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 bmr18987_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -2.58 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.18 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 5.38 _LACS_plot.Y_axis_chem_shift_offset -0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 LEU 6.08 2.38 0 82 ASN 0.43 -1.56 0 25 MET -3.24 -1.04 1 26 ILE 0.09 1.69 1 27 LYS 0.73 0.43 1 28 PHE -4.13 -1.13 1 29 TYR 0.33 0.08 1 30 GLN -3.36 -2.27 1 31 TYR -5.83 -1.77 1 36 THR 5.30 4.13 1 38 LYS 3.78 2.95 1 39 LYS 3.54 3.07 1 40 ALA 1.70 1.87 1 41 ALA 4.20 2.37 1 42 LYS 3.63 2.71 1 43 PHE 4.49 4.03 1 44 LEU 5.17 3.23 1 45 ASP 4.06 3.48 1 46 GLU 3.76 2.64 1 47 TYR 0.95 1.17 1 49 VAL 0.22 -0.20 1 50 SER 1.01 0.74 1 51 TYR -4.08 -2.15 1 52 GLU -5.37 -2.78 1 54 ILE -4.15 -0.74 1 55 ASP -1.42 0.40 1 56 ILE -0.53 1.42 1 57 VAL 3.78 2.85 1 58 GLN 1.38 1.84 1 59 HIS -1.53 -1.34 1 60 THR 1.90 2.28 1 62 THR -2.86 -1.10 1 63 ILE 6.66 6.00 1 64 ASN 4.19 3.23 1 65 GLU 3.14 2.99 1 66 PHE 5.69 5.32 1 67 LYS 5.81 4.95 1 68 THR 5.98 5.10 1 69 ILE 5.00 4.95 1 70 ILE 5.40 4.71 1 71 ALA 3.17 2.40 1 72 ASN 2.20 1.97 1 73 THR -1.60 0.75 1 75 VAL 0.19 -0.82 1 76 GLU -0.65 -0.36 1 77 ILE 5.52 4.68 1 78 ASN 4.43 2.67 1 79 LYS 2.28 1.36 1 80 LEU 1.20 0.82 1 81 PHE -0.33 0.77 1 84 HIS -0.97 0.92 1 87 LYS 4.04 2.10 1 88 TYR 3.61 3.71 1 89 ARG 3.83 3.09 1 90 GLU 3.06 2.85 1 91 LEU 0.03 -0.35 1 92 ASP 1.66 0.20 1 94 LYS 4.40 3.28 1 95 ASN 0.21 1.27 1 96 LYS 0.79 1.72 1 97 LEU 5.23 3.73 1 98 GLN 2.52 1.55 1 99 THR -0.19 -0.04 1 100 LEU -2.55 -0.91 1 101 SER -2.22 -0.94 1 102 ASP 5.91 4.27 1 103 ASP 4.59 3.80 1 104 GLU 1.68 2.70 1 105 LYS 4.22 4.74 1 106 LEU 3.32 2.67 1 107 GLU 3.44 2.88 1 108 LEU 3.08 2.99 1 109 LEU 2.80 2.76 1 110 SER 1.48 2.08 1 111 SER 0.98 1.52 1 112 ASP -0.11 -0.19 1 114 MET 3.36 1.00 1 115 LEU -0.37 0.36 1 116 VAL -0.42 -1.05 1 117 LYS 2.02 1.72 1 120 LEU -1.49 -0.23 1 121 ALA -3.62 -2.65 1 122 VAL -6.00 -2.93 1 123 MET 3.16 1.31 1 125 ASP 0.04 -0.89 1 126 LYS -3.96 -0.83 1 127 ILE -5.93 -2.48 1 128 THR -3.80 -1.14 1 129 LEU -3.95 -2.06 1 131 PHE -1.72 0.30 1 132 LYS -2.58 -1.55 1 133 GLU 4.84 4.24 1 134 ASP 4.60 2.71 1 135 GLN 2.99 2.44 1 136 TYR 6.93 4.79 1 137 LYS 4.17 3.88 1 138 GLU 1.47 1.71 1 139 THR 5.01 3.91 1 140 TRP -3.71 -1.88 1 141 LEU 0.28 -1.24 1 142 ALA 0.39 1.58 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18987_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 3.