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 bmr26909_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.56 _LACS_plot.Line_1_terminator_val_y_1 -2.04 _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 -1.60 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 5.19 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 GLN -6.08 -1.13 0 63 ASP -0.49 -2.60 0 58 ILE 0.84 -1.97 0 54 HIS -4.84 0.20 0 10 GLU 4.44 2.41 1 11 GLN -1.17 0.43 1 12 LEU 3.15 3.33 1 13 ARG 6.77 4.47 1 14 ALA 3.39 2.31 1 15 GLN 5.57 4.21 1 16 LEU 2.95 2.55 1 17 ASN 1.90 1.76 1 18 GLU 1.42 1.28 1 20 LEU -0.20 0.29 1 21 ARG -0.47 -1.19 1 22 ALA 1.05 1.85 1 23 ALA -5.72 -2.28 1 24 TYR -3.94 -0.55 1 25 LEU -1.15 -1.54 1 26 LEU 0.29 -1.60 1 27 LEU -5.66 -3.24 1 29 ASN -0.93 -0.88 1 30 ASP -2.61 -0.85 1 32 LEU 4.11 2.77 1 33 LEU 2.64 2.20 1 34 LEU 3.07 3.58 1 35 GLN 3.87 2.95 1 36 GLU 3.00 2.96 1 37 SER 4.44 4.06 1 38 GLN 4.06 4.42 1 39 ASP 4.21 2.85 1 40 ALA 4.45 3.18 1 41 VAL 5.77 4.39 1 42 ARG 6.07 4.67 1 43 GLN 4.55 3.61 1 44 VAL 6.04 4.39 1 45 ALA 4.76 2.85 1 46 ALA 3.83 2.73 1 47 ALA 2.63 1.70 1 48 GLN -0.00 -0.76 1 50 PHE 1.61 -0.84 1 51 GLU -1.62 0.35 1 52 GLU -3.35 -1.13 1 53 HIS -4.12 0.09 1 55 THR -1.51 0.05 1 56 PHE -3.91 -0.73 1 57 SER 0.52 -0.19 1 59 ASP 1.31 1.16 1 61 ASN -1.36 -0.67 1 62 THR 3.23 3.94 1 64 TRP 4.64 3.11 1 65 ASN 4.73 3.70 1 66 ALA 3.49 2.23 1 67 ILE 5.85 4.35 1 68 PHE 3.10 0.26 1 69 SER 4.81 3.86 1 70 LEU 3.26 2.58 1 72 GLN -0.10 0.53 1 73 ALA 1.21 0.84 1 74 MET 1.25 0.80 1 75 SER 0.91 0.56 1 76 LEU 3.99 3.70 1 77 PHE -0.51 -0.62 1 78 ALA 4.54 4.54 1 79 SER -1.21 -0.57 1 80 ARG 0.61 0.34 1 82 THR -2.36 -1.42 1 83 LEU -5.05 -1.48 1 84 LEU -3.60 -1.72 1 85 LEU -3.71 -2.50 1 86 LEU -1.02 -2.06 1 87 LEU 0.94 0.59 1 89 GLU 3.38 3.21 1 90 ASN 1.28 0.41 1 93 ASN -2.57 -2.14 1 94 ALA 5.01 3.80 1 95 ALA 3.60 2.66 1 96 ILE 3.79 3.87 1 97 ASN 4.53 2.98 1 98 GLU 3.37 2.98 1 99 GLN 6.03 1.73 1 100 LEU 3.51 2.12 1 101 LEU 4.90 3.31 1 102 THR 6.65 4.56 1 103 LEU 3.94 3.70 1 104 THR 5.02 4.67 1 106 LEU -1.67 -0.91 1 107 LEU 2.16 1.25 1 108 HIS -4.18 -0.38 1 109 ASP 3.25 3.23 1 110 ASP -0.02 0.45 1 111 LEU -4.09 -1.62 1 112 LEU -2.61 -0.42 1 113 LEU -3.60 -1.17 1 114 ILE -3.00 -1.21 1 115 VAL -3.12 -1.46 1 116 ARG -6.56 -2.58 1 118 ASN -1.06 -0.12 1 119 LYS 1.85 1.77 1 120 LEU -0.93 -0.95 1 121 SER -2.27 -1.43 1 122 LYS 4.63 2.97 1 123 ALA 3.30 2.39 1 124 GLN 3.18 2.68 1 125 GLU 1.63 0.79 1 126 ASN -1.02 -0.60 1 127 ALA -1.44 -0.02 1 128 ALA 2.79 2.65 1 129 TRP 5.22 2.07 1 130 PHE 3.94 3.28 1 131 THR 5.20 3.64 1 132 ALA 2.97 2.03 1 133 LEU -0.63 -0.48 1 134 ALA 4.43 3.96 1 135 ASN 2.09 1.10 1 136 ARG -1.67 -0.98 1 137 SER -4.24 -0.96 1 138 VAL -3.43 -1.65 1 139 GLN -3.49 -1.77 1 140 VAL -2.20 -2.31 1 141 THR 0.92 -0.01 1 143 GLN -0.32 1.63 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26909_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.56 _LACS_plot.Line_1_terminator_val_y_1 4.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.40 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 GLN -6.08 4.95 0 63 ASP -0.49 -2.11 0 58 ILE 0.84 -2.81 0 54 HIS -4.84 5.04 0 10 GLU 4.44 -2.03 1 11 GLN -1.17 1.60 1 12 LEU 3.15 0.18 1 13 ARG 6.77 -2.30 1 14 ALA 3.39 -1.08 1 15 GLN 5.57 -1.36 1 16 LEU 2.95 -0.40 1 17 ASN 1.90 -0.14 1 18 GLU 1.42 -0.14 1 20 LEU -0.20 0.49 1 21 ARG -0.47 -0.72 1 22 ALA 1.05 0.80 1 23 ALA -5.72 3.44 1 24 TYR -3.94 3.39 1 25 LEU -1.15 -0.39 1 26 LEU 0.29 -1.89 1 27 LEU -5.66 2.42 1 29 ASN -0.93 0.05 1 30 ASP -2.61 1.76 1 32 LEU 4.11 -1.34 1 33 LEU 2.64 -0.44 1 34 LEU 3.07 0.51 1 35 GLN 3.87 -0.92 1 36 GLU 3.00 -0.04 1 37 SER 4.44 -0.38 1 38 GLN 4.06 0.36 1 39 ASP 4.21 -1.36 1 40 ALA 4.45 -1.27 1 41 VAL 5.77 -1.38 1 42 ARG 6.07 -1.40 1 43 GLN 4.55 -0.94 1 44 VAL 6.04 -1.65 1 45 ALA 4.76 -1.91 1 46 ALA 3.83 -1.10 1 47 ALA 2.63 -0.93 1 48 GLN -0.00 -0.76 1 50 PHE 1.61 -2.45 1 51 GLU -1.62 1.97 1 52 GLU -3.35 2.22 1 53 HIS -4.12 4.21 1 55 THR -1.51 1.56 1 56 PHE -3.91 3.18 1 57 SER 0.52 -0.71 1 59 ASP 1.31 -0.15 1 61 ASN -1.36 0.69 1 62 THR 3.23 0.71 1 64 TRP 4.64 -1.53 1 65 ASN 4.73 -1.03 1 66 ALA 3.49 -1.26 1 67 ILE 5.85 -1.50 1 68 PHE 3.10 -2.84 1 69 SER 4.81 -0.95 1 70 LEU 3.26 -0.68 1 72 GLN -0.10 0.63 1 73 ALA 1.21 -0.37 1 74 MET 1.25 -0.45 1 75 SER 0.91 -0.35 1 76 LEU 3.99 -0.29 1 77 PHE -0.51 -0.11 1 78 ALA 4.54 0.00 1 79 SER -1.21 0.64 1 80 ARG 0.61 -0.27 1 82 THR -2.36 0.94 1 83 LEU -5.05 3.57 1 84 LEU -3.60 1.88 1 85 LEU -3.71 1.21 1 86 LEU -1.02 -1.04 1 87 LEU 0.94 -0.35 1 89 GLU 3.38 -0.17 1 90 ASN 1.28 -0.87 1 93 ASN -2.57 0.43 1 94 ALA 5.01 -1.21 1 95 ALA 3.60 -0.94 1 96 ILE 3.79 0.08 1 97 ASN 4.53 -1.55 1 98 GLU 3.37 -0.39 1 99 GLN 6.03 -4.30 1 100 LEU 3.51 -1.39 1 101 LEU 4.90 -1.59 1 102 THR 6.65 -2.09 1 103 LEU 3.94 -0.24 1 104 THR 5.02 -0.35 1 106 LEU -1.67 0.76 1 107 LEU 2.16 -0.91 1 108 HIS -4.18 3.80 1 109 ASP 3.25 -0.02 1 110 ASP -0.02 0.47 1 111 LEU -4.09 2.47 1 112 LEU -2.61 2.19 1 113 LEU -3.60 2.43 1 114 ILE -3.00 1.79 1 115 VAL -3.12 1.66 1 116 ARG -6.56 3.98 1 118 ASN -1.06 0.94 1 119 LYS 1.85 -0.08 1 120 LEU -0.93 -0.02 1 121 SER -2.27 0.84 1 122 LYS 4.63 -1.66 1 123 ALA 3.30 -0.91 1 124 GLN 3.18 -0.50 1 125 GLU 1.63 -0.84 1 126 ASN -1.02 0.42 1 127 ALA -1.44 1.42 1 128 ALA 2.79 -0.14 1 129 TRP 5.22 -3.15 1 130 PHE 3.94 -0.66 1 131 THR 5.20 -1.56 1 132 ALA 2.97 -0.94 1 133 LEU -0.63 0.15 1 134 ALA 4.43 -0.47 1 135 ASN 2.09 -0.99 1 136 ARG -1.67 0.69 1 137 SER -4.24 3.28 1 138 VAL -3.43 1.78 1 139 GLN -3.49 1.72 1 140 VAL -2.20 -0.11 1 141 THR 0.92 -0.93 1 143 GLN -0.32 1.95 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26909_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.56 _LACS_plot.Line_1_terminator_val_y_1 1.04 _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 0.37 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _LACS_plot.Y_axis_chem_shift_offset -0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 PHE 3.94 -1.78 0 125 GLU 1.63 -1.54 0 10 GLU 4.44 -0.02 1 11 GLN -1.17 0.30 1 12 LEU 3.15 -0.25 1 13 ARG 6.77 -0.56 1 14 ALA 3.39 -0.21 1 15 GLN 5.57 -0.30 1 16 LEU 2.95 -0.49 1 17 ASN 1.90 -0.35 1 18 GLU 1.42 -0.12 1 20 LEU -0.20 0.32 1 21 ARG -0.47 0.16 1 22 ALA 1.05 -0.09 1 23 ALA -5.72 1.46 1 24 TYR -3.94 0.33 1 25 LEU -1.15 0.75 1 26 LEU 0.29 0.47 1 27 LEU -5.66 1.41 1 29 ASN -0.93 0.17 1 30 ASP -2.61 0.25 1 32 LEU 4.11 -0.14 1 33 LEU 2.64 -0.20 1 34 LEU 3.07 -0.23 1 35 GLN 3.87 -0.78 1 36 GLU 3.00 -0.30 1 37 SER 4.44 -0.30 1 38 GLN 4.06 -0.87 1 39 ASP 4.21 -0.36 1 40 ALA 4.45 -0.32 1 41 VAL 5.77 -0.96 1 42 ARG 6.07 -0.70 1 43 GLN 4.55 -0.32 1 44 VAL 6.04 -0.37 1 45 ALA 4.76 -0.36 1 46 ALA 3.83 0.06 1 47 ALA 2.63 -0.02 1 48 GLN -0.00 0.25 1 50 PHE 1.61 -0.23 1 51 GLU -1.62 0.04 