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 bmr25893_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _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 -1.32 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 5.99 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 121 ARG -6.33 -1.05 0 60 LYS 5.64 0.91 0 10 VAL 1.79 1.28 1 11 ALA 0.68 0.68 1 12 LYS 0.87 0.78 1 13 LYS 0.76 0.66 1 14 LYS 0.41 0.55 1 15 SER -0.29 0.11 1 16 LYS 1.03 0.95 1 17 LYS 1.09 1.01 1 18 GLU 0.06 0.55 1 19 LYS 1.24 1.07 1 20 ASP 0.93 0.98 1 21 LYS 1.56 1.41 1 22 ASP 0.98 1.04 1 23 SER 1.61 1.51 1 24 LYS 3.98 3.34 1 25 LEU 3.43 2.81 1 26 GLU 3.77 3.42 1 27 LYS 4.10 3.51 1 28 ALA 3.23 2.58 1 29 LEU 3.62 3.13 1 30 LYS 4.37 3.61 1 31 ALA 3.84 2.68 1 32 GLN 2.08 3.92 1 33 ASN 4.19 3.10 1 34 ASP 4.14 3.35 1 35 LEU 4.28 3.57 1 36 ILE 5.27 4.12 1 37 TRP 5.25 4.61 1 38 ASN 3.95 3.71 1 39 ILE 5.09 3.79 1 40 LYS 6.06 5.27 1 41 ASP 2.67 3.44 1 42 GLU 3.17 2.71 1 43 LEU 2.86 3.15 1 44 LYS 3.04 2.36 1 45 LYS 1.81 2.53 1 46 VAL -0.96 0.15 1 48 SER -3.90 -1.65 1 49 THR 7.41 5.73 1 50 ASN 4.60 3.99 1 51 ASP 3.71 3.56 1 52 LEU 3.59 3.06 1 53 LYS 5.53 5.00 1 54 GLU 3.81 3.00 1 55 LEU 3.69 3.44 1 56 LEU 5.61 3.92 1 57 ILE 4.50 4.36 1 58 PHE 3.97 3.82 1 59 ASN -0.18 1.10 1 61 GLN -5.61 -3.51 1 62 GLN 0.14 0.40 1 63 VAL 0.24 0.10 1 65 SER 1.03 1.13 1 67 GLU 4.09 4.06 1 68 SER 4.88 3.49 1 69 ALA 2.62 2.34 1 70 ILE 6.00 5.71 1 71 LEU 3.74 3.62 1 72 ASP 4.09 4.03 1 73 ARG 3.77 3.30 1 74 VAL 6.23 4.72 1 75 ALA 4.14 3.59 1 76 ASP 1.04 3.20 1 78 MET 3.30 3.45 1 79 VAL 3.60 3.23 1 80 PHE 0.89 0.78 1 82 ALA -1.73 -0.83 1 83 LEU 0.57 1.47 1 84 LEU 1.89 0.19 1 87 GLU 1.67 2.23 1 88 GLU 1.08 1.59 1 90 SER 4.27 3.25 1 92 GLN -3.56 -1.86 1 93 LEU -0.17 1.08 1 94 VAL -4.51 -1.14 1 95 PHE 2.48 1.85 1 96 LYS -1.40 -1.02 1 97 SER 7.35 5.67 1 98 ASP -0.97 -0.72 1 99 ALA -1.70 -0.56 1 100 TYR 0.10 0.62 1 101 TYR -3.81 -1.42 1 103 THR -0.86 0.18 1 105 ASP -2.01 -0.12 1 106 VAL 3.49 3.06 1 107 THR -4.86 -1.97 1 108 ALA 2.90 1.48 1 109 TRP -0.50 0.01 1 110 THR -1.90 -0.39 1 111 LYS -0.78 -1.00 1 113 MET -0.35 -0.91 1 114 VAL 5.46 4.16 1 115 LYS -3.34 -1.47 1 116 THR -0.81 -2.09 1 117 GLN 1.46 1.04 1 118 THR -1.58 -2.20 1 120 ASN 0.76 0.75 1 122 LYS -4.37 -2.00 1 123 GLU 1.66 