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 bmr27051_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.39 _LACS_plot.Line_1_terminator_val_y_1 -2.99 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.57 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 5.99 _LACS_plot.Y_axis_chem_shift_offset -0.92 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 TYR 2.25 -6.19 0 10 ASP -0.03 1.07 1 11 ILE -0.13 1.09 1 12 TYR -2.75 -0.09 1 13 GLU -4.22 -1.39 1 14 PHE -1.25 0.18 1 15 GLU 0.01 1.06 1 16 SER 3.91 4.18 1 17 TRP 1.17 1.41 1 18 VAL 6.55 5.37 1 19 SER 3.82 4.58 1 21 LEU -2.16 -2.29 1 22 ASP -0.46 0.91 1 24 GLU 0.82 1.92 1 25 GLN 1.51 2.03 1 26 VAL -1.11 -0.01 1 27 THR -2.38 -0.65 1 29 GLU 0.91 1.88 1 30 SER -3.01 -2.01 1 31 GLN 0.03 0.91 1 32 GLU -1.75 -0.28 1 34 THR -5.36 -0.75 1 35 HIS -2.39 0.31 1 36 ALA -5.74 -1.59 1 37 SER -3.39 1.40 1 38 TYR 0.96 2.77 1 39 ASN -0.61 -0.63 1 40 ARG 3.40 2.62 1 41 LYS 1.78 2.66 1 42 THR -1.36 -0.35 1 44 GLN -5.73 -1.32 1 46 GLU -6.73 -2.26 1 47 GLU -3.92 -1.51 1 48 GLN -3.03 1.58 1 49 LYS 1.52 2.13 1 51 THR -3.69 -0.22 1 52 GLU 3.39 1.20 1 57 GLU 0.18 0.90 1 58 ASN 2.07 0.13 1 59 HIS -0.58 0.57 1 60 PHE -5.49 -0.93 1 61 GLU 2.73 4.41 1 62 THR -7.92 -3.30 1 63 LEU 3.50 4.15 1 64 LEU 4.13 4.34 1 65 LYS 2.22 3.11 1 67 ASN 4.30 4.11 1 68 GLU 2.74 3.39 1 69 SER 2.77 4.65 1 71 ASN 3.88 4.83 1 72 ASP -0.44 -0.40 1 73 ALA -0.21 0.51 1 75 LYS -1.15 0.24 1 79 SER 2.27 2.30 1 80 LEU 2.07 0.91 1 81 GLU -3.10 1.09 1 82 VAL 1.00 0.12 1 83 ASP -3.12 -1.45 1 84 TYR 3.19 3.86 1 86 VAL 0.67 1.11 1 88 ARG 0.78 1.70 1 89 ALA 3.06 2.63 1 90 ASN -8.39 -2.70 1 93 ARG -3.32 -0.39 1 94 TRP -5.50 -1.93 1 95 TYR 0.65 2.34 1 96 TYR -1.31 -0.89 1 97 ASP 4.57 4.00 1 98 THR 3.22 3.31 1 99 ASN -1.68 0.00 1 100 ASN 2.59 1.52 1 101 ALA -2.90 -0.03 1 102 THR -1.70 1.34 1 104 GLU -0.82 1.23 1 105 MET -4.34 -1.47 1 106 PHE 1.62 1.16 1 107 THR -3.27 -1.60 1 111 ILE 4.87 4.93 1 112 THR -2.36 -0.57 1 114 ASN 1.86 -1.49 1 116 ASN 2.02 1.62 1 117 ASN -4.84 -0.99 1 118 PHE 1.56 2.78 1 119 GLU -4.25 -1.31 1 120 SER 4.01 3.70 1 121 GLU 4.38 4.28 1 122 GLU 2.03 3.24 1 123 GLU 3.87 4.02 1 125 LYS 1.27 2.05 1 126 GLU 4.65 4.82 1 127 THR -0.44 0.59 1 129 LYS 0.42 0.60 1 131 PHE -2.44 -0.22 1 132 SER 1.18 3.07 1 133 LEU -2.71 -0.69 1 134 LEU -2.16 -0.07 1 135 LYS 0.41 0.22 1 136 LYS -0.34 0.68 1 137 VAL -0.17 0.86 1 138 