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 bmr11338_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.89 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _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 7.80 _LACS_plot.Line_2_terminator_val_y_2 5.73 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 ILE 7.81 2.77 0 42 ILE -5.40 -0.09 0 56 GLN -6.89 -0.95 0 10 ASP -1.04 -1.69 1 11 TYR 4.42 3.62 1 13 GLU 2.54 2.41 1 14 GLU 3.43 2.56 1 15 GLN 4.93 3.80 1 16 ARG 4.89 4.01 1 17 ASN 3.93 2.80 1 18 GLU 4.39 3.40 1 19 LEU 4.36 3.82 1 20 GLU 2.76 2.65 1 21 ALA 3.58 2.50 1 22 LEU 3.04 2.65 1 23 GLU 2.98 2.34 1 24 SER 1.92 1.87 1 25 ILE 1.44 2.28 1 26 TYR -1.01 -0.56 1 28 ASP 0.28 0.42 1 29 SER -0.91 0.54 1 30 PHE -0.76 0.66 1 31 THR -2.13 -0.17 1 32 VAL 2.34 1.70 1 33 LEU -0.43 0.41 1 34 SER -1.61 -0.79 1 35 GLU -1.71 0.15 1 36 ASN -1.86 -0.29 1 39 SER -3.89 -1.53 1 40 PHE -4.14 -2.21 1 41 THR -4.79 -3.59 1 43 THR 1.01 1.19 1 44 VAL -1.90 -1.29 1 45 THR -1.62 -0.55 1 46 SER -1.00 0.95 1 47 GLU -0.75 -0.12 1 48 ALA -0.87 -0.20 1 50 GLU 1.50 1.54 1 51 ASN 0.77 0.25 1 52 ASP 2.72 1.65 1 53 GLU -0.21 0.16 1 54 THR -3.95 -1.25 1 55 VAL -3.44 -2.33 1 57 THR -2.97 -1.29 1 58 THR 1.94 0.87 1 59 LEU -3.64 -1.85 1 60 LYS -4.94 -2.22 1 61 PHE -5.42 -1.82 1 62 THR -2.79 -0.84 1 63 TYR -0.92 -2.49 1 64 SER -3.11 -2.42 1 65 GLU 3.46 3.42 1 66 LYS -0.56 -2.40 1 67 TYR 2.05 1.19 1 69 ASP 3.72 2.94 1 70 GLU -5.58 -2.78 1 71 ALA 1.45 0.51 1 73 LEU 0.39 -0.36 1 74 TYR -6.07 -3.60 1 75 GLU -6.46 -2.28 1 76 ILE 3.10 -0.34 1 77 PHE 0.21 2.13 1 78 SER -1.74 -1.04 1 79 GLN -0.79 -0.69 1 80 GLU -3.47 -0.35 1 81 ASN 2.69 1.39 1 82 LEU -2.58 -1.22 1 83 GLU -2.87 -1.76 1 84 ASP 5.36 4.17 1 85 ASN 4.20 2.90 1 86 ASP 2.28 3.45 1 87 VAL 6.69 5.31 1 88 SER 4.79 3.46 1 89 ASP 4.27 3.43 1 90 ILE 5.80 4.66 1 91 LEU 4.69 3.64 1 92 LYS 3.91 3.46 1 93 LEU 3.30 2.92 1 94 LEU 4.29 3.40 1 95 ALA 3.83 3.01 1 96 LEU 3.02 2.89 1 97 GLN 3.67 2.56 1 98 ALA 4.56 3.00 1 99 GLU 2.79 2.40 1 100 GLU 1.44 1.79 1 101 ASN -1.84 1.02 1 102 LEU 2.66 2.40 1 104 MET -4.98 -1.86 1 105 VAL 5.85 2.30 1 106 MET -3.40 1.09 1 108 PHE 4.59 3.77 1 109 THR 6.08 4.76 1 110 LEU 5.59 3.89 1 111 VAL 7.19 5.55 1 112 THR 6.54 5.34 1 113 ALA 4.69 2.61 1 114 VAL 6.78 5.14 1 115 GLN 3.97 3.81 1 116 GLU 3.40 2.90 1 117 LYS 3.36 1.28 1 118 LEU 5.54 3.15 1 119 ASN 3.97 2.30 1 120 GLU 2.66 2.66 1 121 ILE 4.95 4.41 1 122 VAL 4.50 3.27 1 123 ASP 1.75 2.16 1 124 GLN 1.19 0.80 1 125 ILE 3.57 3.00 1 126 LYS 1.39 1.05 1 127 THR 0.18 0.03 1 128 ARG 1.74 2.