1.31 1 124 TRP 0.64 0.47 1 125 VAL -3.38 -1.46 1 126 THR -0.90 -0.62 1 128 LYS 3.71 3.06 1 129 GLU 2.98 1.56 1 130 PHE 0.20 0.32 1 131 ARG 2.22 1.64 1 132 GLU 0.41 0.25 1 133 ILE 1.11 -0.03 1 134 SER 5.28 4.22 1 135 TYR 2.95 3.27 1 136 LEU 2.47 1.61 1 137 LYS 3.29 2.55 1 138 LYS 1.38 0.97 1 139 LEU 0.73 0.48 1 140 LYS 0.80 0.27 1 141 VAL -0.65 -0.23 1 142 LYS -0.83 -0.36 1 143 LYS 0.92 0.52 1 144 GLN -3.23 -0.84 1 145 ASP -2.24 -0.70 1 146 ARG 1.39 0.85 1 147 ILE -0.79 -0.31 1 148 PHE -0.80 0.38 1 151 GLU 0.04 0.44 1 152 THR -0.11 0.08 1 153 SER -0.10 0.19 1 154 ASN 0.88 0.75 1 155 SER 0.46 0.53 1 156 SER 0.57 0.73 1 158 ARG -0.03 0.16 1 159 ILE 0.25 0.07 1 160 VAL 0.08 0.11 1 161 THR -0.69 -0.41 1 162 ASP 0.54 1.85 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25893_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 3.49 _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 0.68 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -1.41 _LACS_plot.Y_axis_chem_shift_offset -0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 121 ARG -6.33 5.28 0 60 LYS 5.64 -4.73 0 10 VAL 1.79 -0.51 1 11 ALA 0.68 0.00 1 12 LYS 0.87 -0.09 1 13 LYS 0.76 -0.10 1 14 LYS 0.41 0.14 1 15 SER -0.29 0.40 1 16 LYS 1.03 -0.08 1 17 LYS 1.09 -0.08 1 18 GLU 0.06 0.49 1 19 LYS 1.24 -0.17 1 20 ASP 0.93 0.05 1 21 LYS 1.56 -0.15 1 22 ASP 0.98 0.06 1 23 SER 1.61 -0.10 1 24 LYS 3.98 -0.64 1 25 LEU 3.43 -0.62 1 26 GLU 3.77 -0.35 1 27 LYS 4.10 -0.59 1 28 ALA 3.23 -0.65 1 29 LEU 3.62 -0.49 1 30 LYS 4.37 -0.76 1 31 ALA 3.84 -1.16 1 32 GLN 2.08 1.84 1 33 ASN 4.19 -1.09 1 34 ASP 4.14 -0.79 1 35 LEU 4.28 -0.71 1 36 ILE 5.27 -1.15 1 37 TRP 5.25 -0.64 1 38 ASN 3.95 -0.24 1 39 ILE 5.09 -1.30 1 40 LYS 6.06 -0.79 1 41 ASP 2.67 0.77 1 42 GLU 3.17 -0.46 1 43 LEU 2.86 0.29 1 44 LYS 3.04 -0.68 1 45 LYS 1.81 0.72 1 46 VAL -0.96 1.11 1 48 SER -3.90 2.25 1 49 THR 7.41 -1.68 1 50 ASN 4.60 -0.61 1 51 ASP 3.71 -0.15 1 52 LEU 3.59 -0.53 1 53 LYS 5.53 -0.53 1 54 GLU 3.81 -0.81 1 55 LEU 3.69 -0.25 1 56 LEU 5.61 -1.69 1 57 ILE 4.50 -0.14 1 58 PHE 3.97 -0.15 1 59 ASN -0.18 1.28 1 61 GLN -5.61 2.10 1 62 GLN 0.14 0.26 1 63 VAL 0.24 -0.14 1 65 SER 1.03 0.10 1 67 GLU 4.09 -0.03 1 68 SER 4.88 -1.39 1 69 ALA 2.62 -0.28 1 70 ILE 6.00 -0.29 1 71 LEU 3.74 -0.12 1 72 ASP 4.09 -0.06 1 