ASN -0.64 0.68 1 139 VAL 0.10 1.04 1 140 THR -0.29 0.60 1 141 ILE -0.11 2.52 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27051_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.39 _LACS_plot.Line_1_terminator_val_y_1 5.40 _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 1.43 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset -0.92 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 108 TYR 2.25 -8.44 0 10 ASP -0.03 1.10 1 11 ILE -0.13 1.22 1 12 TYR -2.75 2.66 1 13 GLU -4.22 2.83 1 14 PHE -1.25 1.43 1 15 GLU 0.01 1.05 1 16 SER 3.91 0.27 1 17 TRP 1.17 0.24 1 18 VAL 6.55 -1.18 1 19 SER 3.82 0.76 1 21 LEU -2.16 -0.13 1 22 ASP -0.46 1.37 1 24 GLU 0.82 1.10 1 25 GLN 1.51 0.52 1 26 VAL -1.11 1.10 1 27 THR -2.38 1.73 1 29 GLU 0.91 0.97 1 30 SER -3.01 1.00 1 31 GLN 0.03 0.88 1 32 GLU -1.75 1.47 1 34 THR -5.36 4.61 1 35 HIS -2.39 2.70 1 36 ALA -5.74 4.15 1 37 SER -3.39 4.79 1 38 TYR 0.96 1.81 1 39 ASN -0.61 -0.02 1 40 ARG 3.40 -0.78 1 41 LYS 1.78 0.88 1 42 THR -1.36 1.01 1 44 GLN -5.73 4.41 1 46 GLU -6.73 4.47 1 47 GLU -3.92 2.41 1 48 GLN -3.03 4.61 1 49 LYS 1.52 0.61 1 51 THR -3.69 3.47 1 52 GLU 3.39 -2.19 1 57 GLU 0.18 0.72 1 58 ASN 2.07 -1.94 1 59 HIS -0.58 1.15 1 60 PHE -5.49 4.56 1 61 GLU 2.73 1.68 1 62 THR -7.92 4.62 1 63 LEU 3.50 0.65 1 64 LEU 4.13 0.21 1 65 LYS 2.22 0.89 1 67 ASN 4.30 -0.19 1 68 GLU 2.74 0.65 1 69 SER 2.77 1.88 1 71 ASN 3.88 0.95 1 72 ASP -0.44 0.04 1 73 ALA -0.21 0.72 1 75 LYS -1.15 1.39 1 79 SER 2.27 0.03 1 80 LEU 2.07 -1.16 1 81 GLU -3.10 4.19 1 82 VAL 1.00 -0.88 1 83 ASP -3.12 1.67 1 84 TYR 3.19 0.67 1 86 VAL 0.67 0.44 1 88 ARG 0.78 0.92 1 89 ALA 3.06 -0.43 1 90 ASN -8.39 5.69 1 93 ARG -3.32 2.93 1 94 TRP -5.50 3.57 1 95 TYR 0.65 1.69 1 96 TYR -1.31 0.42 1 97 ASP 4.57 -0.57 1 98 THR 3.22 0.09 1 99 ASN -1.68 1.68 1 100 ASN 2.59 -1.07 1 101 ALA -2.90 2.87 1 102 THR -1.70 3.04 1 104 GLU -0.82 2.05 1 105 MET -4.34 2.87 1 106 PHE 1.62 -0.46 1 107 THR -3.27 1.67 1 111 ILE 4.87 0.06 1 112 THR -2.36 1.79 1 114 ASN 1.86 -3.35 1 116 ASN 2.02 -0.40 1 117 ASN -4.84 3.85 1 118 PHE 1.56 1.22 1 119 GLU -4.25 2.94 1 120 SER 4.01 -0.31 1 121 GLU 4.38 -0.10 1 122 GLU 2.03 1.21 1 123 GLU 3.87 0.15 1 125 LYS 1.27 0.78 1 126 GLU 4.65 0.17 1 127 THR -0.44 1.03 1 129 LYS 0.42 0.18 1 131 PHE -2.44 2.22 1 132 SER 1.18 1.89 1 133 LEU -2.71 2.02 1 134 LEU -2.16 2.09 1 135 LYS 0.41 -0.19 1 136 LYS -0.34 1.02 1 137 