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11338_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.89 _LACS_plot.Line_1_terminator_val_y_1 4.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.02 _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 7.80 _LACS_plot.Line_2_terminator_val_y_2 -2.07 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 107 ILE 7.81 -5.04 0 42 ILE -5.40 5.31 0 56 GLN -6.89 5.94 0 10 ASP -1.04 -0.65 1 11 TYR 4.42 -0.80 1 13 GLU 2.54 -0.13 1 14 GLU 3.43 -0.87 1 15 GLN 4.93 -1.13 1 16 ARG 4.89 -0.88 1 17 ASN 3.93 -1.13 1 18 GLU 4.39 -0.99 1 19 LEU 4.36 -0.54 1 20 GLU 2.76 -0.11 1 21 ALA 3.58 -1.08 1 22 LEU 3.04 -0.39 1 23 GLU 2.98 -0.64 1 24 SER 1.92 -0.05 1 25 ILE 1.44 0.84 1 26 TYR -1.01 0.45 1 28 ASP 0.28 0.14 1 29 SER -0.91 1.45 1 30 PHE -0.76 1.42 1 31 THR -2.13 1.96 1 32 VAL 2.34 -0.64 1 33 LEU -0.43 0.84 1 34 SER -1.61 0.82 1 35 GLU -1.71 1.86 1 36 ASN -1.86 1.57 1 39 SER -3.89 2.36 1 40 PHE -4.14 1.93 1 41 THR -4.79 1.20 1 43 THR 1.01 0.18 1 44 VAL -1.90 0.61 1 45 THR -1.62 1.07 1 46 SER -1.00 1.95 1 47 GLU -0.75 0.63 1 48 ALA -0.87 0.67 1 50 GLU 1.50 0.04 1 51 ASN 0.77 -0.52 1 52 ASP 2.72 -1.07 1 53 GLU -0.21 0.37 1 54 THR -3.95 2.70 1 55 VAL -3.44 1.11 1 57 THR -2.97 1.68 1 58 THR 1.94 -1.07 1 59 LEU -3.64 1.79 1 60 LYS -4.94 2.72 1 61 PHE -5.42 3.60 1 62 THR -2.79 1.95 1 63 TYR -0.92 -1.57 1 64 SER -3.11 0.69 1 65 GLU 3.46 -0.04 1 66 LYS -0.56 -1.84 1 67 TYR 2.05 -0.86 1 69 ASP 3.72 -0.78 1 70 GLU -5.58 2.80 1 71 ALA 1.45 -0.94 1 73 LEU 0.39 -0.75 1 74 TYR -6.07 2.47 1 75 GLU -6.46 4.18 1 76 ILE 3.10 -3.44 1 77 PHE 0.21 1.92 1 78 SER -1.74 0.70 1 79 GLN -0.79 0.10 1 80 GLU -3.47 3.12 1 81 ASN 2.69 -1.30 1 82 LEU -2.58 1.36 1 83 GLU -2.87 1.11 1 84 ASP 5.36 -1.19 1 85 ASN 4.20 -1.30 1 86 ASP 2.28 1.17 1 87 VAL 6.69 -1.38 1 88 SER 4.79 -1.33 1 89 ASP 4.27 -0.84 1 90 ILE 5.80 -1.14 1 91 LEU 4.69 -1.05 1 92 LYS 3.91 -0.45 1 93 LEU 3.30 -0.38 1 94 LEU 4.29 -0.89 1 95 ALA 3.83 -0.82 1 96 LEU 3.02 -0.13 1 97 GLN 3.67 -1.11 1 98 ALA 4.56 -1.56 1 99 GLU 2.79 -0.39 1 100 GLU 1.44 0.35 1 101 ASN -1.84 2.86 1 102 LEU 2.66 -0.26 1 104 MET -4.98 3.12 1 105 VAL 5.85 -3.55 1 106 MET -3.40 4.49 1 108 PHE 4.59 -0.82 1 109 THR 6.08 -1.32 1 110 LEU 5.59 -1.70 1 111 VAL 7.19 -1.64 1 112 THR 6.54 -1.20 1 113 ALA 4.69 -2.08 1 114 VAL 6.78 -1.64 1 115 GLN 3.97 -0.16 1 116 GLU 3.40 -0.50 1 117 LYS 3.36 -2.08 1 118 LEU 5.54 -2.39 1 119 ASN 3.97 -1.67 1 120 GLU 2.66 0.00 1 121 ILE 4.95 -0.54 1 122 VAL 4.50 -1.23 1 123 ASP 1.75 0.41 1 124 GLN 1.19 -0.39 1 125 ILE 3.57 -0.57 1 126 LYS 1.39 -0.34 1 127 THR 0.18 -0.15 