1 52 GLU -3.35 0.02 1 53 HIS -4.12 0.60 1 54 HIS -4.84 -0.01 1 55 THR -1.51 1.01 1 56 PHE -3.91 0.04 1 57 SER 0.52 0.16 1 58 ILE 0.84 0.05 1 59 ASP 1.31 -0.29 1 61 ASN -1.36 0.19 1 62 THR 3.23 -0.77 1 63 ASP -0.49 0.07 1 64 TRP 4.64 -1.29 1 65 ASN 4.73 -0.36 1 66 ALA 3.49 -0.31 1 67 ILE 5.85 -1.19 1 68 PHE 3.10 -0.12 1 69 SER 4.81 -0.22 1 70 LEU 3.26 -0.17 1 72 GLN -0.10 0.03 1 73 ALA 1.21 -0.13 1 74 MET 1.25 -0.09 1 75 SER 0.91 -0.13 1 76 LEU 3.99 -0.21 1 77 PHE -0.51 0.04 1 78 ALA 4.54 0.03 1 79 SER -1.21 0.08 1 80 ARG 0.61 0.48 1 81 GLN -6.08 1.25 1 82 THR -2.36 1.09 1 83 LEU -5.05 0.71 1 84 LEU -3.60 1.36 1 85 LEU -3.71 0.99 1 86 LEU -1.02 0.68 1 87 LEU 0.94 -0.37 1 89 GLU 3.38 -0.30 1 90 ASN 1.28 0.11 1 93 ASN -2.57 0.08 1 94 ALA 5.01 -0.16 1 95 ALA 3.60 -0.18 1 96 ILE 3.79 -0.71 1 97 ASN 4.53 -0.35 1 98 GLU 3.37 -0.35 1 99 GLN 6.03 -0.32 1 100 LEU 3.51 -0.53 1 101 LEU 4.90 -0.24 1 102 THR 6.65 -0.75 1 103 LEU 3.94 -0.39 1 104 THR 5.02 -0.48 1 106 LEU -1.67 0.14 1 107 LEU 2.16 -0.36 1 108 HIS -4.18 0.16 1 109 ASP 3.25 -0.13 1 110 ASP -0.02 0.45 1 111 LEU -4.09 1.08 1 112 LEU -2.61 0.27 1 113 LEU -3.60 0.80 1 114 ILE -3.00 1.15 1 115 VAL -3.12 0.80 1 116 ARG -6.56 1.64 1 118 ASN -1.06 0.01 1 119 LYS 1.85 -0.53 1 120 LEU -0.93 0.13 1 121 SER -2.27 -0.08 1 122 LYS 4.63 -0.46 1 123 ALA 3.30 -0.29 1 124 GLN 3.18 -0.28 1 126 ASN -1.02 -0.19 1 127 ALA -1.44 -0.11 1 128 ALA 2.79 -0.26 1 129 TRP 5.22 -0.57 1 131 THR 5.20 -0.56 1 132 ALA 2.97 -0.22 1 133 LEU -0.63 -0.17 1 134 ALA 4.43 -0.72 1 135 ASN 2.09 -0.25 1 136 ARG -1.67 0.37 1 137 SER -4.24 0.96 1 138 VAL -3.43 0.28 1 139 GLN -3.49 0.95 1 140 VAL -2.20 0.65 1 141 THR 0.92 0.31 1 143 GLN -0.32 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26909_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.56 _LACS_plot.Line_1_terminator_val_y_1 -2.96 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 6.76 _LACS_plot.Line_2_terminator_val_y_2 2.80 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 LEU -5.05 -5.21 0 129 TRP 5.22 -1.78 0 108 HIS -4.18 1.67 0 26 LEU 0.29 -4.53 0 10 GLU 4.44 0.64 1 11 GLN -1.17 0.93 1 12 LEU 3.15 -0.17 1 13 ARG 6.77 1.73 1 14 ALA 3.39 2.54 1 15 GLN 5.57 2.63 1 16 LEU 2.95 1.46 1 17 ASN 1.90 1.61 1 18 GLU 