VAL -0.17 1.03 1 138 ASN -0.64 1.32 1 139 VAL 0.10 0.94 1 140 THR -0.29 0.89 1 141 ILE -0.11 2.63 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27051_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.39 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.25 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 ALA -5.74 1.48 0 10 ASP -0.03 0.10 1 11 ILE -0.13 0.08 1 12 TYR -2.75 0.46 1 13 GLU -4.22 0.23 1 14 PHE -1.25 0.38 1 15 GLU 0.01 -0.01 1 16 SER 3.91 -0.19 1 17 TRP 1.17 0.11 1 18 VAL 6.55 -1.07 1 19 SER 3.82 -0.35 1 21 LEU -2.16 0.24 1 22 ASP -0.46 -0.16 1 24 GLU 0.82 -0.19 1 25 GLN 1.51 -0.16 1 26 VAL -1.11 0.50 1 27 THR -2.38 0.35 1 29 GLU 0.91 -0.14 1 30 SER -3.01 0.41 1 31 GLN 0.03 0.12 1 32 GLU -1.75 0.10 1 34 THR -5.36 0.99 1 35 HIS -2.39 0.39 1 37 SER -3.39 0.46 1 38 TYR 0.96 -0.01 1 39 ASN -0.61 0.15 1 40 ARG 3.40 -0.48 1 41 LYS 1.78 -0.10 1 42 THR -1.36 0.20 1 44 GLN -5.73 0.64 1 46 GLU -6.73 0.31 1 47 GLU -3.92 0.44 1 48 GLN -3.03 0.35 1 49 LYS 1.52 0.05 1 51 THR -3.69 0.43 1 52 GLU 3.39 -0.34 1 57 GLU 0.18 -0.06 1 58 ASN 2.07 0.18 1 59 HIS -0.58 0.38 1 60 PHE -5.49 0.21 1 61 GLU 2.73 0.05 1 62 THR -7.92 0.46 1 63 LEU 3.50 -0.60 1 64 LEU 4.13 -0.16 1 65 LYS 2.22 -0.08 1 67 ASN 4.30 -0.51 1 68 GLU 2.74 -0.16 1 69 SER 2.77 0.05 1 71 ASN 3.88 -0.22 1 72 ASP -0.44 0.31 1 73 ALA -0.21 -0.62 1 75 LYS -1.15 -0.43 1 79 SER 2.27 -0.48 1 80 LEU 2.07 0.01 1 81 GLU -3.10 0.19 1 82 VAL 1.00 -0.37 1 83 ASP -3.12 0.18 1 84 TYR 3.19 0.00 1 86 VAL 0.67 0.02 1 88 ARG 0.78 -0.13 1 89 ALA 3.06 -0.28 1 90 ASN -8.39 0.51 1 93 ARG -3.32 1.20 1 94 TRP -5.50 0.80 1 95 TYR 0.65 -0.04 1 96 TYR -1.31 -0.02 1 97 ASP 4.57 0.12 1 98 THR 3.22 -0.08 1 99 ASN -1.68 0.21 1 100 ASN 2.59 -0.47 1 101 ALA -2.90 0.39 1 102 THR -1.70 -0.10 1 104 GLU -0.82 -0.06 1 105 MET -4.34 0.42 1 106 PHE 1.62 -0.17 1 107 THR -3.27 0.38 1 108 TYR 2.25 0.62 1 111 ILE 4.87 -0.32 1 112 THR -2.36 0.19 1 114 ASN 1.86 -0.03 1 116 ASN 2.02 0.13 1 117 ASN -4.84 0.57 1 118 PHE 1.56 0.04 1 119 GLU -4.25 0.23 1 120 SER 4.01 0.15 1 121 GLU 4.38 -0.60 1 122 GLU 2.03 -0.35 1 123 GLU 3.87 -0.44 1 125 LYS 1.27 -0.28 1 126 GLU 4.65 0.03 1 127 THR -0.44 0.18 1 129 LYS 0.42 0.30 1 131 PHE -2.44 0.47 1 132 SER 1.18 -0.16 1 133 LEU -2.71 0.58 1 134 LEU -2.16 0.28 1 135 LYS 0.41 0.20 1 136 LYS -0.34 0.11 1 137 VAL -0.17 0.08 1 138 ASN -0.64 0.18 1 139 VAL 0.10 0.11 1 140 THR -0.29 0.13 1 141 ILE -0.11 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27051_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.39 _LACS_plot.Line_1_terminator_val_y_1 -1.