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 bmr4965_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.50 _LACS_plot.Line_2_terminator_val_x_2 9.87 _LACS_plot.Line_2_terminator_val_y_2 7.77 _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 127 ILE 4.81 0.72 0 112 MET 9.87 8.53 0 111 LYS -0.51 -2.91 0 10 LEU -6.85 -2.15 1 11 GLN -0.57 -0.31 1 12 LEU -5.89 -1.98 1 14 ALA 1.38 1.21 1 16 LYS -1.72 -0.79 1 17 ALA 0.35 0.82 1 18 THR -0.66 -0.51 1 20 ALA 1.94 0.96 1 23 VAL 6.37 5.20 1 26 ALA 2.31 2.06 1 27 LEU 1.94 1.81 1 29 GLN 3.58 2.13 1 30 HIS -3.82 0.09 1 32 ALA -1.88 -1.16 1 33 ASN 1.78 0.69 1 34 ILE 3.95 4.40 1 35 MET 4.35 1.69 1 36 GLU 3.02 2.67 1 37 PHE 6.50 4.57 1 38 VAL 6.30 5.12 1 39 LYS 3.72 3.41 1 40 ALA 2.53 2.54 1 41 PHE 5.52 4.25 1 42 ASN 5.54 2.68 1 43 ALA 3.23 2.31 1 44 ALA 1.90 1.75 1 45 THR -0.63 -0.83 1 46 ALA 2.28 2.28 1 47 ASN 0.79 -0.03 1 48 MET 0.74 0.82 1 50 ASP 0.13 -0.68 1 51 ALA -1.40 -0.19 1 52 ILE 0.66 -1.26 1 53 VAL -2.76 -0.62 1 55 VAL -6.01 -3.20 1 56 GLU -3.82 -1.88 1 57 ILE -1.84 -0.11 1 58 THR 1.77 1.46 1 59 ILE -1.86 -1.16 1 60 TYR -1.91 -0.28 1 61 ALA 2.73 2.39 1 62 ASP 0.81 -0.84 1 63 ARG 7.15 3.13 1 64 SER -0.44 0.73 1 65 PHE -5.27 -1.42 1 66 THR -4.13 -1.23 1 67 PHE -5.27 -1.34 1 68 VAL -4.98 -2.05 1 69 THR -1.98 -1.79 1 70 LYS -2.16 -1.90 1 71 THR 0.90 0.46 1 74 ALA 4.45 3.08 1 75 SER 5.64 3.41 1 76 TYR 3.61 3.13 1 77 LEU 2.76 2.63 1 78 ILE 4.93 4.56 1 79 ARG 5.51 4.93 1 80 LYS 3.53 2.62 1 81 ALA 3.40 2.50 1 82 ALA -1.78 -0.75 1 84 LEU -0.66 -0.36 1 85 GLU -1.29 -0.72 1 86 LYS 1.31 0.96 1 88 ALA -0.51 -0.18 1 89 HIS -0.57 0.92 1 90 LYS -0.33 -0.17 1 93 ARG 0.58 0.29 1 94 GLU -0.02 0.35 1 95 LYS -0.07 -0.04 1 96 VAL 0.38 0.32 1 98 ARG -4.53 -1.32 1 99 ILE -5.72 -2.11 1 100 THR -3.31 -1.57 1 101 TRP 1.95 2.20 1 102 GLU 5.14 4.29 1 103 GLN 3.36 3.55 1 104 VAL 7.93 5.14 1 105 LEU 3.28 2.91 1 106 GLU 3.03 2.83 1 107 ILE 4.85 4.38 1 108 ALA 4.91 3.21 1 109 LYS 4.05 3.76 1 110 GLN 2.36 2.57 1 114 ASP 0.69 1.21 1 115 LEU -0.58 -0.33 1 116 ASN 2.37 0.76 1 117 THR -1.00 -1.44 1 118 THR 0.50 -0.17 1 119 ASP -2.46 -1.17 1 120 LEU 3.64 3.10 1 