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.82 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 -1.55 _LACS_plot.Y_axis_chem_shift_offset -0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 LEU 6.08 -3.70 0 82 ASN 0.43 -1.99 0 25 MET -3.24 2.20 1 26 ILE 0.09 1.60 1 27 LYS 0.73 -0.30 1 28 PHE -4.13 3.00 1 29 TYR 0.33 -0.25 1 30 GLN -3.36 1.09 1 31 TYR -5.83 4.06 1 36 THR 5.30 -1.17 1 38 LYS 3.78 -0.83 1 39 LYS 3.54 -0.47 1 40 ALA 1.70 0.17 1 41 ALA 4.20 -1.83 1 42 LYS 3.63 -0.92 1 43 PHE 4.49 -0.46 1 44 LEU 5.17 -1.94 1 45 ASP 4.06 -0.58 1 46 GLU 3.76 -1.12 1 47 TYR 0.95 0.22 1 49 VAL 0.22 -0.42 1 50 SER 1.01 -0.27 1 51 TYR -4.08 1.93 1 52 GLU -5.37 2.59 1 54 ILE -4.15 3.41 1 55 ASP -1.42 1.82 1 56 ILE -0.53 1.95 1 57 VAL 3.78 -0.93 1 58 GLN 1.38 0.46 1 59 HIS -1.53 0.19 1 60 THR 1.90 0.38 1 62 THR -2.86 1.76 1 63 ILE 6.66 -0.66 1 64 ASN 4.19 -0.96 1 65 GLU 3.14 -0.15 1 66 PHE 5.69 -0.37 1 67 LYS 5.81 -0.86 1 68 THR 5.98 -0.88 1 69 ILE 5.00 -0.05 1 70 ILE 5.40 -0.69 1 71 ALA 3.17 -0.77 1 72 ASN 2.20 -0.23 1 73 THR -1.60 2.35 1 75 VAL 0.19 -1.01 1 76 GLU -0.65 0.29 1 77 ILE 5.52 -0.84 1 78 ASN 4.43 -1.76 1 79 LYS 2.28 -0.92 1 80 LEU 1.20 -0.38 1 81 PHE -0.33 1.10 1 84 HIS -0.97 1.89 1 87 LYS 4.04 -1.94 1 88 TYR 3.61 0.10 1 89 ARG 3.83 -0.74 1 90 GLU 3.06 -0.21 1 91 LEU 0.03 -0.38 1 92 ASP 1.66 -1.46 1 94 LYS 4.40 -1.12 1 95 ASN 0.21 1.06 1 96 LYS 0.79 0.93 1 97 LEU 5.23 -1.50 1 98 GLN 2.52 -0.97 1 99 THR -0.19 0.15 1 100 LEU -2.55 1.64 1 101 SER -2.22 1.28 1 102 ASP 5.91 -1.64 1 103 ASP 4.59 -0.79 1 104 GLU 1.68 1.02 1 105 LYS 4.22 0.52 1 106 LEU 3.32 -0.65 1 107 GLU 3.44 -0.56 1 108 LEU 3.08 -0.09 1 109 LEU 2.80 -0.04 1 110 SER 1.48 0.60 1 111 SER 0.98 0.54 1 112 ASP -0.11 -0.08 1 114 MET 3.36 -2.36 1 115 LEU -0.37 0.73 1 116 VAL -0.42 -0.63 1 117 LYS 2.02 -0.30 1 120 LEU -1.49 1.26 1 121 ALA -3.62 0.97 1 122 VAL -6.00 3.07 1 123 MET 3.16 -1.85 1 125 ASP 0.04 -0.93 1 126 LYS -3.96 3.13 1 127 ILE -5.93 3.45 1 128 THR -3.80 2.66 1 129 LEU -3.95 1.89 1 131 PHE -1.72 2.02 1 132 LYS -2.58 1.03 1 133 GLU 4.84 -0.60 1 134 ASP 4.60 -1.89 1 135 GLN 2.99 -0.55 1 136 TYR 6.93 -2.14 1 137 LYS 4.17 -0.29 1 138 GLU 1.47 0.24 1 139 THR 5.01 -1.10 1 140 TRP -3.71 1.83 1 141 LEU 0.28 -1.52 1 142 ALA 0.39 1.19 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18987_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 0.