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 bmr5602_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 4.74 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 10 ARG -6.06 -0.94 0 22 ILE -8.85 -5.09 0 17 ASP -1.29 -2.60 0 116 GLU -5.87 -0.47 0 11 ALA -5.09 -2.05 1 12 VAL -2.53 -0.95 1 13 ALA -6.50 -1.68 1 14 LEU -0.14 0.03 1 15 ILE -1.27 -0.51 1 16 TYR -4.79 -1.86 1 18 ASP 1.95 1.12 1 19 GLN -1.06 -1.13 1 20 HIS 3.65 1.83 1 21 HIS -2.05 -0.02 1 23 LEU 1.65 0.20 1 24 LEU -6.85 -2.82 1 25 MET -2.12 -2.78 1 26 LEU 1.73 0.50 1 27 ARG -4.19 -1.20 1 28 HIS -3.25 -0.23 1 29 LYS -1.03 -0.14 1 30 ASN 2.27 1.32 1 32 LYS -2.85 -1.15 1 33 LYS -1.52 -0.24 1 34 TYR -1.61 -1.06 1 35 ALA -7.32 -2.69 1 36 THR -6.03 -2.68 1 37 LEU 0.96 0.69 1 42 ILE -0.79 -0.45 1 43 GLU -1.59 -0.94 1 44 GLU 2.67 2.02 1 46 GLU -3.96 -1.31 1 47 THR 0.01 -0.72 1 49 GLN 6.72 4.32 1 51 ALA 0.61 2.67 1 53 ALA 3.90 2.81 1 54 ARG 5.37 3.68 1 55 GLU 4.55 2.42 1 56 VAL 6.11 5.21 1 57 LEU 3.95 3.63 1 58 GLU 2.45 2.82 1 59 GLU 1.51 2.56 1 60 VAL -2.56 -1.84 1 61 ASN 1.45 2.03 1 62 LEU -4.73 -2.05 1 63 THR 2.49 1.37 1 64 VAL -6.71 -4.44 1 65 GLN -1.85 -1.25 1 66 VAL 2.72 1.55 1 68 GLU -0.58 0.22 1 69 GLN -0.88 0.20 1 70 VAL -0.80 -0.80 1 71 LEU -2.27 0.55 1 72 GLU -4.37 -1.22 1 73 LEU -5.65 -1.14 1 74 ASP -0.28 -0.06 1 75 ASN -1.05 -1.05 1 76 LEU 0.43 -0.08 1 77 HIS -0.49 1.50 1 79 ALA 1.03 1.22 1 80 ASN -1.88 -0.53 1 82 SER -3.93 -0.71 1 83 HIS -0.91 0.35 1 84 GLU -5.55 -1.39 1 85 HIS 0.09 1.81 1 86 TYR -2.75 -1.10 1 87 PHE -4.45 -0.65 1 88 ARG 0.39 0.38 1 90 ARG -4.77 -1.56 1 91 VAL 3.03 2.94 1 92 VAL 0.43 1.28 1 93 SER -0.95 0.03 1 95 GLU -3.46 -1.72 1 96 MET 1.60 1.78 1 97 ARG -0.05 0.19 1 98 LEU -0.23 0.22 1 100 ASP -0.28 0.43 1 103 GLU 0.96 0.80 1 105 ILE 0.07 0.12 1 106 ARG 0.73 0.22 1 107 GLN 0.48 0.92 1 108 SER -1.28 -0.17 1 109 GLU 1.71 1.73 1 110 ASP 0.43 0.83 1 111 ASN -0.52 0.00 1 113 TYR -4.18 -1.55 1 117 TRP -0.68 -1.53 1 118 VAL -2.05 0.01 1 119 ALA -0.29 0.04 1 120 LEU 4.18 2.89 1 121 ASN 2.40 0.84 1 122 ARG 0.49 0.70 1 123 LEU 4.98 3.36 1 124 GLU 5.75 3.85 1 125 GLU 3.07 2.90 1 126 VAL 0.26 -0.96 1 127 ASN 2.49 0.40 1 128 LEU 0.98 0.91 1 129 VAL -2.60 -1.57 1 131 GLU 5.32 4.39 1 132 GLN 4.04 3.21 1 133 VAL 1.22 0.42 1 134 ARG 5.68 4.32 1 135 GLU 2.91 2.22 1 136 LEU 3.31 3.06 1 137 VAL 3.46 2.54 1 138 ARG 4.03 3.59 1 139 THR 1.58 1.90 1 140 GLN 1.04 -0.06 1 141 GLU 0.88 0.82 1 142 VAL 0.04 -0.22 1 143 ASN -1.85 -1.82 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5602_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 5.