121 GLU 4.47 3.47 1 122 ALA 3.46 2.41 1 123 ALA 2.62 2.46 1 124 ALA 3.47 2.91 1 125 ARG 5.23 4.33 1 126 MET 4.45 4.13 1 128 ALA 3.72 3.05 1 130 SER 5.41 4.00 1 131 ALA 5.21 3.18 1 132 ARG 5.14 3.88 1 133 SER 3.94 3.22 1 134 MET -1.12 0.45 1 136 VAL -0.19 -0.69 1 137 GLU -2.12 -0.70 1 138 VAL -0.83 -1.20 1 139 VAL -1.83 -0.88 1 141 ALA -0.02 -0.18 1 143 GLU -0.87 -0.35 1 144 VAL 0.09 0.00 1 145 LYS -0.41 -0.14 1 146 ASP 0.34 0.35 1 147 ALA 0.08 1.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4965_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 4.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.37 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.50 _LACS_plot.Line_2_terminator_val_x_2 9.87 _LACS_plot.Line_2_terminator_val_y_2 -2.10 _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 127 ILE 4.81 -4.09 0 112 MET 9.87 -1.34 0 111 LYS -0.51 -2.40 0 10 LEU -6.85 4.70 1 11 GLN -0.57 0.26 1 12 LEU -5.89 3.91 1 14 ALA 1.38 -0.17 1 16 LYS -1.72 0.93 1 17 ALA 0.35 0.47 1 18 THR -0.66 0.15 1 20 ALA 1.94 -0.98 1 23 VAL 6.37 -1.17 1 26 ALA 2.31 -0.25 1 27 LEU 1.94 -0.13 1 29 GLN 3.58 -1.45 1 30 HIS -3.82 3.91 1 32 ALA -1.88 0.72 1 33 ASN 1.78 -1.09 1 34 ILE 3.95 0.45 1 35 MET 4.35 -2.66 1 36 GLU 3.02 -0.35 1 37 PHE 6.50 -1.93 1 38 VAL 6.30 -1.18 1 39 LYS 3.72 -0.31 1 40 ALA 2.53 0.01 1 41 PHE 5.52 -1.27 1 42 ASN 5.54 -2.86 1 43 ALA 3.23 -0.92 1 44 ALA 1.90 -0.15 1 45 THR -0.63 -0.20 1 46 ALA 2.28 0.00 1 47 ASN 0.79 -0.82 1 48 MET 0.74 0.08 1 50 ASP 0.13 -0.81 1 51 ALA -1.40 1.21 1 52 ILE 0.66 -1.92 1 53 VAL -2.76 2.14 1 55 VAL -6.01 2.81 1 56 GLU -3.82 1.94 1 57 ILE -1.84 1.73 1 58 THR 1.77 -0.31 1 59 ILE -1.86 0.70 1 60 TYR -1.91 1.63 1 61 ALA 2.73 -0.34 1 62 ASP 0.81 -1.65 1 63 ARG 7.15 -4.02 1 64 SER -0.44 1.17 1 65 PHE -5.27 3.85 1 66 THR -4.13 2.90 1 67 PHE -5.27 3.93 1 68 VAL -4.98 2.93 1 69 THR -1.98 0.19 1 70 LYS -2.16 0.26 1 71 THR 0.90 -0.44 1 74 ALA 4.45 -1.37 1 75 SER 5.64 -2.23 1 76 TYR 3.61 -0.48 1 77 LEU 2.76 -0.13 1 78 ILE 4.93 -0.37 1 79 ARG 5.51 -0.58 1 80 LYS 3.53 -0.91 1 81 ALA 3.40 -0.90 1 82 ALA -1.78 1.03 1 84 LEU -0.66 0.30 1 85 GLU -1.29 0.57 1 86 