1 128 ARG 1.74 0.56 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11338_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.89 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _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 7.80 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 THR -4.79 1.47 0 10 ASP -1.04 -0.04 1 11 TYR 4.42 -0.39 1 13 GLU 2.54 -0.25 1 14 GLU 3.43 -0.23 1 15 GLN 4.93 -0.50 1 16 ARG 4.89 -0.25 1 17 ASN 3.93 -0.26 1 18 GLU 4.39 -0.17 1 19 LEU 4.36 -0.63 1 20 GLU 2.76 -0.39 1 21 ALA 3.58 -0.26 1 22 LEU 3.04 -0.59 1 23 GLU 2.98 -0.97 1 24 SER 1.92 -0.18 1 25 ILE 1.44 -0.45 1 26 TYR -1.01 0.44 1 28 ASP 0.28 0.14 1 29 SER -0.91 0.31 1 30 PHE -0.76 0.85 1 31 THR -2.13 -0.11 1 32 VAL 2.34 -0.33 1 33 LEU -0.43 0.03 1 34 SER -1.61 0.08 1 35 GLU -1.71 0.06 1 36 ASN -1.86 -0.09 1 39 SER -3.89 0.96 1 40 PHE -4.14 0.72 1 42 ILE -5.40 0.45 1 43 THR 1.01 0.52 1 44 VAL -1.90 0.22 1 45 THR -1.62 0.63 1 46 SER -1.00 -0.20 1 47 GLU -0.75 -0.05 1 48 ALA -0.87 0.12 1 50 GLU 1.50 -0.22 1 51 ASN 0.77 -0.03 1 52 ASP 2.72 -0.30 1 53 GLU -0.21 -0.01 1 54 THR -3.95 0.13 1 55 VAL -3.44 0.64 1 56 GLN -6.89 1.13 1 57 THR -2.97 0.57 1 58 THR 1.94 0.62 1 59 LEU -3.64 0.27 1 60 LYS -4.94 0.46 1 61 PHE -5.42 0.71 1 62 THR -2.79 0.56 1 63 TYR -0.92 0.03 1 64 SER -3.11 0.13 1 65 GLU 3.46 -0.27 1 66 LYS -0.56 -0.82 1 67 TYR 2.05 0.02 1 69 ASP 3.72 -0.08 1 70 GLU -5.58 0.06 1 71 ALA 1.45 -0.37 1 73 LEU 0.39 0.00 1 74 TYR -6.07 1.02 1 75 GLU -6.46 0.06 1 76 ILE 3.10 -0.09 1 77 PHE 0.21 -0.29 1 78 SER -1.74 0.01 1 79 GLN -0.79 0.75 1 80 GLU -3.47 0.07 1 81 ASN 2.69 -0.39 1 82 LEU -2.58 0.42 1 83 GLU -2.87 0.20 1 84 ASP 5.36 -0.39 1 85 ASN 4.20 -0.30 1 86 ASP 2.28 -0.23 1 87 VAL 6.69 -0.78 1 88 SER 4.79 -0.30 1 89 ASP 4.27 -0.16 1 90 ILE 5.80 -0.55 1 91 LEU 4.69 -0.23 1 92 LYS 3.91 -0.20 1 93 LEU 3.30 -0.15 1 94 LEU 4.29 -0.74 1 95 ALA 3.83 -0.18 1 96 LEU 3.02 -0.16 1 97 GLN 3.67 -0.42 1 98 ALA 4.56 0.27 1 99 GLU 2.79 -0.31 1 100 GLU 1.44 -0.22 1 101 ASN -1.84 0.02 1 102 LEU 2.66 -0.42 1 104 MET -4.98 0.18 1 105 VAL 5.85 -0.25 1 106 MET -3.40 0.79 1 107 ILE 7.81 -0.67 1 108 PHE 4.59 -0.09 1 109 THR 6.08 -0.68 1 110 LEU 5.59 -0.52 1 111 VAL 7.19 -0.86 1 112 THR 6.54 -0.60 1 113 ALA 4.69 -0.15 1 114 VAL 6.78 -0.70 1 115 GLN 3.97 -0.70 1 116 GLU 3.40 -0.29 1 117 LYS 3.36 0.00 1 118 LEU 5.54 -0.41 1 119 ASN 3.97 -0.21 1 120 GLU 2.66 -0.18 1 121 ILE 4.95 -0.50 1 122 VAL 4.50 -0.22 1 123 ASP 1.75 -0.04 1 124 GLN 1.19 -0.05 1 125 ILE 3.57 -0.30 1 126 LYS 1.39 0.04 1 127 THR 0.18 0.06 1 128 ARG 1.74 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11338_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.89 _LACS_plot.Line_1_terminator_val_y_1 -2.