73 ARG 3.77 -0.47 1 74 VAL 6.23 -1.51 1 75 ALA 4.14 -0.55 1 76 ASP 1.04 2.16 1 78 MET 3.30 0.15 1 79 VAL 3.60 -0.37 1 80 PHE 0.89 -0.11 1 82 ALA -1.73 0.90 1 83 LEU 0.57 0.90 1 84 LEU 1.89 -1.70 1 87 GLU 1.67 0.56 1 88 GLU 1.08 0.51 1 90 SER 4.27 -1.02 1 92 GLN -3.56 1.70 1 93 LEU -0.17 1.25 1 94 VAL -4.51 3.37 1 95 PHE 2.48 -0.63 1 96 LYS -1.40 0.38 1 97 SER 7.35 -1.68 1 98 ASP -0.97 0.25 1 99 ALA -1.70 1.14 1 100 TYR 0.10 0.52 1 101 TYR -3.81 2.39 1 103 THR -0.86 1.04 1 105 ASP -2.01 1.89 1 106 VAL 3.49 -0.43 1 107 THR -4.86 2.89 1 108 ALA 2.90 -1.42 1 109 TRP -0.50 0.51 1 110 THR -1.90 1.51 1 111 LYS -0.78 -0.22 1 113 MET -0.35 -0.56 1 114 VAL 5.46 -1.30 1 115 LYS -3.34 1.87 1 116 THR -0.81 -1.28 1 117 GLN 1.46 -0.42 1 118 THR -1.58 -0.62 1 120 ASN 0.76 -0.01 1 122 LYS -4.37 2.37 1 123 GLU 1.66 -0.35 1 124 TRP 0.64 -0.17 1 125 VAL -3.38 1.92 1 126 THR -0.90 0.28 1 128 LYS 3.71 -0.65 1 129 GLU 2.98 -1.42 1 130 PHE 0.20 0.12 1 131 ARG 2.22 -0.58 1 132 GLU 0.41 -0.16 1 133 ILE 1.11 -1.14 1 134 SER 5.28 -1.06 1 135 TYR 2.95 0.32 1 136 LEU 2.47 -0.86 1 137 LYS 3.29 -0.74 1 138 LYS 1.38 -0.41 1 139 LEU 0.73 -0.25 1 140 LYS 0.80 -0.53 1 141 VAL -0.65 0.42 1 142 LYS -0.83 0.47 1 143 LYS 0.92 -0.40 1 144 GLN -3.23 2.39 1 145 ASP -2.24 1.54 1 146 ARG 1.39 -0.54 1 147 ILE -0.79 0.48 1 148 PHE -0.80 1.18 1 151 GLU 0.04 0.40 1 152 THR -0.11 0.19 1 153 SER -0.10 0.29 1 154 ASN 0.88 -0.13 1 155 SER 0.46 0.07 1 156 SER 0.57 0.16 1 158 ARG -0.03 0.19 1 159 ILE 0.25 -0.18 1 160 VAL 0.08 0.03 1 161 THR -0.69 0.28 1 162 ASP 0.54 1.31 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25893_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.33 _LACS_plot.Line_1_terminator_val_y_1 0.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 MET 3.30 -1.63 0 10 VAL 1.79 -0.15 1 11 ALA 0.68 -0.07 1 12 LYS 0.87 -0.08 1 13 LYS 0.76 -0.04 1 14 LYS 0.41 0.00 1 15 SER -0.29 -0.02 1 16 LYS 1.03 -0.04 1 17 LYS 1.09 -0.04 1 18 GLU 0.06 -0.09 1 19 LYS 1.24 -0.08 1 20 ASP 0.93 -0.07 1 21 LYS 1.56 -0.10 1 22 ASP 0.98 0.01 1 23 SER 1.61 -0.06 1 24 LYS 3.98 -0.24 1 25 LEU 3.43 -0.11 1 26 GLU 3.77 -0.40 1 27 LYS 4.10 -0.26 1 28 ALA 3.23 -0.10 1 29 LEU 3.62 -0.41 1 30 LYS 4.37 -0.26 1 31 ALA 3.84 -0.10 1 32 GLN 2.08 -0.21 1 33 ASN 4.19 -0.24 1 34 ASP 4.14 -0.11 