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 bmr4984_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 -3.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.94 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 4.68 _LACS_plot.Y_axis_chem_shift_offset -0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 134 ILE -3.01 -3.82 0 10 GLU -4.49 -1.64 1 11 PHE -2.69 -1.44 1 12 GLU -3.84 -1.24 1 13 VAL -5.69 -3.51 1 14 LEU -2.84 -0.70 1 15 SER -5.13 -1.80 1 16 PHE -2.63 -1.16 1 17 GLU -7.40 -1.80 1 18 ILE -1.43 1.67 1 19 ASP 2.99 1.55 1 20 GLU 2.90 1.50 1 21 GLN -1.89 -0.92 1 22 ALA -1.92 -0.93 1 23 LEU -5.54 -1.24 1 24 ALA -4.35 -0.97 1 25 PHE -9.30 -3.71 1 26 ASP 2.60 3.40 1 27 VAL 3.72 3.56 1 28 ASP 3.50 3.15 1 29 ASN 0.79 1.16 1 30 ILE 1.48 -1.05 1 31 GLU -0.61 1.05 1 32 MET -2.55 0.30 1 33 VAL -1.37 -0.17 1 34 ILE -4.34 -1.45 1 35 GLU -0.28 0.50 1 36 LYS 1.63 1.31 1 37 SER -0.77 -0.30 1 38 ASP 0.57 0.90 1 39 ILE -1.26 -0.08 1 40 THR 0.60 1.20 1 44 LYS 1.70 0.65 1 45 SER -0.30 0.40 1 47 HIS 0.00 2.60 1 48 PHE 1.77 0.60 1 49 VAL 2.19 1.59 1 50 GLU -1.19 -0.05 1 52 VAL -6.39 -3.09 1 53 ILE -5.03 -1.56 1 54 ASN -1.96 -1.07 1 55 LEU -2.97 -1.33 1 56 ARG 1.52 1.11 1 58 ARG -1.85 -0.89 1 59 ILE 0.48 -1.06 1 60 ILE -3.50 -1.10 1 62 VAL -5.02 -2.68 1 63 VAL 0.80 -0.36 1 64 ASN 1.90 2.20 1 65 LEU 2.86 3.16 1 66 ALA 2.52 3.09 1 67 LYS 4.00 3.19 1 68 ILE -0.44 0.42 1 69 LEU -2.77 -1.29 1 71 ILE 1.06 1.45 1 72 SER -2.78 -1.11 1 73 PHE -3.57 -1.43 1 74 ASP 3.71 3.65 1 75 GLU 2.59 2.21 1 76 GLN -0.84 0.40 1 77 LYS 1.61 1.39 1 78 MET -2.12 0.19 1 79 LYS -2.55 0.13 1 80 SER -3.40 -0.94 1 81 ILE -1.74 -0.04 1 82 ILE 1.96 0.84 1 83 VAL -7.20 -2.39 1 84 ALA -4.42 -1.25 1 85 ARG -2.46 -1.76 1 86 THR 4.93 2.85 1 87 LYS -0.48 0.79 1 88 ASP -2.03 0.07 1 89 VAL -5.18 -1.57 1 90 GLU -4.86 -1.70 1 91 VAL -2.99 -1.07 1 93 PHE -1.71 0.62 1 94 LEU -6.57 -2.87 1 95 VAL 4.35 3.77 1 96 ASP -3.10 -1.08 1 97 ARG 1.15 1.05 1 98 VAL 1.31 0.93 1 99 LEU 0.24 0.36 1 101 VAL -3.99 -1.11 1 102 LEU -0.79 -0.34 1 103 ARG -4.53 -2.15 1 104 ILE -3.75 -1.52 1 105 THR 2.97 3.24 1 106 GLU 2.91 2.03 1 107 ASN -0.11 0.93 1 108 GLN -1.96 -0.38 1 109 LEU -2.28 -0.85 1 110 ASP 0.42 0.06 1 111 LEU 1.80 2.00 1 112 THR 0.50 1.20 1 113 ASN 0.76 0.93 1 114 VAL 0.54 0.65 1 115 SER 1.90 1.70 1 