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 bmr19826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -2.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 4.83 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 PHE -3.49 -5.36 0 10 ASP -1.26 -1.01 1 11 LYS 3.24 1.90 1 12 SER -0.73 0.23 1 13 LYS -2.21 -1.49 1 14 VAL 1.99 1.79 1 15 ALA -3.04 -0.16 1 17 TYR -4.58 -0.46 1 18 ILE -7.40 -3.62 1 19 GLU -6.23 -2.26 1 20 ILE -1.24 -0.28 1 22 ASP 3.67 2.70 1 23 ALA -5.32 -2.45 1 24 ASP 2.59 1.41 1 25 ILE -2.07 -0.12 1 26 LYS 0.11 0.74 1 27 GLU -6.96 -1.76 1 29 VAL -2.82 -2.18 1 30 TYR 1.74 1.88 1 34 ALA 0.39 -0.81 1 35 THR 1.20 -0.21 1 37 GLU 3.87 3.24 1 38 GLN 2.40 2.18 1 39 LEU 1.99 0.93 1 40 ASN 2.20 1.86 1 41 ARG 3.63 2.09 1 43 VAL 4.02 1.09 1 44 SER -5.28 -0.72 1 45 PHE 2.99 1.56 1 46 ALA 3.58 3.02 1 47 GLU -5.85 -2.03 1 48 GLU 1.62 2.06 1 49 ASN 0.94 -0.78 1 50 GLU -0.54 -0.94 1 51 SER -4.30 -2.49 1 52 LEU 3.05 0.82 1 53 ASP -0.77 0.08 1 54 ASP 1.64 1.06 1 55 GLN 6.82 3.85 1 56 ASN -1.54 -1.98 1 57 ILE -0.22 -0.08 1 58 SER -1.15 -0.78 1 59 ILE -3.33 0.18 1 60 ALA -6.54 -2.78 1 62 HIS -1.71 1.51 1 63 THR -1.40 -2.98 1 64 PHE -4.60 -2.05 1 65 ILE 2.53 2.19 1 66 ASP 0.43 -0.20 1 67 ARG -2.47 -0.54 1 69 ASN 0.26 0.09 1 70 TYR -2.28 -0.38 1 71 GLN 7.81 3.59 1 73 THR 6.56 6.30 1 74 ASN -1.48 -0.77 1 75 LEU 3.79 2.45 1 76 LYS 2.98 1.43 1 77 ALA 0.22 0.53 1 78 ALA -0.64 -0.55 1 79 LYS -4.92 -2.16 1 80 LYS 5.16 3.58 1 82 SER 3.95 3.56 1 83 MET -0.83 -1.63 1 84 VAL -4.08 -1.43 1 85 TYR -4.03 -2.09 1 86 PHE -7.27 -4.00 1 87 LYS -2.12 -0.84 1 88 VAL -3.89 -2.84 1 90 ASN 0.26 0.03 1 91 GLU -3.45 -0.84 1 92 THR 1.13 0.92 1 93 ARG -1.76 0.04 1 94 LYS -3.49 -1.01 1 95 TYR -7.37 -2.67 1 96 LYS -5.29 -1.95 1 97 MET 2.13 1.72 1 98 THR -0.11 0.93 1 99 SER -1.00 -0.07 1 100 ILE -2.91 -0.10 1 101 ARG -4.08 -1.14 1 102 ASP -0.97 -0.01 1 103 VAL -1.80 0.38 1 106 THR -0.11 -1.13 1 107 ASP 2.45 0.83 1 108 VAL 2.20 1.08 1 109 GLU 2.72 1.46 1 110 VAL 2.91 1.67 1 111 LEU 0.44 -0.45 1 112 ASP 0.74 0.81 1 113 GLU -2.42 -0.68 1 114 GLN -0.98 -2.04 1 115 LYS 2.23 1.49 1 117 LYS -1.87 -1.13 1 118 ASP 0.10 0.63 1 119 LYS 2.00 1.86 1 120 GLN -6.74 -1.77 1 