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 -1.98 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 10 ARG -6.06 5.12 0 22 ILE -8.85 3.76 0 17 ASP -1.29 -1.31 0 116 GLU -5.87 5.40 0 11 ALA -5.09 3.04 1 12 VAL -2.53 1.58 1 13 ALA -6.50 4.82 1 14 LEU -0.14 0.17 1 15 ILE -1.27 0.76 1 16 TYR -4.79 2.93 1 18 ASP 1.95 -0.83 1 19 GLN -1.06 -0.07 1 20 HIS 3.65 -1.82 1 21 HIS -2.05 2.03 1 23 LEU 1.65 -1.45 1 24 LEU -6.85 4.03 1 25 MET -2.12 -0.66 1 26 LEU 1.73 -1.23 1 27 ARG -4.19 2.99 1 28 HIS -3.25 3.02 1 29 LYS -1.03 0.89 1 30 ASN 2.27 -0.95 1 32 LYS -2.85 1.70 1 33 LYS -1.52 1.28 1 34 TYR -1.61 0.55 1 35 ALA -7.32 4.63 1 36 THR -6.03 3.35 1 37 LEU 0.96 -0.27 1 42 ILE -0.79 0.34 1 43 GLU -1.59 0.65 1 44 GLU 2.67 -0.65 1 46 GLU -3.96 2.65 1 47 THR 0.01 -0.73 1 49 GLN 6.72 -2.40 1 51 ALA 0.61 2.06 1 53 ALA 3.90 -1.09 1 54 ARG 5.37 -1.69 1 55 GLU 4.55 -2.13 1 56 VAL 6.11 -0.90 1 57 LEU 3.95 -0.32 1 58 GLU 2.45 0.37 1 59 GLU 1.51 1.05 1 60 VAL -2.56 0.72 1 61 ASN 1.45 0.58 1 62 LEU -4.73 2.68 1 63 THR 2.49 -1.12 1 64 VAL -6.71 2.27 1 65 GLN -1.85 0.60 1 66 VAL 2.72 -1.17 1 68 GLU -0.58 0.80 1 69 GLN -0.88 1.08 1 70 VAL -0.80 0.00 1 71 LEU -2.27 2.82 1 72 GLU -4.37 3.15 1 73 LEU -5.65 4.51 1 74 ASP -0.28 0.22 1 75 ASN -1.05 0.00 1 76 LEU 0.43 -0.51 1 77 HIS -0.49 1.99 1 79 ALA 1.03 0.19 1 80 ASN -1.88 1.35 1 82 SER -3.93 3.22 1 83 HIS -0.91 1.26 1 84 GLU -5.55 4.16 1 85 HIS 0.09 1.72 1 86 TYR -2.75 1.65 1 87 PHE -4.45 3.80 1 88 ARG 0.39 -0.01 1 90 ARG -4.77 3.21 1 91 VAL 3.03 -0.09 1 92 VAL 0.43 0.85 1 93 SER -0.95 0.98 1 95 GLU -3.46 1.74 1 96 MET 1.60 0.18 1 97 ARG -0.05 0.24 1 98 LEU -0.23 0.45 1 100 ASP -0.28 0.71 1 103 GLU 0.96 -0.16 1 105 ILE 0.07 0.05 1 106 ARG 0.73 -0.51 1 107 GLN 0.48 0.44 1 108 SER -1.28 1.11 1 109 GLU 1.71 0.02 1 110 ASP 0.43 0.40 1 111 ASN -0.52 0.52 1 113 TYR -4.18 2.63 1 117 TRP -0.68 -0.85 1 118 VAL -2.05 2.06 1 119 ALA -0.29 0.33 1 120 LEU 4.18 -1.29 1 121 ASN 2.40 -1.56 1 122 ARG 0.49 0.21 1 123 LEU 4.98 -1.62 1 124 GLU 5.75 -1.90 1 125 GLU 3.07 -0.17 1 126 VAL 0.26 -1.22 1 127 ASN 2.49 -2.09 1 128 LEU 0.98 -0.07 1 129 VAL -2.60 1.03 1 131 GLU 5.32 -0.93 1 132 GLN 4.04 -0.83 1 133 VAL 1.22 -0.80 1 134 ARG 5.68 -1.36 1 135 GLU 2.91 -0.69 1 136 LEU 3.31 -0.25 1 137 VAL 3.46 -0.92 1 138 ARG 4.03 -0.44 1 139 THR 1.58 0.32 1 140 GLN 1.04 -1.10 1 141 GLU 0.88 -0.06 1 142 VAL 0.04 -0.26 1 143 ASN -1.85 0.