LYS 1.31 -0.35 1 88 ALA -0.51 0.33 1 89 HIS -0.57 1.49 1 90 LYS -0.33 0.16 1 93 ARG 0.58 -0.29 1 94 GLU -0.02 0.37 1 95 LYS -0.07 0.03 1 96 VAL 0.38 -0.06 1 98 ARG -4.53 3.21 1 99 ILE -5.72 3.61 1 100 THR -3.31 1.74 1 101 TRP 1.95 0.25 1 102 GLU 5.14 -0.85 1 103 GLN 3.36 0.19 1 104 VAL 7.93 -2.79 1 105 LEU 3.28 -0.37 1 106 GLU 3.03 -0.20 1 107 ILE 4.85 -0.47 1 108 ALA 4.91 -1.70 1 109 LYS 4.05 -0.29 1 110 GLN 2.36 0.21 1 114 ASP 0.69 0.52 1 115 LEU -0.58 0.25 1 116 ASN 2.37 -1.61 1 117 THR -1.00 -0.44 1 118 THR 0.50 -0.67 1 119 ASP -2.46 1.29 1 120 LEU 3.64 -0.54 1 121 GLU 4.47 -1.00 1 122 ALA 3.46 -1.05 1 123 ALA 2.62 -0.16 1 124 ALA 3.47 -0.56 1 125 ARG 5.23 -0.90 1 126 MET 4.45 -0.32 1 128 ALA 3.72 -0.67 1 130 SER 5.41 -1.41 1 131 ALA 5.21 -2.03 1 132 ARG 5.14 -1.26 1 133 SER 3.94 -0.72 1 134 MET -1.12 1.57 1 136 VAL -0.19 -0.50 1 137 GLU -2.12 1.42 1 138 VAL -0.83 -0.37 1 139 VAL -1.83 0.95 1 141 ALA -0.02 -0.16 1 143 GLU -0.87 0.52 1 144 VAL 0.09 -0.09 1 145 LYS -0.41 0.27 1 146 ASP 0.34 0.01 1 147 ALA 0.08 1.28 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4965_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 0.80 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 9.87 _LACS_plot.Line_2_terminator_val_y_2 -1.02 _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 141 ALA -0.02 -1.09 0 65 PHE -5.27 1.79 0 10 LEU -6.85 0.42 1 11 GLN -0.57 0.62 1 12 LEU -5.89 0.31 1 14 ALA 1.38 -0.43 1 16 LYS -1.72 0.31 1 17 ALA 0.35 0.14 1 18 THR -0.66 0.23 1 20 ALA 1.94 -0.17 1 23 VAL 6.37 -0.93 1 26 ALA 2.31 -0.17 1 27 LEU 1.94 -0.21 1 29 GLN 3.58 -0.30 1 30 HIS -3.82 0.09 1 32 ALA -1.88 0.31 1 33 ASN 1.78 -0.16 1 34 ILE 3.95 -0.85 1 35 MET 4.35 -0.14 1 36 GLU 3.02 -0.25 1 37 PHE 6.50 -0.64 1 38 VAL 6.30 -1.43 1 39 LYS 3.72 -0.36 1 40 ALA 2.53 -0.04 1 41 PHE 5.52 -1.02 1 42 ASN 5.54 -0.57 1 43 ALA 3.23 -0.09 1 44 ALA 1.90 -0.02 1 45 THR -0.63 0.11 1 46 ALA 2.28 -0.36 1 47 ASN 0.79 0.15 1 48 MET 0.74 -0.10 1 50 ASP 0.13 0.24 1 51 ALA -1.40 -0.16 1 52 ILE 0.66 0.16 1 53 VAL -2.76 0.20 1 55 VAL -6.01 1.20 1 56 GLU -3.82 0.82 1 57 ILE -1.84 0.64 1 58 THR 1.77 0.22 1 59 ILE -1.86 0.53 