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 bmr15964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.19 _LACS_plot.Line_1_terminator_val_y_1 -3.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.99 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 4.71 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ASN -6.24 -0.90 0 47 HIS -6.16 -0.56 0 114 ILE 2.21 -1.72 0 10 ASP 0.18 0.24 1 12 HIS -0.69 0.99 1 13 ASN -0.13 0.13 1 15 LEU 0.62 1.13 1 17 LYS 3.35 0.36 1 19 PHE 3.93 3.27 1 21 ASP 2.38 1.69 1 22 HIS 0.50 1.28 1 23 ILE -2.56 -2.03 1 24 HIS -1.73 -2.01 1 25 TRP -1.08 -0.55 1 26 ARG -5.63 -1.63 1 27 THR -1.00 -0.48 1 28 LEU 4.79 3.95 1 29 GLU 4.43 3.46 1 30 ASP 3.91 2.87 1 32 LYS 5.62 4.74 1 33 LYS 4.16 3.55 1 34 GLU 3.24 2.21 1 35 ALA 3.16 3.45 1 36 ALA 3.10 1.92 1 37 ALA 1.80 1.64 1 38 SER -0.82 0.60 1 40 LEU -2.41 -1.07 1 42 LEU -2.01 -0.14 1 43 MET -1.94 -0.66 1 44 VAL -3.11 -2.11 1 45 ILE -2.94 -1.24 1 46 ILE -0.07 0.26 1 48 LYS -4.82 -3.31 1 49 SER 3.86 2.42 1 50 TRP -1.96 -2.97 1 53 ALA 3.05 2.27 1 55 LYS 4.14 3.42 1 56 ALA 2.27 1.67 1 57 LEU 0.62 1.13 1 58 LYS 2.47 2.04 1 60 LYS 0.53 2.65 1 61 PHE 2.62 2.54 1 62 ALA -2.49 -1.82 1 63 GLU -1.16 -1.04 1 64 SER 5.22 3.52 1 65 THR 3.50 3.76 1 66 GLU 6.09 4.96 1 67 ILE 4.53 3.15 1 68 SER 1.69 2.16 1 70 LEU 4.47 3.39 1 71 SER 2.59 2.62 1 72 HIS 0.30 -0.25 1 74 PHE 2.78 1.28 1 75 VAL 0.19 -2.20 1 76 MET -5.18 -1.21 1 77 VAL -4.14 -1.06 1 78 ASN -3.28 -2.89 1 79 LEU -7.19 -3.28 1 80 GLU 5.68 3.28 1 81 ASP 3.45 1.73 1 82 GLU -0.55 -0.13 1 83 GLU -0.01 0.33 1 84 GLU 1.53 -0.67 1 86 LYS -1.06 -0.18 1 87 ASP 3.11 2.27 1 88 GLU 3.34 1.74 1 89 ASP 1.34 0.36 1 90 PHE -0.28 -0.80 1 91 SER -1.01 -1.55 1 93 ASP -1.81 -2.20 1 96 TYR -2.35 -0.25 1 97 ILE -4.51 -1.22 1 99 ARG -0.20 0.03 1 100 ILE -7.01 -2.83 1 101 LEU -3.01 -0.75 1 102 PHE -4.94 -1.73 1 103 LEU 1.88 0.38 1 104 ASP 0.28 0.50 1 106 SER -1.66 -1.76 1 108 LYS 2.62 1.90 1 109 VAL -2.98 0.92 1 110 HIS 3.03 0.46 1 112 GLU 3.98 0.51 1 113 ILE -5.36 -2.13 1 115 ASN 2.77 2.22 1 116 GLU -0.96 -0.21 1 117 ASN -2.39 -1.03 1 119 ASN 2.40 1.76 1 121 SER -3.49 -3.46 1 122 TYR 5.61 4.34 1 123 LYS -0.77 -1.91 1 124 TYR -2.57 -1.06 1 125 PHE -3.53 -0.87 1 126 TYR -1.98 -0.76 1 127 VAL -2.60 -3.40 1 128 SER 4.33 3.06 1 129 ALA 5.26 4.03 1 130 GLU 3.86 2.92 1 131 GLN 6.47 4.67 1 132 VAL 5.88 4.77 1 133 VAL 5.09 3.39 1 134 GLN 1.88 4.24 1 136 MET 5.15 4.41 1 137 LYS 3.39 2.54 1 138 GLU 3.33 2.82 1 139 ALA 4.91 3.18 1 140 GLN 2.53 2.38 1 141 GLU 1.23 2.10 1 142 ARG -0.62 -0.57 1 143 LEU 1.57 1.31 1 144 THR 1.07 1.13 1 146 ASP 1.93 1.35 1 147 ALA 1.02 0.66 1 148 PHE -0.20 -0.33 1 149 ARG 0.99 1.42 1 150 LYS 0.99 1.42 1 151 LYS -0.53 1.02 1 152 HIS -0.04 -0.08 1 153 LEU 0.20 0.45 1 154 GLU 0.30 0.44 1 155 ASP -0.61 -0.20 1 156 GLU 0.62 1.56 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.19 _LACS_plot.Line_1_terminator_val_y_1 4.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.01 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.94 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _LACS_plot.Y_axis_chem_shift_offset -0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ASN -6.24 5.34 0 47 HIS -6.16 5.60 0 114 ILE 2.21 -3.93 0 10 ASP 0.18 0.06 1 12 HIS -0.69 1.68 1 13 ASN -0.13 0.26 1 15 LEU 0.62 0.51 1 17 LYS 3.35 -2.99 1 19 PHE 3.93 -0.66 1 21 ASP 2.38 -0.69 1 22 HIS 0.50 0.78 1 23 ILE -2.56 0.53 1 24 HIS -1.73 -0.28 1 25 TRP -1.08 0.53 1 26 ARG -5.63 4.00 1 27 THR -1.00 0.52 1 28 LEU 4.79 -0.84 1 29 GLU 4.43 -0.97 1 30 ASP 3.91 -1.04 1 32 LYS 5.62 -0.88 1 33 LYS 4.16 -0.61 1 34 GLU 3.24 -1.03 1 35 ALA 3.16 0.29 1 36 ALA 3.10 -1.18 1 37 ALA 1.80 -0.16 1 38 SER -0.82 1.42 1 40 LEU -2.41 1.34 1 42 LEU -2.01 1.87 1 43 MET -1.94 1.28 1 44 VAL -3.11 1.00 1 45 ILE -2.94 1.70 1 46 ILE -0.07 0.33 1 48 LYS -4.82 1.51 1 49 SER 3.86 -1.44 1 50 TRP -1.96 -1.01 1 53 ALA 3.05 -0.78 1 55 LYS 4.14 -0.72 1 56 ALA 2.27 -0.60 1 57 LEU 0.62 0.51 1 58 LYS 2.47 -0.43 1 60 LYS 0.53 2.12 1 61 PHE 2.62 -0.08 1 62 ALA -2.49 0.67 1 63 GLU -1.16 0.12 1 64 SER 5.22 -1.70 1 65 THR 3.50 0.26 1 66 GLU 6.09 -1.13 1 67 ILE 4.53 -1.38 1 68 SER 1.69 0.47 1 70 LEU 4.47 -1.08 1 71 SER 2.59 0.03 1 72 HIS 0.30 -0.55 1 74 PHE 2.78 -1.50 1 75 VAL 0.19 -2.39 1 76 MET -5.18 3.97 1 77 VAL -4.14 3.08 1 78 ASN -3.28 0.39 1 79 LEU -7.19 3.91 1 80 