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5602_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 0.92 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 -0.71 _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 141 GLU 0.88 -1.03 0 49 GLN 6.72 -1.51 0 16 TYR -4.79 1.51 0 10 ARG -6.06 0.59 1 11 ALA -5.09 1.02 1 12 VAL -2.53 0.38 1 13 ALA -6.50 0.57 1 14 LEU -0.14 0.04 1 15 ILE -1.27 0.13 1 17 ASP -1.29 -0.07 1 18 ASP 1.95 -0.19 1 19 GLN -1.06 -0.20 1 20 HIS 3.65 -0.51 1 21 HIS -2.05 0.51 1 22 ILE -8.85 0.98 1 23 LEU 1.65 -0.31 1 24 LEU -6.85 0.43 1 25 MET -2.12 0.04 1 26 LEU 1.73 0.14 1 27 ARG -4.19 0.42 1 28 HIS -3.25 0.59 1 29 LYS -1.03 0.40 1 30 ASN 2.27 -0.31 1 32 LYS -2.85 0.30 1 33 LYS -1.52 0.65 1 34 TYR -1.61 0.55 1 35 ALA -7.32 1.22 1 36 THR -6.03 0.62 1 37 LEU 0.96 -0.06 1 42 ILE -0.79 -0.27 1 43 GLU -1.59 -0.10 1 44 GLU 2.67 -0.37 1 46 GLU -3.96 0.22 1 47 THR 0.01 0.02 1 51 ALA 0.61 -0.32 1 53 ALA 3.90 -0.69 1 54 ARG 5.37 -0.33 1 55 GLU 4.55 -0.45 1 56 VAL 6.11 -0.84 1 57 LEU 3.95 -0.25 1 58 GLU 2.45 -0.47 1 59 GLU 1.51 -0.10 1 60 VAL -2.56 0.66 1 61 ASN 1.45 -0.04 1 62 LEU -4.73 0.45 1 63 THR 2.49 -0.15 1 64 VAL -6.71 1.11 1 65 GLN -1.85 0.14 1 66 VAL 2.72 -0.02 1 68 GLU -0.58 -0.18 1 69 GLN -0.88 0.09 1 70 VAL -0.80 0.24 1 71 LEU -2.27 0.02 1 72 GLU -4.37 0.79 1 73 LEU -5.65 0.20 1 74 ASP -0.28 0.36 1 75 ASN -1.05 -0.09 1 76 LEU 0.43 -0.14 1 77 HIS -0.49 -0.19 1 79 ALA 1.03 -0.27 1 80 ASN -1.88 -0.03 1 82 SER -3.93 0.57 1 83 HIS -0.91 0.43 1 84 GLU -5.55 0.47 1 85 HIS 0.09 -0.31 1 86 TYR -2.75 0.38 1 87 PHE -4.45 0.73 1 88 ARG 0.39 0.62 1 90 ARG -4.77 0.59 1 91 VAL 3.03 -0.38 1 92 VAL 0.43 0.03 1 93 SER -0.95 0.08 1 95 GLU -3.46 0.07 1 96 MET 1.60 -0.13 1 97 ARG -0.05 -0.11 1 98 LEU -0.23 -0.02 1 100 ASP -0.28 -0.03 1 103 GLU 0.96 -0.24 1 105 ILE 0.07 -0.13 1 106 ARG 0.73 -0.10 1 107 GLN 0.48 -0.12 1 108 SER -1.28 -0.04 1 109 GLU 1.71 -0.23 1 110 ASP 0.43 -0.01 1 111 ASN -0.52 0.30 1 113 TYR -4.18 0.52 1 116 GLU -5.87 -0.08 1 117 TRP -0.68 0.07 1 118 VAL -2.05 0.03 1 119 ALA -0.29 0.10 1 120 LEU 4.18 -0.48 1 121 ASN 2.40 -0.07 1 122 ARG 0.49 0.38 1 123 LEU 4.98 -0.60 1 124 GLU 5.75 -0.41 1 125 GLU 3.07 -0.41 1 126 VAL 0.26 -0.03 1 127 ASN 2.49 -0.56 1 128 LEU 0.98 0.24 1 129 VAL -2.60 0.01 1 131 GLU 5.32 -0.60 1 132 GLN 4.04 -0.20 1 133 VAL 1.22 -0.15 1 134 ARG 5.68 -0.64 1 135 GLU 2.91 -0.30 1 136 LEU 3.31 -0.39 1 137 VAL 3.46 -0.39 1 138 ARG 4.03 -0.17 1 139 THR 1.58 -0.08 1 140 GLN 1.04 -0.21 1 142 VAL 0.04 -0.34 1 143 ASN -1.85 