116 ASP 1.91 1.83 1 117 LYS -0.28 -0.32 1 118 PHE 2.37 1.06 1 120 LYS 3.11 2.07 1 121 LYS -4.01 -1.90 1 122 SER -0.41 0.44 1 123 LYS -4.65 -1.40 1 125 LEU -2.40 -1.18 1 126 VAL -0.64 -0.70 1 127 LYS -1.83 -1.49 1 128 THR 2.32 1.59 1 129 ASP -3.26 -0.78 1 131 ARG -1.49 -0.62 1 132 LEU -2.82 -0.86 1 133 ILE 1.76 0.70 1 135 TYR -2.14 -0.23 1 136 LEU -2.13 -1.69 1 137 ASP 3.91 3.23 1 138 ILE 4.54 4.16 1 139 ASP 2.23 1.66 1 140 LYS 5.44 4.67 1 141 ILE 6.22 4.16 1 142 ILE 3.20 3.27 1 143 GLU 2.50 2.42 1 144 GLU 2.31 2.30 1 145 ILE 1.26 1.48 1 146 THR 1.47 1.33 1 147 VAL 0.64 0.82 1 148 LYS -0.39 0.30 1 149 GLU 1.40 1.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4984_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 5.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.06 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -1.54 _LACS_plot.Y_axis_chem_shift_offset -0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 134 ILE -3.01 -0.81 0 10 GLU -4.49 2.85 1 11 PHE -2.69 1.25 1 12 GLU -3.84 2.60 1 13 VAL -5.69 2.18 1 14 LEU -2.84 2.14 1 15 SER -5.13 3.33 1 16 PHE -2.63 1.47 1 17 GLU -7.40 5.60 1 18 ILE -1.43 3.10 1 19 ASP 2.99 -1.44 1 20 GLU 2.90 -1.40 1 21 GLN -1.89 0.97 1 22 ALA -1.92 0.99 1 23 LEU -5.54 4.30 1 24 ALA -4.35 3.38 1 25 PHE -9.30 5.59 1 26 ASP 2.60 0.80 1 27 VAL 3.72 -0.16 1 28 ASP 3.50 -0.35 1 29 ASN 0.79 0.37 1 30 ILE 1.48 -2.53 1 31 GLU -0.61 1.66 1 32 MET -2.55 2.85 1 33 VAL -1.37 1.20 1 34 ILE -4.34 2.89 1 35 GLU -0.28 0.78 1 36 LYS 1.63 -0.32 1 37 SER -0.77 0.47 1 38 ASP 0.57 0.33 1 39 ILE -1.26 1.18 1 40 THR 0.60 0.60 1 44 LYS 1.70 -1.05 1 45 SER -0.30 0.70 1 47 HIS 0.00 2.60 1 48 PHE 1.77 -1.17 1 49 VAL 2.19 -0.60 1 50 GLU -1.19 1.14 1 52 VAL -6.39 3.30 1 53 ILE -5.03 3.47 1 54 ASN -1.96 0.89 1 55 LEU -2.97 1.64 1 56 ARG 1.52 -0.41 1 58 ARG -1.85 0.96 1 59 ILE 0.48 -1.54 1 60 ILE -3.50 2.40 1 62 VAL -5.02 2.34 1 63 VAL 0.80 -1.16 1 64 ASN 1.90 0.30 1 65 LEU 2.86 0.30 1 66 ALA 2.52 0.57 1 67 LYS 4.00 -0.81 1 68 ILE -0.44 0.86 1 69 LEU -2.77 1.48 1 71 ILE 1.06 0.39 1 72 SER -2.78 1.67 1 73 PHE -3.57 2.14 1 74 ASP 3.71 -0.06 1 75 GLU 2.59 -0.38 1 76 GLN -0.84 1.24 1 77 LYS 1.61 -0.22 1 78 MET -2.12 2.31 1 79 LYS -2.55 2.68 1 80 SER -3.40 2.46 1 81 ILE -1.74 1.70 1 82 ILE 1.96 -1.12 1 83 VAL -7.20 4.81 1 84 ALA -4.42 3.17 