GLU 5.68 -2.40 1 81 ASP 3.45 -1.72 1 82 GLU -0.55 0.42 1 83 GLU -0.01 0.34 1 84 GLU 1.53 -2.20 1 86 LYS -1.06 0.88 1 87 ASP 3.11 -0.84 1 88 GLU 3.34 -1.60 1 89 ASP 1.34 -0.98 1 90 PHE -0.28 -0.52 1 91 SER -1.01 -0.54 1 93 ASP -1.81 -0.39 1 96 TYR -2.35 2.10 1 97 ILE -4.51 3.29 1 99 ARG -0.20 0.23 1 100 ILE -7.01 4.18 1 101 LEU -3.01 2.26 1 102 PHE -4.94 3.21 1 103 LEU 1.88 -1.50 1 104 ASP 0.28 0.22 1 106 SER -1.66 -0.10 1 108 LYS 2.62 -0.72 1 109 VAL -2.98 3.90 1 110 HIS 3.03 -2.57 1 112 GLU 3.98 -3.47 1 113 ILE -5.36 3.23 1 115 ASN 2.77 -0.55 1 116 GLU -0.96 0.75 1 117 ASN -2.39 1.36 1 119 ASN 2.40 -0.64 1 121 SER -3.49 0.03 1 122 TYR 5.61 -1.27 1 123 LYS -0.77 -1.14 1 124 TYR -2.57 1.51 1 125 PHE -3.53 2.66 1 126 TYR -1.98 1.22 1 127 VAL -2.60 -0.80 1 128 SER 4.33 -1.27 1 129 ALA 5.26 -1.23 1 130 GLU 3.86 -0.94 1 131 GLN 6.47 -1.80 1 132 VAL 5.88 -1.11 1 133 VAL 5.09 -1.70 1 134 GLN 1.88 2.36 1 136 MET 5.15 -0.74 1 137 LYS 3.39 -0.85 1 138 GLU 3.33 -0.51 1 139 ALA 4.91 -1.73 1 140 GLN 2.53 -0.15 1 141 GLU 1.23 0.87 1 142 ARG -0.62 0.05 1 143 LEU 1.57 -0.26 1 144 THR 1.07 0.06 1 146 ASP 1.93 -0.58 1 147 ALA 1.02 -0.36 1 148 PHE -0.20 -0.13 1 149 ARG 0.99 0.43 1 150 LYS 0.99 0.43 1 151 LYS -0.53 1.55 1 152 HIS -0.04 -0.04 1 153 LEU 0.20 0.25 1 154 GLU 0.30 0.14 1 155 ASP -0.61 0.41 1 156 GLU 0.62 0.94 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.19 _LACS_plot.Line_1_terminator_val_y_1 0.58 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 LEU -7.19 -0.46 0 10 ASP 0.18 -0.01 1 12 HIS -0.69 -0.04 1 13 ASN -0.13 0.03 1 15 LEU 0.62 -0.18 1 17 LYS 3.35 -0.59 1 19 PHE 3.93 -0.47 1 21 ASP 2.38 0.32 1 22 HIS 0.50 -0.15 1 23 ILE -2.56 -0.64 1 24 HIS -1.73 -0.10 1 25 TRP -1.08 0.08 1 26 ARG -5.63 0.62 1 27 THR -1.00 0.18 1 28 LEU 4.79 -0.33 1 29 GLU 4.43 -0.36 1 30 ASP 3.91 -0.20 1 32 LYS 5.62 -0.40 1 33 LYS 4.16 -0.20 1 34 GLU 3.24 -0.27 1 35 ALA 3.16 -0.36 1 36 ALA 3.10 -0.24 1 37 ALA 1.80 -0.04 1 38 SER -0.82 0.04 1 40 LEU -2.41 0.07 1 42 LEU -2.01 1.24 1 43 MET -1.94 -0.03 1 44 VAL -3.11 0.87 1 45 ILE -2.94 0.42 1 46 ILE -0.07 0.64 1 47 HIS -6.16 0.03 1 48 LYS -4.82 0.68 1 49 SER 3.86 -0.26 1 50 TRP -1.96 