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 2.37 _LACS_plot.Y_axis_chem_shift_offset -0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 62 THR -7.92 0.81 0 141 ILE -0.11 4.82 0 10 ASP -0.03 -0.25 1 11 ILE -0.13 -0.70 1 12 TYR -2.75 -0.16 1 13 GLU -4.22 -0.59 1 14 PHE -1.25 2.52 1 15 GLU 0.01 2.75 1 16 SER 3.91 2.37 1 17 TRP 1.17 2.22 1 18 VAL 6.55 3.55 1 19 SER 3.82 3.39 1 21 LEU -2.16 -0.83 1 22 ASP -0.46 2.71 1 25 GLN 1.51 0.96 1 26 VAL -1.11 0.53 1 27 THR -2.38 -0.13 1 29 GLU 0.91 0.31 1 30 SER -3.01 1.36 1 31 GLN 0.03 0.27 1 32 GLU -1.75 0.39 1 34 THR -5.36 -0.68 1 35 HIS -2.39 -2.00 1 36 ALA -5.74 -0.59 1 37 SER -3.39 -1.36 1 38 TYR 0.96 -0.13 1 39 ASN -0.61 1.24 1 40 ARG 3.40 -0.36 1 41 LYS 1.78 1.34 1 42 THR -1.36 3.10 1 44 GLN -5.73 0.57 1 46 GLU -6.73 -0.90 1 47 GLU -3.92 0.09 1 48 GLN -3.03 -0.95 1 49 LYS 1.52 1.53 1 51 THR -3.69 -0.35 1 52 GLU 3.39 1.22 1 57 GLU 0.18 1.78 1 58 ASN 2.07 1.10 1 59 HIS -0.58 -3.09 1 60 PHE -5.49 1.75 1 61 GLU 2.73 0.85 1 63 LEU 3.50 1.19 1 64 LEU 4.13 2.18 1 65 LYS 2.22 3.06 1 67 ASN 4.30 3.21 1 68 GLU 2.74 3.21 1 71 ASN 3.88 1.68 1 72 ASP -0.44 -1.12 1 73 ALA -0.21 -0.68 1 75 LYS -1.15 1.25 1 79 SER 2.27 1.22 1 80 LEU 2.07 1.04 1 81 GLU -3.10 -0.30 1 82 VAL 1.00 -0.37 1 83 ASP -3.12 0.57 1 84 TYR 3.19 1.54 1 86 VAL 0.67 1.14 1 88 ARG 0.78 -0.86 1 89 ALA 3.06 1.19 1 90 ASN -8.39 -2.33 1 93 ARG -3.32 -0.28 1 94 TRP -5.50 -2.79 1 95 TYR 0.65 -1.47 1 96 TYR -1.31 1.16 1 97 ASP 4.57 1.61 1 98 THR 3.22 1.42 1 99 ASN -1.68 -0.11 1 100 ASN 2.59 -1.84 1 101 ALA -2.90 -1.04 1 102 THR -1.70 1.47 1 104 GLU -0.82 0.61 1 105 MET -4.34 -2.92 1 106 PHE 1.62 -1.03 1 107 THR -3.27 -0.08 1 108 TYR 2.25 0.90 1 111 ILE -2.36 0.84 1 114 ASN 1.86 -0.18 1 116 ASN 2.02 -0.46 1 117 ASN -4.84 1.08 1 118 PHE 1.56 -0.28 1 119 GLU -4.25 -1.17 1 120 SER 4.01 2.36 1 121 GLU 4.38 2.46 1 122 GLU 2.03 2.78 1 123 GLU 3.87 2.50 1 125 LYS 1.27 2.14 1 126 GLU 4.65 1.21 1 127 THR -0.44 -0.34 1 129 LYS 0.42 0.58 1 131 PHE -2.44 -0.44 1 132 SER 1.18 0.13 1 133 LEU -2.71 0.42 1 134 LEU -2.16 -0.28 1 135 LYS 0.41 0.62 1 136 LYS -0.34 -0.03 1 137 VAL -0.17 0.32 1 138 ASN -0.64 0.51 1 139 VAL 0.10 0.05 1 140 THR -0.29 -0.68 1 stop_ save_