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.03 _LACS_plot.Line_2_terminator_val_x_2 6.93 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 121 ALA -3.62 1.55 0 127 ILE -5.93 1.69 0 25 MET -3.24 -0.02 1 26 ILE 0.09 -0.59 1 27 LYS 0.73 0.01 1 28 PHE -4.13 0.21 1 29 TYR 0.33 0.58 1 30 GLN -3.36 0.28 1 31 TYR -5.83 0.40 1 36 THR 5.30 -0.48 1 38 LYS 3.78 -0.28 1 39 LYS 3.54 -0.64 1 40 ALA 1.70 -1.41 1 41 ALA 4.20 -1.36 1 42 LYS 3.63 -0.36 1 43 PHE 4.49 -0.38 1 44 LEU 5.17 -0.44 1 45 ASP 4.06 -0.18 1 46 GLU 3.76 -0.61 1 47 TYR 0.95 -0.30 1 49 VAL 0.22 -0.16 1 50 SER 1.01 -0.12 1 51 TYR -4.08 0.43 1 52 GLU -5.37 0.10 1 54 ILE -4.15 -0.07 1 55 ASP -1.42 0.25 1 56 ILE -0.53 -0.08 1 57 VAL 3.78 -0.48 1 58 GLN 1.38 -0.39 1 59 HIS -1.53 0.23 1 60 THR 1.90 -0.47 1 62 THR -2.86 -0.05 1 63 ILE 6.66 -0.49 1 64 ASN 4.19 -0.39 1 65 GLU 3.14 -0.43 1 66 PHE 5.69 -0.45 1 67 LYS 5.81 -0.53 1 68 THR 5.98 -0.46 1 69 ILE 5.00 -0.36 1 70 ILE 5.40 -0.65 1 71 ALA 3.17 -0.27 1 72 ASN 2.20 -0.25 1 73 THR -1.60 0.12 1 75 VAL 0.19 -0.24 1 76 GLU -0.65 -0.24 1 77 ILE 5.52 -0.75 1 78 ASN 4.43 -0.28 1 79 LYS 2.28 -0.22 1 80 LEU 1.20 -0.41 1 81 PHE -0.33 -0.17 1 82 ASN 0.43 -0.25 1 84 HIS -0.97 -0.17 1 87 LYS 4.04 -0.27 1 88 TYR 3.61 -0.89 1 89 ARG 3.83 -0.13 1 90 GLU 3.06 -0.43 1 91 LEU 0.03 -0.21 1 92 ASP 1.66 -0.23 1 93 LEU 6.08 -0.90 1 94 LYS 4.40 -0.36 1 95 ASN 0.21 -0.01 1 96 LYS 0.79 -0.17 1 97 LEU 5.23 -0.74 1 98 GLN 2.52 -0.16 1 99 THR -0.19 0.06 1 100 LEU -2.55 0.15 1 101 SER -2.22 -0.01 1 102 ASP 5.91 -0.44 1 103 ASP 4.59 -0.36 1 104 GLU 1.68 -0.43 1 105 LYS 4.22 -0.47 1 106 LEU 3.32 -0.67 1 107 GLU 3.44 -0.61 1 108 LEU 3.08 -0.40 1 109 LEU 2.80 -0.96 1 110 SER 1.48 -0.19 1 111 SER 0.98 -0.13 1 112 ASP -0.11 -0.04 1 114 MET 3.36 -0.40 1 115 LEU -0.37 -0.06 1 116 VAL -0.42 -0.12 1 117 LYS 2.02 -0.61 1 120 LEU -1.49 0.64 1 122 VAL -6.00 1.44 1 123 MET 3.16 -0.05 1 125 ASP 0.04 -0.44 1 126 LYS -3.96 0.09 1 128 THR -3.80 0.17 1 129 LEU -3.95 0.68 1 131 PHE -1.72 0.07 1 132 LYS -2.58 -0.42 1 133 GLU 4.84 -1.39 1 134 ASP 4.60 -0.48 1 135 GLN 2.99 -0.26 1 136 TYR 6.93 -0.62 1 137 LYS 4.17 -0.41 1 138 GLU 1.47 -0.45 1 139 THR 5.01 -0.68 1 140 TRP -3.71 0.64 1 141 LEU 0.28 0.26 1 142 ALA 0.39 -0.28 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18987_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -2.