1 60 TYR -1.91 0.82 1 61 ALA 2.73 -0.20 1 62 ASP 0.81 -0.01 1 63 ARG 7.15 -0.51 1 64 SER -0.44 0.00 1 66 THR -4.13 0.49 1 67 PHE -5.27 1.44 1 68 VAL -4.98 0.55 1 69 THR -1.98 0.85 1 70 LYS -2.16 0.47 1 71 THR 0.90 0.00 1 74 ALA 4.45 -0.46 1 75 SER 5.64 -0.52 1 76 TYR 3.61 -0.38 1 77 LEU 2.76 -0.51 1 78 ILE 4.93 -0.80 1 79 ARG 5.51 -0.72 1 80 LYS 3.53 -0.39 1 81 ALA 3.40 -0.22 1 82 ALA -1.78 0.20 1 84 LEU -0.66 0.01 1 85 GLU -1.29 -0.01 1 86 LYS 1.31 -0.08 1 88 ALA -0.51 -0.01 1 89 HIS -0.57 -0.08 1 90 LYS -0.33 0.00 1 93 ARG 0.58 0.02 1 94 GLU -0.02 -0.08 1 95 LYS -0.07 0.05 1 96 VAL 0.38 0.10 1 98 ARG -4.53 1.15 1 99 ILE -5.72 0.80 1 100 THR -3.31 0.80 1 101 TRP 1.95 -0.32 1 102 GLU 5.14 -0.50 1 103 GLN 3.36 -0.29 1 104 VAL 7.93 -0.99 1 105 LEU 3.28 -0.80 1 106 GLU 3.03 -0.40 1 107 ILE 4.85 -0.51 1 108 ALA 4.91 -0.78 1 109 LYS 4.05 -0.45 1 110 GLN 2.36 -0.21 1 111 LYS -0.51 0.23 1 112 MET 9.87 -0.72 1 114 ASP 0.69 0.03 1 115 LEU -0.58 0.05 1 116 ASN 2.37 -0.29 1 117 THR -1.00 0.38 1 118 THR 0.50 0.19 1 119 ASP -2.46 0.12 1 120 LEU 3.64 -0.26 1 121 GLU 4.47 -0.35 1 122 ALA 3.46 -0.21 1 123 ALA 2.62 -0.21 1 124 ALA 3.47 -0.78 1 125 ARG 5.23 -0.14 1 126 MET 4.45 -0.25 1 127 ILE 4.81 -0.44 1 128 ALA 3.72 -0.35 1 130 SER 5.41 -0.21 1 131 ALA 5.21 -0.31 1 132 ARG 5.14 0.01 1 133 SER 3.94 -0.12 1 134 MET -1.12 0.05 1 136 VAL -0.19 -0.18 1 137 GLU -2.12 -0.08 1 138 VAL -0.83 0.71 1 139 VAL -1.83 0.36 1 143 GLU -0.87 -0.19 1 144 VAL 0.09 -0.08 1 145 LYS -0.41 0.04 1 146 ASP 0.34 -0.08 1 147 ALA 0.08 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4965_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.85 _LACS_plot.Line_1_terminator_val_y_1 -2.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.82 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.71 _LACS_plot.Line_2_terminator_val_x_2 9.87 _LACS_plot.Line_2_terminator_val_y_2 3.30 _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 147 ALA 0.08 4.57 0 112 MET 9.87 -0.12 0 10 LEU -6.85 -2.24 1 11 GLN -0.57 -1.19 1 14 ALA 1.38 1.27 1 16 LYS -1.72 -0.35 1 17 ALA 0.35 -0.66 1 18 THR -0.66 -1.10 1 20 ALA 1.94 -0.84 1 23 VAL 6.37 