1 35 LEU 4.28 -0.14 1 36 ILE 5.27 -0.76 1 37 TRP 5.25 -0.62 1 38 ASN 3.95 -0.41 1 39 ILE 5.09 -0.50 1 40 LYS 6.06 -0.64 1 41 ASP 2.67 -0.55 1 42 GLU 3.17 -0.30 1 43 LEU 2.86 -0.41 1 44 LYS 3.04 -0.19 1 45 LYS 1.81 -0.13 1 46 VAL -0.96 0.38 1 48 SER -3.90 0.29 1 49 THR 7.41 -0.41 1 50 ASN 4.60 -0.35 1 51 ASP 3.71 -0.22 1 52 LEU 3.59 -0.30 1 53 LYS 5.53 -0.44 1 54 GLU 3.81 -0.31 1 55 LEU 3.69 -0.44 1 56 LEU 5.61 -0.31 1 57 ILE 4.50 -0.42 1 58 PHE 3.97 -0.48 1 59 ASN -0.18 -0.49 1 60 LYS 5.64 -0.34 1 61 GLN -5.61 0.37 1 62 GLN 0.14 -0.22 1 63 VAL 0.24 -0.04 1 65 SER 1.03 -0.10 1 67 GLU 4.09 -0.47 1 68 SER 4.88 -0.28 1 69 ALA 2.62 0.05 1 70 ILE 6.00 -0.83 1 71 LEU 3.74 -0.44 1 72 ASP 4.09 -0.35 1 73 ARG 3.77 -0.06 1 74 VAL 6.23 -0.61 1 75 ALA 4.14 -0.70 1 76 ASP 1.04 -0.53 1 79 VAL 3.60 -0.73 1 80 PHE 0.89 0.26 1 82 ALA -1.73 0.48 1 83 LEU 0.57 -0.17 1 84 LEU 1.89 -0.05 1 87 GLU 1.67 -0.28 1 88 GLU 1.08 0.06 1 90 SER 4.27 -0.15 1 92 GLN -3.56 0.17 1 93 LEU -0.17 0.78 1 94 VAL -4.51 0.38 1 95 PHE 2.48 -0.71 1 96 LYS -1.40 -0.11 1 97 SER 7.35 -0.81 1 98 ASP -0.97 0.15 1 99 ALA -1.70 -0.63 1 100 TYR 0.10 0.56 1 101 TYR -3.81 0.48 1 103 THR -0.86 0.41 1 105 ASP -2.01 0.41 1 106 VAL 3.49 -0.21 1 107 THR -4.86 0.09 1 108 ALA 2.90 -0.35 1 109 TRP -0.50 0.13 1 110 THR -1.90 0.27 1 111 LYS -0.78 0.30 1 113 MET -0.35 0.45 1 114 VAL 5.46 -0.43 1 115 LYS -3.34 0.66 1 116 THR -0.81 0.37 1 117 GLN 1.46 -0.04 1 118 THR -1.58 0.09 1 120 ASN 0.76 -0.06 1 121 ARG -6.33 0.95 1 122 LYS -4.37 0.48 1 123 GLU 1.66 -0.12 1 124 TRP 0.64 -0.40 1 125 VAL -3.38 0.36 1 126 THR -0.90 -0.12 1 128 LYS 3.71 -0.40 1 129 GLU 2.98 -0.29 1 130 PHE 0.20 -0.13 1 131 ARG 2.22 -0.34 1 132 GLU 0.41 -0.11 1 133 ILE 1.11 0.03 1 134 SER 5.28 -0.57 1 135 TYR 2.95 -0.42 1 136 LEU 2.47 -0.31 1 137 LYS 3.29 -0.27 1 138 LYS 1.38 -0.16 1 139 LEU 0.73 -0.18 1 140 LYS 0.80 -0.02 1 141 VAL -0.65 0.01 1 142 LYS -0.83 0.04 1 143 LYS 0.92 0.04 1 144 GLN -3.23 0.32 1 145 ASP -2.24 0.30 1 146 ARG 1.39 -0.83 1 147 ILE -0.79 -0.05 1 148 PHE -0.80 -0.06 1 151 GLU 0.04 -0.01 1 152 THR -0.11 0.06 1 153 SER -0.10 -0.02 1 154 ASN 0.88 -0.06 1 155 SER 0.46 0.00 1 156 SER 0.57 -0.01 1 158 ARG -0.03 0.02 1 159 ILE 0.25 0.03 1 160 VAL 0.08 0.11 1 161 THR -0.69 0.06 1 162 ASP 0.54 -0.24 1 stop_ save_