1 85 ARG -2.46 0.70 1 86 THR 4.93 -2.08 1 87 LYS -0.48 1.27 1 88 ASP -2.03 2.10 1 89 VAL -5.18 3.61 1 90 GLU -4.86 3.16 1 91 VAL -2.99 1.92 1 93 PHE -1.71 2.33 1 94 LEU -6.57 3.70 1 95 VAL 4.35 -0.58 1 96 ASP -3.10 2.02 1 97 ARG 1.15 -0.10 1 98 VAL 1.31 -0.38 1 99 LEU 0.24 0.12 1 101 VAL -3.99 2.88 1 102 LEU -0.79 0.45 1 103 ARG -4.53 2.38 1 104 ILE -3.75 2.23 1 105 THR 2.97 0.27 1 106 GLU 2.91 -0.88 1 107 ASN -0.11 1.04 1 108 GLN -1.96 1.58 1 109 LEU -2.28 1.43 1 110 ASP 0.42 -0.36 1 111 LEU 1.80 0.20 1 112 THR 0.50 0.70 1 113 ASN 0.76 0.17 1 114 VAL 0.54 0.11 1 115 SER 1.90 -0.20 1 116 ASP 1.91 -0.08 1 117 LYS -0.28 -0.04 1 118 PHE 2.37 -1.31 1 120 LYS 3.11 -1.04 1 121 LYS -4.01 2.11 1 122 SER -0.41 0.85 1 123 LYS -4.65 3.25 1 125 LEU -2.40 1.22 1 126 VAL -0.64 -0.06 1 127 LYS -1.83 0.34 1 128 THR 2.32 -0.73 1 129 ASP -3.26 2.48 1 131 ARG -1.49 0.87 1 132 LEU -2.82 1.96 1 133 ILE 1.76 -1.06 1 135 TYR -2.14 1.91 1 136 LEU -2.13 0.44 1 137 ASP 3.91 -0.68 1 138 ILE 4.54 -0.38 1 139 ASP 2.23 -0.57 1 140 LYS 5.44 -0.77 1 141 ILE 6.22 -2.06 1 142 ILE 3.20 0.07 1 143 GLU 2.50 -0.08 1 144 GLU 2.31 -0.01 1 145 ILE 1.26 0.22 1 146 THR 1.47 -0.14 1 147 VAL 0.64 0.18 1 148 LYS -0.39 0.69 1 149 GLU 1.40 0.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4984_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 1.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.33 _LACS_plot.Line_2_terminator_val_x_2 6.22 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 VAL 4.35 0.66 0 10 GLU -4.49 0.61 1 11 PHE -2.69 0.35 1 12 GLU -3.84 1.04 1 13 VAL -5.69 1.09 1 14 LEU -2.84 0.44 1 15 SER -5.13 1.13 1 16 PHE -2.63 0.51 1 17 GLU -7.40 1.21 1 18 ILE -1.43 -0.08 1 19 ASP 2.99 -0.42 1 20 GLU 2.90 -0.41 1 21 GLN -1.89 0.12 1 22 ALA -1.92 0.71 1 23 LEU -5.54 0.67 1 24 ALA -4.35 1.00 1 25 PHE -9.30 0.98 1 26 ASP 2.60 0.37 1 27 VAL 3.72 -0.07 1 28 ASP 3.50 -0.21 1 29 ASN 0.79 0.21 1 30 ILE 1.48 0.05 1 31 GLU -0.61 0.04 1 32 MET -2.55 0.22 1 33 VAL -1.37 0.70 1 34 ILE -4.34 0.52 1 35 GLU -0.28 0.16 1 36 LYS 1.63 -0.32 1 37 SER -0.77 0.02 1 38 ASP 0.57 0.01 1 39 ILE -1.26 0.18 1 40 THR 0.60 0.11 1 44 LYS 1.70 -0.20 1 45 SER -0.30 -0.66 1 47 HIS 0.00 -0.39 1 48 PHE 1.77 -0.08 1 49 VAL 2.19 0.05 1 50 GLU -1.19 0.08 1 52 VAL -6.39 1.30 1 53 ILE -5.03 0.54 1 54 ASN -1.96 0.44 1 