06 1 120 ILE -1.06 0.96 1 121 TYR -2.83 -0.12 1 124 LYS -0.02 -0.44 1 125 ARG -3.30 0.04 1 126 ARG 0.70 -0.53 1 127 ALA -0.56 0.02 1 129 GLN 5.57 -0.74 1 131 MET 2.34 -0.79 1 132 TYR 5.28 -0.70 1 133 GLU 4.27 -1.02 1 134 ASP 1.48 -0.48 1 135 MET 0.61 -0.52 1 136 TYR 4.87 -1.27 1 137 TYR 2.59 -0.26 1 139 ASN 0.58 -0.34 1 141 TYR -1.04 -0.41 1 142 ARG -0.53 -0.51 1 144 ASP -2.66 -0.05 1 145 ASN 3.03 -0.89 1 147 TRP -1.23 0.45 1 148 TYR -4.14 0.33 1 149 GLN -4.99 1.42 1 150 LYS -3.99 0.45 1 151 ASN 1.00 0.13 1 152 LEU -1.18 0.08 1 154 TYR 5.85 -0.67 1 156 LEU -4.84 1.00 1 157 ARG -4.11 0.70 1 158 MET -5.64 1.29 1 159 LYS -3.21 1.44 1 161 ILE -5.14 0.35 1 162 MET -5.80 0.75 1 163 THR -0.78 0.38 1 164 SER -1.11 0.11 1 165 ALA -3.56 -0.04 1 167 GLU -0.31 0.37 1 168 ALA -2.27 -0.26 1 169 LYS -4.55 0.69 1 170 MET -6.79 0.77 1 171 GLN -4.24 1.09 1 172 ILE -6.16 1.13 1 173 LYS -2.90 0.96 1 174 ILE -1.97 1.17 1 175 SER -4.77 0.47 1 176 ARG 0.89 0.42 1 stop_ save_