1.42 0.79 1 20 LEU -0.20 1.31 1 21 ARG -0.47 -2.10 1 22 ALA 1.05 -0.11 1 23 ALA -5.72 -3.09 1 24 TYR -3.94 -2.20 1 25 LEU -1.15 -3.71 1 27 LEU -5.66 -0.26 1 29 ASN -0.93 0.59 1 30 ASP -2.61 -0.55 1 32 LEU 4.11 1.85 1 33 LEU 2.64 3.52 1 34 LEU 3.07 0.45 1 35 GLN 3.87 1.66 1 36 GLU 3.00 3.73 1 37 SER 4.44 -0.48 1 38 GLN 4.06 1.37 1 39 ASP 4.21 2.14 1 40 ALA 4.45 1.41 1 41 VAL 5.77 1.48 1 42 ARG 6.07 2.06 1 43 GLN 4.55 3.41 1 44 VAL 6.04 1.92 1 45 ALA 4.76 3.09 1 46 ALA 3.83 3.14 1 47 ALA 2.63 0.94 1 48 GLN -0.00 -0.36 1 50 PHE 1.61 -1.10 1 51 GLU -1.62 -1.08 1 52 GLU -3.35 -2.93 1 53 HIS -4.12 0.85 1 54 HIS -4.84 0.66 1 55 THR -1.51 -1.56 1 56 PHE -3.91 -1.27 1 57 SER 0.52 -0.70 1 58 ILE 0.84 -3.00 1 59 ASP 1.31 0.08 1 61 ASN -1.36 0.22 1 62 THR 3.23 -1.58 1 63 ASP -0.49 -0.56 1 64 TRP 4.64 0.82 1 65 ASN 4.73 3.04 1 66 ALA 3.49 2.17 1 67 ILE 5.85 1.62 1 68 PHE 3.10 4.20 1 69 SER 4.81 2.37 1 70 LEU 3.26 1.40 1 72 GLN -0.10 -0.08 1 73 ALA 1.21 0.26 1 74 MET 1.25 0.43 1 75 SER 0.91 0.44 1 76 LEU 3.99 -0.30 1 77 PHE -0.51 -0.73 1 78 ALA 4.54 -0.88 1 79 SER -1.21 -0.69 1 80 ARG 0.61 -0.18 1 81 GLN -6.08 -0.57 1 82 THR -2.36 -1.62 1 84 LEU -3.60 -3.23 1 85 LEU -3.71 -2.56 1 86 LEU -1.02 -1.07 1 87 LEU 0.94 -1.43 1 89 GLU 3.38 0.62 1 90 ASN 1.28 0.53 1 93 ASN -2.57 -0.43 1 94 ALA 5.01 1.98 1 95 ALA 3.60 3.11 1 96 ILE 3.79 0.97 1 97 ASN 4.53 4.33 1 98 GLU 3.37 1.80 1 99 GLN 6.03 2.84 1 100 LEU 3.51 1.80 1 101 LEU 4.90 2.95 1 102 THR 6.65 2.18 1 103 LEU 3.94 1.29 1 104 THR 5.02 1.67 1 106 LEU -1.67 -0.67 1 107 LEU 2.16 -2.36 1 109 ASP 3.25 0.84 1 110 ASP -0.02 -3.02 1 111 LEU -4.09 -3.64 1 112 LEU -2.61 -3.40 1 113 LEU -3.60 -3.55 1 114 ILE -3.00 -2.03 1 115 VAL -3.12 -2.77 1 116 ARG -6.56 -1.51 1 118 ASN -1.06 -0.63 1 119 LYS 1.85 0.41 1 120 LEU -0.93 0.12 1 121 SER -2.27 0.03 1 122 LYS 4.63 2.50 1 123 ALA 3.30 3.94 1 124 GLN 3.18 2.78 1 125 GLU 1.63 -1.37 1 126 ASN -1.02 0.06 1 127 ALA -1.44 -0.07 1 128 ALA 2.79 2.78 1 130 PHE 3.94 2.70 1 131 THR 5.20 2.92 1 132 ALA 2.97 1.74 1 133 LEU -0.63 1.55 1 134 ALA 4.43 -0.05 1 135 ASN 2.09 0.35 1 136 ARG -1.67 -2.25 1 137 SER -4.24 -1.13 1 138 VAL -3.43 -2.36 1 139 GLN -3.49 -2.10 1 140 VAL -2.20 -0.37 1 141 THR 0.92 -0.08 1 143 GLN -0.32 3.29 1 stop_ save_