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.74 _LACS_plot.Line_2_terminator_val_x_2 7.80 _LACS_plot.Line_2_terminator_val_y_2 2.82 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 ARG 1.74 4.94 0 10 ASP -1.04 -0.62 1 11 TYR 4.42 1.96 1 13 GLU 2.54 1.90 1 14 GLU 3.43 3.84 1 15 GLN 4.93 1.21 1 16 ARG 4.89 3.29 1 17 ASN 3.93 3.24 1 18 GLU 4.39 1.15 1 19 LEU 4.36 2.28 1 20 GLU 2.76 2.49 1 21 ALA 3.58 3.11 1 22 LEU 3.04 0.23 1 23 GLU 2.98 0.62 1 24 SER 1.92 1.18 1 25 ILE 1.44 -0.55 1 26 TYR -1.01 -0.51 1 28 ASP 0.28 0.28 1 29 SER -0.91 -0.82 1 30 PHE -0.76 -0.56 1 31 THR -2.13 -2.55 1 32 VAL 2.34 -0.37 1 33 LEU -0.43 -0.35 1 34 SER -1.61 -1.94 1 35 GLU -1.71 -0.77 1 36 ASN -1.86 -1.32 1 39 SER -3.89 -0.42 1 40 PHE -4.14 -3.08 1 41 THR -4.79 -0.48 1 42 ILE -5.40 -1.12 1 43 THR 1.01 -1.87 1 44 VAL -1.90 -3.04 1 45 THR -1.62 0.38 1 46 SER -1.00 -0.41 1 47 GLU -0.75 -0.54 1 48 ALA -0.87 1.20 1 50 GLU 1.50 0.72 1 51 ASN 0.77 -0.66 1 52 ASP 2.72 -1.17 1 53 GLU -0.21 -0.91 1 54 THR -3.95 -0.60 1 55 VAL -3.44 -1.91 1 56 GLN -6.89 -1.50 1 57 THR -2.97 -1.76 1 58 THR 1.94 -1.49 1 59 LEU -3.64 -3.17 1 60 LYS -4.94 -2.01 1 61 PHE -5.42 -1.21 1 62 THR -2.79 -0.03 1 63 TYR -0.92 0.14 1 64 SER -3.11 0.84 1 65 GLU 3.46 1.04 1 66 LYS -0.56 -1.24 1 67 TYR 2.05 1.19 1 69 ASP 3.72 -0.73 1 70 GLU -5.58 -2.59 1 71 ALA 1.45 1.02 1 73 LEU 0.39 -0.82 1 74 TYR -6.07 -1.84 1 75 GLU -6.46 -2.15 1 76 ILE 3.10 -1.72 1 77 PHE 0.21 -0.19 1 78 SER -1.74 -2.53 1 79 GLN -0.79 -1.92 1 80 GLU -3.47 -0.77 1 81 ASN 2.69 -1.81 1 82 LEU -2.58 0.24 1 83 GLU -2.87 1.60 1 84 ASP 5.36 2.94 1 85 ASN 4.20 1.71 1 86 ASP 2.28 1.74 1 87 VAL 6.69 1.44 1 88 SER 4.79 2.99 1 89 ASP 4.27 3.46 1 90 ILE 5.80 0.59 1 91 LEU 4.69 2.44 1 92 LYS 3.91 1.98 1 93 LEU 3.30 1.04 1 94 LEU 4.29 0.04 1 95 ALA 3.83 3.77 1 96 LEU 3.02 2.54 1 97 GLN 3.67 3.24 1 98 ALA 4.56 0.88 1 99 GLU 2.79 2.76 1 100 GLU 1.44 0.96 1 101 ASN -1.84 -2.67 1 102 LEU 2.66 0.53 1 104 MET -4.98 -2.53 1 105 VAL 5.85 2.45 1 106 MET -3.40 0.05 1 107 ILE 7.81 1.24 1 108 PHE 4.59 2.84 1 109 THR 6.08 1.73 1 110 LEU 5.59 0.75 1 111 VAL 7.19 1.89 1 112 THR 6.54 1.11 1 113 ALA 4.69 3.15 1 114 VAL 6.78 0.47 1 115 GLN 3.97 1.95 1 116 GLU 3.40 2.63 1 117 LYS 3.36 1.84 1 118 LEU 5.54 0.82 1 119 ASN 3.97 2.46 1 120 GLU 2.66 2.56 1 121 ILE 4.95 2.84 1 122 VAL 4.50 0.88 1 123 ASP 1.75 1.26 1 124 GLN 1.19 1.74 1 125 ILE 3.57 0.81 1 126 LYS 1.39 0.58 1 127 THR 0.18 -0.62 1 stop_ save_