121 LEU -5.22 -2.36 1 122 THR 1.06 0.65 1 123 LEU -1.08 -2.32 1 124 ILE -4.46 -0.96 1 125 THR -2.72 -1.92 1 127 ASP -5.52 -1.29 1 128 ASP 2.39 0.75 1 129 TYR 4.05 1.36 1 130 ASN -1.53 -1.64 1 131 GLU 2.02 1.53 1 132 LYS 2.78 1.97 1 133 THR -0.52 -0.65 1 135 VAL -4.15 -1.93 1 136 TRP -0.01 -0.44 1 137 GLU 1.63 2.10 1 138 LYS -3.70 -0.94 1 139 ARG -6.18 -1.20 1 140 LYS -3.45 -0.69 1 141 ILE -4.11 -2.56 1 142 PHE -1.66 -1.84 1 143 VAL -1.50 -0.94 1 144 ALA -5.79 -2.65 1 145 THR -0.11 0.43 1 146 GLU 0.56 1.01 1 147 VAL -2.07 -1.19 1 148 LYS 0.76 1.35 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 4.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.80 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 -2.97 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 PHE -3.49 -1.87 0 10 ASP -1.26 0.25 1 11 LYS 3.24 -1.34 1 12 SER -0.73 0.96 1 13 LYS -2.21 0.72 1 14 VAL 1.99 -0.20 1 15 ALA -3.04 2.88 1 17 TYR -4.58 4.12 1 18 ILE -7.40 3.78 1 19 GLU -6.23 3.97 1 20 ILE -1.24 0.96 1 22 ASP 3.67 -0.97 1 23 ALA -5.32 2.87 1 24 ASP 2.59 -1.18 1 25 ILE -2.07 1.95 1 26 LYS 0.11 0.63 1 27 GLU -6.96 5.20 1 29 VAL -2.82 0.64 1 30 TYR 1.74 0.14 1 34 ALA 0.39 -1.20 1 35 THR 1.20 -1.41 1 37 GLU 3.87 -0.63 1 38 GLN 2.40 -0.22 1 39 LEU 1.99 -1.06 1 40 ASN 2.20 -0.34 1 41 ARG 3.63 -1.54 1 43 VAL 4.02 -2.93 1 44 SER -5.28 4.56 1 45 PHE 2.99 -1.43 1 46 ALA 3.58 -0.56 1 47 GLU -5.85 3.82 1 48 GLU 1.62 0.44 1 49 ASN 0.94 -1.72 1 50 GLU -0.54 -0.40 1 51 SER -4.30 1.81 1 52 LEU 3.05 -2.23 1 53 ASP -0.77 0.85 1 54 ASP 1.64 -0.58 1 55 GLN 6.82 -2.97 1 56 ASN -1.54 -0.44 1 57 ILE -0.22 0.14 1 58 SER -1.15 0.37 1 59 ILE -3.33 3.51 1 60 ALA -6.54 3.76 1 62 HIS -1.71 3.22 1 63 THR -1.40 -1.58 1 64 PHE -4.60 2.55 1 65 ILE 2.53 -0.34 1 66 ASP 0.43 -0.63 1 67 ARG -2.47 1.93 1 69 ASN 0.26 -0.17 1 70 TYR -2.28 1.90 1 71 GLN 7.81 -4.22 1 73 THR 6.56 -0.26 1 74 ASN -1.48 0.71 1 75 LEU 3.79 -1.34 1 76 LYS 2.98 -1.55 1 77 ALA 0.22 0.31 1 78 ALA -0.64 0.09 1 79 LYS -4.92 2.76 1 80 LYS 5.16 -1.58 1 82 SER 3.95 -0.39 1 83 MET -0.83 -0.80 1 84 VAL -4.08 2.65 1 85 TYR -4.03 1.94 1 86 PHE -7.27 3.27 1 87 LYS -2.12 1.28 1 88 VAL -3.89 1.05 1 90 ASN 0.26 -0.23 1 91 GLU -3.45 2.61 