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _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 6.93 _LACS_plot.Line_2_terminator_val_y_2 2.74 _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 117 LYS 2.02 -4.75 0 25 MET -3.24 -1.58 1 26 ILE 0.09 -0.52 1 27 LYS 0.73 -3.28 1 28 PHE -4.13 -3.25 1 29 TYR 0.33 -0.05 1 30 GLN -3.36 -4.05 1 36 THR 5.30 1.50 1 38 LYS 3.78 2.77 1 39 LYS 3.54 1.40 1 40 ALA 1.70 0.20 1 41 ALA 4.20 0.67 1 42 LYS 3.63 2.05 1 43 PHE 4.49 1.13 1 44 LEU 5.17 2.06 1 45 ASP 4.06 4.06 1 46 GLU 3.76 1.77 1 47 TYR 0.95 -0.18 1 49 VAL 0.22 -0.03 1 50 SER 1.01 -1.09 1 51 TYR -4.08 -3.55 1 54 ILE -4.15 -1.45 1 55 ASP -1.42 0.07 1 56 ILE -0.53 -2.39 1 57 VAL 3.78 0.52 1 58 GLN 1.38 0.73 1 59 HIS -1.53 -0.34 1 62 THR -2.86 1.06 1 63 ILE 6.66 1.47 1 64 ASN 4.19 3.24 1 65 GLU 3.14 3.49 1 66 PHE 5.69 2.69 1 67 LYS 5.81 3.22 1 68 THR 5.98 0.51 1 69 ILE 5.00 3.87 1 70 ILE 5.40 2.11 1 71 ALA 3.17 2.31 1 72 ASN 2.20 2.58 1 73 THR -1.60 2.27 1 75 VAL 0.19 -3.18 1 76 GLU -0.65 1.59 1 77 ILE 5.52 1.03 1 78 ASN 4.43 3.61 1 79 LYS 2.28 0.22 1 80 LEU 1.20 -0.90 1 81 PHE -0.33 0.52 1 84 HIS -0.97 2.21 1 87 LYS 4.04 0.84 1 88 TYR 3.61 2.44 1 89 ARG 3.83 3.52 1 90 GLU 3.06 2.03 1 91 LEU 0.03 -1.43 1 92 ASP 1.66 1.22 1 93 LEU 6.08 -0.02 1 94 LYS 4.40 1.30 1 95 ASN 0.21 1.61 1 96 LYS 0.79 2.25 1 97 LEU 5.23 0.53 1 98 GLN 2.52 0.88 1 99 THR -0.19 -0.08 1 100 LEU -2.55 -0.37 1 101 SER -2.22 0.72 1 102 ASP 5.91 1.91 1 103 ASP 4.59 2.88 1 104 GLU 1.68 3.77 1 105 LYS 4.22 1.36 1 106 LEU 3.32 1.27 1 107 GLU 3.44 2.41 1 108 LEU 3.08 1.66 1 109 LEU 2.80 -1.54 1 110 SER 1.48 1.75 1 111 SER 0.98 -0.07 1 112 ASP -0.11 -0.68 1 114 MET 3.36 2.16 1 115 LEU -0.37 -1.30 1 116 VAL -0.42 -0.31 1 120 LEU -1.49 -4.38 1 121 ALA -3.62 -2.86 1 122 VAL -6.00 -2.40 1 125 ASP 0.04 -1.13 1 126 LYS -3.96 -2.34 1 127 ILE -5.93 -2.75 1 128 THR -3.80 -1.20 1 129 LEU -3.95 1.26 1 133 GLU 4.84 0.65 1 134 ASP 4.60 2.16 1 135 GLN 2.99 3.19 1 136 TYR 6.93 2.35 1 137 LYS 4.17 1.70 1 138 GLU 1.47 0.71 1 139 THR 5.01 -0.03 1 140 TRP -3.71 0.45 1 141 LEU 0.28 -1.81 1 stop_ save_