55 LEU -2.97 0.33 1 56 ARG 1.52 -0.46 1 58 ARG -1.85 0.20 1 59 ILE 0.48 0.55 1 60 ILE -3.50 0.30 1 62 VAL -5.02 0.94 1 63 VAL 0.80 -0.10 1 64 ASN 1.90 -0.31 1 65 LEU 2.86 -0.45 1 66 ALA 2.52 -0.07 1 67 LYS 4.00 -0.57 1 68 ILE -0.44 -0.19 1 69 LEU -2.77 0.67 1 71 ILE 1.06 -0.17 1 72 SER -2.78 0.28 1 73 PHE -3.57 0.08 1 74 ASP 3.71 -0.18 1 75 GLU 2.59 -0.17 1 76 GLN -0.84 0.01 1 77 LYS 1.61 0.21 1 78 MET -2.12 0.35 1 79 LYS -2.55 0.70 1 80 SER -3.40 0.69 1 81 ILE -1.74 0.15 1 82 ILE 1.96 0.42 1 83 VAL -7.20 1.08 1 84 ALA -4.42 1.08 1 85 ARG -2.46 0.21 1 86 THR 4.93 -0.41 1 87 LYS -0.48 0.04 1 88 ASP -2.03 0.24 1 89 VAL -5.18 0.91 1 90 GLU -4.86 0.28 1 91 VAL -2.99 0.62 1 93 PHE -1.71 0.08 1 94 LEU -6.57 0.60 1 96 ASP -3.10 0.36 1 97 ARG 1.15 0.15 1 98 VAL 1.31 0.14 1 99 LEU 0.24 0.79 1 101 VAL -3.99 0.41 1 102 LEU -0.79 0.62 1 103 ARG -4.53 0.55 1 104 ILE -3.75 0.78 1 105 THR 2.97 -0.22 1 106 GLU 2.91 -0.04 1 107 ASN -0.11 0.07 1 108 GLN -1.96 0.38 1 109 LEU -2.28 0.30 1 110 ASP 0.42 0.31 1 111 LEU 1.80 -0.11 1 112 THR 0.50 -0.02 1 113 ASN 0.76 -0.04 1 114 VAL 0.54 -0.46 1 115 SER 1.90 -0.18 1 116 ASP 1.91 -0.26 1 117 LYS -0.28 0.15 1 118 PHE 2.37 0.06 1 120 LYS 3.11 -0.23 1 121 LYS -4.01 0.44 1 122 SER -0.41 0.06 1 123 LYS -4.65 0.86 1 125 LEU -2.40 0.43 1 126 VAL -0.64 0.66 1 127 LYS -1.83 0.29 1 128 THR 2.32 -0.26 1 129 ASP -3.26 0.24 1 131 ARG -1.49 0.58 1 132 LEU -2.82 -0.10 1 133 ILE 1.76 -0.08 1 134 ILE -3.01 0.22 1 135 TYR -2.14 0.37 1 136 LEU -2.13 -0.06 1 137 ASP 3.91 -0.38 1 138 ILE 4.54 -0.30 1 139 ASP 2.23 -0.21 1 140 LYS 5.44 -0.60 1 141 ILE 6.22 -0.45 1 142 ILE 3.20 -0.35 1 143 GLU 2.50 -0.14 1 144 GLU 2.31 0.03 1 145 ILE 1.26 -0.04 1 146 THR 1.47 -0.03 1 147 VAL 0.64 -0.28 1 148 LYS -0.39 0.03 1 149 GLU 1.40 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4984_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.30 _LACS_plot.Line_1_terminator_val_y_1 2.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.21 _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 5.43 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset -0.62 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 121 LYS -4.01 22.50 0 10 GLU -4.49 1.00 1 11 PHE -2.69 3.50 1 12 GLU -3.84 -0.30 1 13 VAL -5.69 3.10 1 14 LEU -2.84 -0.10 1 15 SER -5.13 3.60 1 16 PHE -2.63 -2.50 1 17 GLU -7.40 0.00 1 18 ILE -1.43 0.90 1 19 ASP 2.99 1.70 1 20 GLU 2.90 0.80 1 21 GLN -1.89 3.00 1 22 ALA -1.92 -1.90 1 23 LEU -5.54 0.80 1 24 ALA -4.35 -0.90 1 25 PHE -9.30 1.10 1 26 ASP 2.60 -0.90 1 27 VAL 3.72 -2.10 1 28 ASP 3.50 -0.40 1 29 ASN 0.79 3.80 1 30 ILE 1.48 0.80 1 31 GLU -0.61 0.00 1 32 MET -2.55 4.10 1 33 VAL -1.37 1.20 1 34 ILE -4.34 1.20 1 37 SER -0.77 4.70 1 38 ASP 0.57 1.00 1 39 ILE -1.26 0.50 1 44 LYS 1.70 0.20 1 45 SER -0.30 3.30 1 48 PHE 1.77 1.80 1 49 VAL 2.19 0.50 1 50 GLU -1.19 -0.50 1 52 VAL -6.39 1.40 1 53 ILE -5.03 2.90 1 54 ASN -1.96 2.70 1 55 LEU -2.97 -0.10 1 56 ARG 1.52 0.50 1 58 ARG -1.85 1.70 1 59 ILE 0.48 -0.20 1 62 VAL -5.02 1.80 1 63 VAL 0.80 3.00 1 64 ASN 1.90 0.60 1 65 LEU 2.86 -1.60 1 66 ALA 2.52 -3.40 1 67 LYS 4.00 -0.80 1 68 ILE -0.44 -1.20 1 69 LEU -2.77 1.20 1 71 ILE 1.06 5.70 1 72 SER -2.78 3.90 1 73 PHE -3.57 -1.20 1 74 ASP 3.71 -1.90 1 75 GLU 2.59 -0.60 1 76 GLN -0.84 -0.50 1 77 LYS 1.61 0.80 1 78 MET -2.12 -0.70 1 79 LYS -2.55 3.60 1 80 SER -3.40 1.00 1 81 ILE -1.74 1.10 1 82 ILE 1.96 2.60 1 83 VAL -7.20 0.40 1 84 ALA -4.42 0.80 1 85 ARG -2.46 4.30 1 86 THR 4.93 0.10 1 87 LYS -0.48 1.00 1 88 ASP -2.03 3.10 1 89 VAL -5.18 1.40 1 90 GLU -4.86 4.50 1 91 VAL -2.99 2.10 1 93 PHE -1.71 -0.50 1 94 LEU -6.57 2.70 1 95 VAL 4.35 -0.60 1 96 ASP -3.10 2.30 1 97 ARG 1.15 1.20 1 98 VAL 1.31 -2.00 1 99 LEU 0.24 0.60 1 101 VAL -3.99 0.50 1 102 LEU -0.79 0.80 1 103 ARG -4.53 1.90 1 104 ILE -3.75 1.20 1 105 THR 2.97 -1.20 1 106 GLU 2.91 1.50 1 107 ASN -0.11 2.10 1 108 GLN -1.96 -0.60 1 109 LEU -2.28 -0.20 1 110 ASP 0.42 -2.70 1 111 LEU 1.80 3.10 1 112 THR 0.50 2.50 1 113 ASN 0.76 0.10 1 114 VAL 0.54 2.50 1 115 SER 1.90 -0.70 1 116 ASP 1.91 -1.20 1 117 LYS -0.28 0.00 1 118 PHE 2.37 -0.30 1 120 LYS 3.11 0.80 1 122 SER -0.41 0.90 1 123 LYS -4.65 -0.70 1 125 LEU -2.40 2.00 1 126 VAL -0.64 0.30 1 127 LYS -1.83 4.60 1 128 THR 2.32 0.50 1 129 ASP -3.26 2.20 1 131 ARG -1.49 -0.80 1 132 LEU -2.82 1.20 1 133 ILE 1.76 2.80 1 134 ILE -3.01 2.10 1 135 TYR -2.14 0.50 1 136 LEU -2.13 0.80 1 137 ASP 3.91 1.00 1 138 ILE 4.54 -2.50 1 139 ASP 2.23 -3.30 1 140 LYS 5.44 -0.70 1 141 ILE 3.20 -1.90 1 143 GLU 2.50 -1.90 1 144 GLU 2.31 -0.20 1 145 ILE 1.26 2.90 1 146 THR 1.47 0.10 1 147 VAL 0.64 -0.90 1 148 LYS -0.39 -0.50 1 stop_ save_