0.97 1 26 ALA 2.31 0.86 1 27 LEU 1.94 2.31 1 29 GLN 3.58 -0.22 1 30 HIS -3.82 1.25 1 32 ALA -1.88 -1.69 1 33 ASN 1.78 -0.44 1 34 ILE 3.95 1.10 1 35 MET 4.35 2.98 1 36 GLU 3.02 3.26 1 37 PHE 6.50 -0.65 1 38 VAL 6.30 0.76 1 39 LYS 3.72 3.10 1 40 ALA 2.53 3.31 1 41 PHE 5.52 3.17 1 42 ASN 5.54 2.38 1 43 ALA 3.23 2.49 1 44 ALA 1.90 1.75 1 45 THR -0.63 0.21 1 46 ALA 2.28 0.31 1 47 ASN 0.79 0.55 1 48 MET 0.74 -0.54 1 50 ASP 0.13 -0.84 1 51 ALA -1.40 -1.99 1 52 ILE 0.66 -0.43 1 53 VAL -2.76 -1.30 1 55 VAL -6.01 -3.08 1 56 GLU -3.82 -0.10 1 57 ILE -1.84 -1.74 1 58 THR 1.77 -2.42 1 59 ILE -1.86 -0.94 1 60 TYR -1.91 2.64 1 61 ALA 2.73 -0.52 1 62 ASP 0.81 0.21 1 63 ARG 7.15 -1.23 1 64 SER -0.44 -2.52 1 65 PHE -5.27 -0.37 1 66 THR -4.13 -1.52 1 67 PHE -5.27 -2.93 1 68 VAL -4.98 -0.73 1 69 THR -1.98 -0.43 1 70 LYS -2.16 -0.72 1 71 THR 0.90 -0.45 1 74 ALA 4.45 0.93 1 75 SER 5.64 1.22 1 76 TYR 3.61 0.93 1 77 LEU 2.76 2.80 1 78 ILE 4.93 0.28 1 79 ARG 5.51 2.25 1 80 LYS 3.53 3.40 1 81 ALA 3.40 0.49 1 82 ALA -1.78 -0.48 1 84 LEU -0.66 -0.43 1 85 GLU -1.29 -0.33 1 86 LYS 1.31 0.53 1 88 ALA -0.51 -0.42 1 89 HIS -0.57 0.66 1 90 LYS -0.33 -0.66 1 93 ARG 0.58 0.22 1 94 GLU -0.02 -0.27 1 95 LYS -0.07 -0.39 1 96 VAL 0.38 0.45 1 98 ARG -4.53 -2.02 1 99 ILE -5.72 -2.43 1 100 THR -3.31 2.26 1 101 TRP 1.95 0.60 1 102 GLU 5.14 3.23 1 103 GLN 3.36 3.06 1 104 VAL 7.93 1.29 1 105 LEU 3.28 1.40 1 106 GLU 3.03 3.10 1 107 ILE 4.85 1.20 1 108 ALA 4.91 0.69 1 109 LYS 4.05 2.60 1 110 GLN 2.36 1.98 1 111 LYS -0.51 0.03 1 114 ASP 0.69 0.84 1 115 LEU -0.58 -1.24 1 116 ASN 2.37 -1.37 1 117 THR -1.00 -2.13 1 118 THR 0.50 -0.79 1 119 ASP -2.46 -1.01 1 120 LEU 3.64 0.35 1 121 GLU 4.47 2.70 1 122 ALA 3.46 3.38 1 123 ALA 2.62 1.22 1 124 ALA 3.47 1.29 1 125 ARG 5.23 4.20 1 126 MET 4.45 3.18 1 127 ILE 4.81 1.56 1 128 ALA 3.72 1.94 1 130 SER 5.41 2.35 1 131 ALA 5.21 1.53 1 132 ARG 5.14 5.19 1 133 SER 3.94 0.52 1 134 MET -1.12 -0.48 1 136 VAL -0.19 -1.69 1 137 GLU -2.12 -1.70 1 138 VAL -0.83 0.34 1 139 VAL -1.83 -0.30 1 141 ALA -0.02 -0.63 1 143 GLU -0.87 -0.30 1 144 VAL 0.09 -0.43 1 145 LYS -0.41 -0.58 1 146 ASP 0.34 -1.52 1 stop_ save_