0.15 1 53 ALA 3.05 0.06 1 55 LYS 4.14 -0.61 1 56 ALA 2.27 -0.14 1 57 LEU 0.62 -0.18 1 58 LYS 2.47 -0.21 1 60 LYS 0.53 -0.62 1 61 PHE 2.62 0.02 1 62 ALA -2.49 -0.01 1 63 GLU -1.16 0.12 1 64 SER 5.22 -0.27 1 65 THR 3.50 -0.27 1 66 GLU 6.09 -0.88 1 67 ILE 4.53 -0.69 1 68 SER 1.69 -0.17 1 70 LEU 4.47 -0.72 1 71 SER 2.59 -0.20 1 72 HIS 0.30 -0.30 1 73 ASN -6.24 0.18 1 74 PHE 2.78 -0.29 1 75 VAL 0.19 0.38 1 76 MET -5.18 0.87 1 77 VAL -4.14 0.88 1 78 ASN -3.28 0.43 1 80 GLU 5.68 -0.46 1 81 ASP 3.45 -0.06 1 82 GLU -0.55 -0.35 1 83 GLU -0.01 -0.81 1 84 GLU 1.53 -0.11 1 86 LYS -1.06 -0.15 1 87 ASP 3.11 -0.28 1 88 GLU 3.34 -0.36 1 89 ASP 1.34 -0.37 1 90 PHE -0.28 -0.18 1 91 SER -1.01 0.36 1 93 ASP -1.81 0.03 1 96 TYR -2.35 0.25 1 97 ILE -4.51 1.23 1 99 ARG -0.20 0.83 1 100 ILE -7.01 0.48 1 101 LEU -3.01 0.76 1 102 PHE -4.94 1.10 1 103 LEU 1.88 -0.40 1 104 ASP 0.28 0.04 1 106 SER -1.66 0.15 1 108 LYS 2.62 -0.41 1 109 VAL -2.98 -0.04 1 110 HIS 3.03 -0.08 1 112 GLU 3.98 0.34 1 113 ILE -5.36 0.55 1 114 ILE 2.21 -0.16 1 115 ASN 2.77 -0.50 1 116 GLU -0.96 0.17 1 117 ASN -2.39 -0.12 1 119 ASN 2.40 -0.31 1 121 SER -3.49 0.15 1 122 TYR 5.61 -0.51 1 123 LYS -0.77 0.60 1 124 TYR -2.57 0.70 1 125 PHE -3.53 -0.07 1 126 TYR -1.98 0.18 1 127 VAL -2.60 0.37 1 128 SER 4.33 -0.43 1 129 ALA 5.26 -0.39 1 130 GLU 3.86 -0.07 1 131 GLN 6.47 -0.70 1 132 VAL 5.88 -0.81 1 133 VAL 5.09 -0.34 1 134 GLN 1.88 -0.91 1 136 MET 5.15 -0.37 1 137 LYS 3.39 -0.28 1 138 GLU 3.33 -0.68 1 139 ALA 4.91 -0.75 1 140 GLN 2.53 -0.33 1 141 GLU 1.23 -0.12 1 142 ARG -0.62 0.04 1 143 LEU 1.57 -0.09 1 144 THR 1.07 -0.16 1 146 ASP 1.93 -0.26 1 147 ALA 1.02 -0.08 1 148 PHE -0.20 -0.10 1 149 ARG 0.99 -0.16 1 150 LYS 0.99 -0.16 1 151 LYS -0.53 -0.15 1 152 HIS -0.04 0.00 1 153 LEU 0.20 -0.17 1 154 GLU 0.30 -0.09 1 155 ASP -0.61 -0.04 1 156 GLU 0.62 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15964_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.19 _LACS_plot.Line_1_terminator_val_y_1 -2.