1 92 THR 1.13 -0.21 1 93 ARG -1.76 1.80 1 94 LYS -3.49 2.48 1 95 TYR -7.37 4.70 1 96 LYS -5.29 3.34 1 97 MET 2.13 -0.41 1 98 THR -0.11 1.04 1 99 SER -1.00 0.93 1 100 ILE -2.91 2.81 1 101 ARG -4.08 2.94 1 102 ASP -0.97 0.96 1 103 VAL -1.80 2.18 1 106 THR -0.11 -1.02 1 107 ASP 2.45 -1.62 1 108 VAL 2.20 -1.12 1 109 GLU 2.72 -1.26 1 110 VAL 2.91 -1.24 1 111 LEU 0.44 -0.89 1 112 ASP 0.74 0.07 1 113 GLU -2.42 1.74 1 114 GLN -0.98 -1.06 1 115 LYS 2.23 -0.74 1 117 LYS -1.87 0.74 1 118 ASP 0.10 0.53 1 119 LYS 2.00 -0.14 1 120 GLN -6.74 4.97 1 121 LEU -5.22 2.86 1 122 THR 1.06 -0.41 1 123 LEU -1.08 -1.24 1 124 ILE -4.46 3.50 1 125 THR -2.72 0.80 1 127 ASP -5.52 4.23 1 128 ASP 2.39 -1.64 1 129 TYR 4.05 -2.69 1 130 ASN -1.53 -0.11 1 131 GLU 2.02 -0.49 1 132 LYS 2.78 -0.81 1 133 THR -0.52 -0.13 1 135 VAL -4.15 2.22 1 136 TRP -0.01 -0.43 1 137 GLU 1.63 0.47 1 138 LYS -3.70 2.76 1 139 ARG -6.18 4.98 1 140 LYS -3.45 2.76 1 141 ILE -4.11 1.55 1 142 PHE -1.66 -0.18 1 143 VAL -1.50 0.56 1 144 ALA -5.79 3.14 1 145 THR -0.11 0.54 1 146 GLU 0.56 0.45 1 147 VAL -2.07 0.88 1 148 LYS 0.76 0.59 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 0.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.29 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 -0.74 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 SER -1.15 1.34 0 14 VAL 1.99 -1.22 0 10 ASP -1.26 -0.04 1 11 LYS 3.24 -0.41 1 12 SER -0.73 -0.17 1 13 LYS -2.21 0.20 1 15 ALA -3.04 0.08 1 17 TYR -4.58 0.74 1 18 ILE -7.40 1.41 1 19 GLU -6.23 1.13 1 20 ILE -1.24 0.55 1 22 ASP 3.67 -0.21 1 23 ALA -5.32 0.19 1 24 ASP 2.59 -0.32 1 25 ILE -2.07 0.24 1 26 LYS 0.11 0.75 1 27 GLU -6.96 0.61 1 29 VAL -2.82 0.10 1 30 TYR 1.74 -0.18 1 34 ALA 0.39 -0.04 1 35 THR 1.20 0.06 1 37 GLU 3.87 -0.36 1 38 GLN 2.40 0.07 1 39 LEU 1.99 0.33 1 40 ASN 2.20 -0.11 1 41 ARG 3.63 -0.38 1 43 VAL 4.02 -0.38 1 44 SER -5.28 1.00 1 45 PHE 2.99 0.22 1 46 ALA 3.58 -0.47 1 47 GLU -5.85 0.29 1 48 GLU 1.62 -0.75 1 49 ASN 0.94 0.07 1 50 GLU -0.54 -0.10 1 51 SER -4.30 0.24 1 52 LEU 3.05 -0.05 1 53 ASP -0.77 0.23 1 54 ASP 1.64 -0.25 1 55 GLN 6.82 -0.35 1 56 ASN -1.54 0.35 1 57 ILE -0.22 0.11 1 59 ILE -3.33 0.09 1 60 ALA -6.54 1.31 1 62 HIS -1.71 -0.08 1 63 THR -1.40 0.44 1 64 PHE -4.60 0.49 1 65 ILE 2.53 -0.17 1 66 ASP 0.43 -0.03 1 67 ARG -2.47 0.21 1 69 ASN 0.26 0.13 1 70 TYR -2.28 0.12 1 71 GLN 7.81 -1.32 1 72 PHE -3.49 0.44 1 73 THR 6.56 -0.17 1 74 ASN -1.48 0.34 1 75 LEU 3.79 -0.88 1 76 LYS 2.98 -0.02 1 77 ALA 0.22 -0.06 1 78 ALA -0.64 -0.23 1 79 LYS -4.92 0.26 1 80 LYS 5.16 -0.72 1 82 SER 3.95 -0.18 1 83 MET -0.83 0.64 1 84 VAL -4.08 0.32 1 85 TYR -4.03 1.14 1 86 PHE -7.27 1.38 1 87 LYS -2.12 0.84 1 88 VAL -3.89 0.25 1 90 ASN 0.26 0.05 1 91 GLU -3.45 0.26 1 92 THR 1.13 0.31 1 93 ARG -1.76 0.17 1 94 LYS -3.49 0.80 1 95 TYR -7.37 0.52 1 96 LYS -5.29 0.79 1 97 MET 2.13 0.09 1 98 THR -0.11 0.22 1 99 SER -1.00 0.16 1 100 ILE -2.91 0.53 1 101 ARG -4.08 0.37 1 102 ASP -0.97 0.62 1 103 VAL -1.80 0.31 1 106 THR -0.11 -0.09 1 107 ASP 2.45 0.32 1 108 VAL 2.20 -0.17 1 109 GLU 2.72 -0.09 1 110 VAL 2.91 -0.23 1 111 LEU 0.44 -0.13 1 112 ASP 0.74 -0.08 1 113 GLU -2.42 0.29 1 114 GLN -0.98 0.02 1 115 LYS 2.23 -0.30 1 117 LYS -1.87 0.16 1 118 ASP 0.10 -0.06 1 119 LYS 2.00 0.33 1 120 GLN -6.74 1.41 1 121 LEU -5.22 0.93 1 122 THR 1.06 0.20 1 123 LEU -1.08 0.96 1 124 ILE -4.46 0.82 1 125 THR -2.72 0.82 1 127 ASP -5.52 0.69 1 128 ASP 2.39 -0.28 1 129 TYR 4.05 -0.80 1 130 ASN -1.53 -0.25 1 131 GLU 2.02 -0.66 1 132 LYS 2.78 -0.19 1 133 THR -0.52 -0.09 1 135 VAL -4.15 0.13 1 136 TRP -0.01 -0.22 1 137 GLU 1.63 -0.10 1 138 LYS -3.70 0.59 1 139 ARG -6.18 0.92 1 140 LYS -3.45 0.61 1 141 ILE -4.11 1.21 1 142 PHE -1.66 0.28 1 143 VAL -1.50 0.78 1 144 ALA -5.79 0.99 1 145 THR -0.11 0.63 1 146 GLU 0.56 -0.20 1 147 VAL -2.07 0.13 1 148 LYS 0.76 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19826_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -1.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _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 7.80 _LACS_plot.Line_2_terminator_val_y_2 0.57 _LACS_plot.Y_axis_chem_shift_offset 0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 ILE -7.40 -3.54 0 55 GLN 6.82 -0.72 0 59 ILE -3.33 -3.98 0 38 GLN 2.40 2.92 0 71 GLN 7.81 -0.55 0 10 ASP -1.26 0.35 1 11 LYS 3.24 -0.83 1 12 SER -0.73 -0.52 1 13 LYS -2.21 -2.55 1 14 VAL 1.99 0.42 1 15 ALA -3.04 -0.84 1 17 TYR -4.58 -1.53 1 19 GLU -6.23 -0.69 1 22 ASP 3.67 -0.38 1 23 ALA -5.32 -1.95 1 24 ASP 2.59 -1.69 1 25 ILE -2.07 0.14 1 26 LYS 0.11 -1.59 1 29 VAL -2.82 -1.37 1 34 ALA 0.39 -1.28 1 37 GLU 3.87 2.30 1 39 LEU 1.99 1.12 1 40 ASN 2.20 2.48 1 41 ARG 3.63 0.52 1 43 VAL 4.02 -0.99 1 44 SER -5.28 -0.77 1 45 PHE 2.99 -0.42 1 46 ALA 3.58 2.16 1 47 GLU -5.85 0.01 1 48 GLU 1.62 -0.34 1 49 ASN 0.94 -0.67 1 50 GLU -0.54 -2.95 1 51 SER -4.30 0.32 1 52 LEU 3.05 -0.42 1 53 ASP -0.77 -0.29 1 54 ASP 1.64 0.37 1 56 ASN -1.54 -0.14 1 57 ILE -0.22 -2.04 1 58 SER -1.15 0.22 1 60 ALA -6.54 -3.33 1 62 HIS -1.71 0.93 1 63 THR -1.40 -1.91 1 64 PHE -4.60 0.16 1 65 ILE 2.53 -0.27 1 66 ASP 0.43 -0.57 1 67 ARG -2.47 -1.79 1 69 ASN 0.26 -0.69 1 70 TYR -2.28 -0.52 1 72 PHE -3.49 0.75 1 73 THR 6.56 1.01 1 74 ASN -1.48 1.49 1 75 LEU 3.79 -1.51 1 76 LYS 2.98 -0.82 1 77 ALA 0.22 0.68 1 78 ALA -0.64 -3.02 1 79 LYS -4.92 -0.04 1 80 LYS 5.16 1.11 1 82 SER 3.95 -0.61 1 83 MET -0.83 -0.10 1 84 VAL -4.08 -2.57 1 85 TYR -4.03 -1.11 1 86 PHE -7.27 -2.27 1 87 LYS -2.12 -1.56 1 88 VAL -3.89 -0.53 1 90 ASN 0.26 -0.24 1 91 GLU -3.45 -0.86 1 92 THR 1.13 -0.55 1 93 ARG -1.76 -1.77 1 94 LYS -3.49 -1.92 1 95 TYR -7.37 -2.56 1 96 LYS -5.29 0.20 1 97 MET 2.13 -0.21 1 98 THR -0.11 -0.85 1 100 ILE -2.91 -0.58 1 101 ARG -4.08 -2.73 1 102 ASP -0.97 -0.39 1 106 THR -0.11 0.34 1 107 ASP 2.45 0.36 1 108 VAL 2.20 1.19 1 109 GLU 2.72 -0.46 1 110 VAL 2.91 0.57 1 111 LEU 0.44 0.51 1 112 ASP 0.74 0.74 1 113 GLU -2.42 0.65 1 114 GLN -0.98 -0.78 1 117 LYS -1.87 -0.32 1 118 ASP 0.10 0.27 1 119 LYS 2.00 -0.76 1 120 GLN -6.74 -1.56 1 121 LEU -5.22 -1.11 1 122 THR 1.06 -1.35 1 123 LEU -1.08 -1.72 1 124 ILE -4.46 0.74 1 125 THR -2.72 -0.15 1 127 ASP -5.52 -1.77 1 128 ASP 2.39 -1.48 1 129 TYR 4.05 -0.58 1 130 ASN -1.53 -0.38 1 131 GLU 2.02 1.11 1 132 LYS 2.78 1.84 1 133 THR -0.52 1.73 1 135 VAL -4.15 -1.45 1 136 TRP -0.01 -0.19 1 137 GLU 1.63 -0.76 1 138 LYS -3.70 0.92 1 139 ARG -6.18 -1.08 1 140 LYS -3.45 -1.84 1 141 ILE -4.11 -2.49 1 142 PHE -1.66 -1.12 1 143 VAL -1.50 -1.52 1 144 ALA -5.79 -2.19 1 145 THR -0.11 0.06 1 146 GLU 0.56 -0.97 1 147 VAL -2.07 -1.65 1 148 LYS 0.76 0.58 1 stop_ save_