0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5602_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.85 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 2.10 _LACS_plot.Y_axis_chem_shift_offset 0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 TYR -1.61 -4.40 0 16 TYR -4.79 1.63 0 10 ARG -6.06 -2.37 1 11 ALA -5.09 -2.64 1 12 VAL -2.53 -2.85 1 13 ALA -6.50 -2.10 1 14 LEU -0.14 -3.38 1 15 ILE -1.27 -3.23 1 17 ASP -1.29 1.37 1 18 ASP 1.95 0.29 1 19 GLN -1.06 -1.28 1 20 HIS 3.65 0.50 1 21 HIS -2.05 -0.55 1 22 ILE -8.85 -3.04 1 23 LEU 1.65 -2.69 1 24 LEU -6.85 -3.13 1 25 MET -2.12 -1.23 1 26 LEU 1.73 -0.86 1 27 ARG -4.19 -0.94 1 28 HIS -3.25 0.17 1 29 LYS -1.03 -0.24 1 30 ASN 2.27 -0.06 1 32 LYS -2.85 -1.15 1 33 LYS -1.52 -0.51 1 35 ALA -7.32 -2.36 1 36 THR -6.03 -0.63 1 37 LEU 0.96 0.01 1 42 ILE -0.79 0.48 1 43 GLU -1.59 1.85 1 44 GLU 2.67 1.45 1 46 GLU -3.96 0.03 1 47 THR 0.01 0.52 1 49 GLN 6.72 2.97 1 51 ALA 0.61 0.79 1 53 ALA 3.90 2.45 1 54 ARG 5.37 1.87 1 55 GLU 4.55 2.06 1 56 VAL 6.11 1.66 1 57 LEU 3.95 2.73 1 58 GLU 2.45 2.06 1 59 GLU 1.51 2.24 1 60 VAL -2.56 -0.84 1 61 ASN 1.45 -1.14 1 62 LEU -4.73 -1.65 1 63 THR 2.49 -0.23 1 64 VAL -6.71 -2.10 1 65 GLN -1.85 0.12 1 66 VAL 2.72 -0.59 1 68 GLU -0.58 -0.42 1 69 GLN -0.88 -0.10 1 71 LEU -2.27 -4.00 1 72 GLU -4.37 -2.23 1 73 LEU -5.65 -2.55 1 74 ASP -0.28 -2.01 1 75 ASN -1.05 -0.29 1 76 LEU 0.43 -0.43 1 77 HIS -0.49 1.39 1 79 ALA 1.03 -0.04 1 80 ASN -1.88 -1.81 1 82 SER -3.93 -2.26 1 83 HIS -0.91 -0.90 1 84 GLU -5.55 -2.14 1 85 HIS 0.09 -0.98 1 86 TYR -2.75 -0.80 1 87 PHE -4.45 0.23 1 88 ARG 0.39 -0.30 1 90 ARG -4.77 -0.74 1 91 VAL 3.03 -0.28 1 92 VAL 0.43 -0.47 1 93 SER -0.95 -2.21 1 95 GLU -3.46 -1.75 1 96 MET 1.60 -0.04 1 97 ARG -0.05 -1.78 1 98 LEU -0.23 0.44 1 100 ASP -0.28 0.30 1 103 GLU 0.96 0.51 1 105 ILE 0.07 -0.40 1 106 ARG 0.73 -0.09 1 107 GLN 0.48 -0.09 1 108 SER -1.28 0.18 1 109 GLU 1.71 0.26 1 110 ASP 0.43 -0.46 1 111 ASN -0.52 -1.57 1 116 GLU -5.87 -2.37 1 117 TRP -0.68 0.26 1 118 VAL -2.05 -1.38 1 119 ALA -0.29 1.15 1 120 LEU 4.18 0.33 1 121 ASN 2.40 1.20 1 122 ARG 0.49 0.24 1 123 LEU 4.98 -0.04 1 124 GLU 5.75 2.59 1 125 GLU 3.07 2.06 1 126 VAL 0.26 -1.61 1 127 ASN 2.49 -1.37 1 128 LEU 0.98 -1.80 1 129 VAL -2.60 -1.54 1 131 GLU 5.32 2.61 1 132 GLN 4.04 1.41 1 133 VAL 1.22 0.28 1 134 ARG 5.68 1.02 1 135 GLU 2.91 2.11 1 136 LEU 3.31 0.82 1 137 VAL 3.46 3.40 1 138 ARG 4.03 1.53 1 139 THR 1.58 1.39 1 140 GLN 1.04 -0.32 1 141 GLU 0.88 -0.51 1 142 VAL 0.04 -0.80 1 stop_ save_