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.70 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.70 _LACS_plot.Line_2_terminator_val_x_2 6.47 _LACS_plot.Line_2_terminator_val_y_2 2.19 _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 26 ARG -5.63 1.00 0 80 GLU -7.19 -0.33 0 79 LEU -3.28 -5.19 0 10 ASP 0.18 0.42 1 13 ASN -0.13 0.49 1 15 LEU 0.62 0.77 1 17 LYS 3.35 -1.55 1 19 PHE 3.93 -1.82 1 21 ASP 2.38 -0.85 1 22 HIS 0.50 1.02 1 23 ILE -2.56 -3.18 1 24 HIS -1.73 -0.85 1 25 TRP -1.08 0.12 1 27 THR -1.00 1.41 1 28 LEU 4.79 0.83 1 29 GLU 4.43 3.34 1 30 ASP 3.91 3.26 1 32 LYS 5.62 3.40 1 33 LYS 4.16 2.55 1 34 GLU 3.24 2.94 1 35 ALA 3.16 1.48 1 36 ALA 3.10 2.59 1 37 ALA 1.80 1.59 1 38 SER -0.82 0.72 1 42 LEU -2.01 -2.22 1 43 MET -1.94 -3.62 1 44 VAL -3.11 -2.42 1 45 ILE -2.94 -1.02 1 46 ILE -0.07 -1.65 1 47 HIS -6.16 -2.38 1 48 LYS -4.82 0.89 1 49 SER 3.86 0.89 1 53 ALA 3.05 2.12 1 55 LYS 4.14 1.93 1 56 ALA 2.27 1.23 1 57 LEU 0.62 0.14 1 60 LYS 2.47 2.18 1 61 PHE 0.53 1.87 1 62 ALA 2.62 1.26 1 63 GLU -2.49 0.09 1 64 SER -1.16 2.40 1 65 THR 5.22 0.31 1 66 GLU 3.50 2.27 1 67 ILE 6.09 1.19 1 70 LEU 1.69 2.58 1 71 SER 4.47 0.85 1 72 HIS 2.59 1.00 1 73 ASN 0.30 -3.49 1 74 PHE -6.24 -0.40 1 75 VAL 2.78 -1.49 1 76 MET 0.19 -1.28 1 77 VAL -5.18 -1.42 1 78 ASN -4.14 -3.55 1 81 ASP 5.68 1.17 1 82 GLU 3.45 -0.36 1 83 GLU -0.55 0.21 1 86 LYS 1.53 -0.26 1 87 ASP -1.06 1.20 1 88 GLU 3.11 1.63 1 89 ASP 3.34 0.35 1 90 PHE 1.34 -0.45 1 93 ASP -1.01 -1.30 1 96 TYR -1.81 -1.72 1 99 ARG -4.51 -2.06 1 100 ILE -0.20 -2.52 1 101 LEU -7.01 -3.52 1 102 PHE -3.01 -1.26 1 103 LEU -4.94 -0.54 1 106 SER 0.28 0.32 1 108 LYS -1.66 0.45 1 109 VAL 2.62 0.14 1 112 GLU 3.03 -0.80 1 113 ILE 3.98 -0.13 1 114 ILE -5.36 -1.96 1 115 ASN 2.21 1.27 1 116 GLU 2.77 0.08 1 117 ASN -0.96 -0.78 1 121 SER 2.40 -3.15 1 122 TYR -3.49 0.74 1 123 LYS 5.61 -0.82 1 124 TYR -0.77 -0.85 1 125 PHE -2.57 -0.67 1 126 TYR -3.53 -2.91 1 127 VAL -1.98 -1.31 1 128 SER -2.60 -0.54 1 129 ALA 4.33 0.76 1 130 GLU 5.26 3.20 1 131 GLN 3.86 3.52 1 132 VAL 6.47 1.39 1 133 VAL 5.88 0.91 1 134 GLN 5.09 3.16 1 136 MET 1.88 2.67 1 137 LYS 5.15 3.03 1 138 GLU 3.39 2.04 1 139 ALA 3.33 1.56 1 140 GLN 4.91 2.64 1 141 GLU 2.53 1.87 1 142 ARG 1.23 2.30 1 143 LEU -0.62 -1.27 1 144 THR 1.57 0.48 1 146 ASP 1.07 0.86 1 147 ALA 1.93 0.40 1 148 PHE 1.02 -0.26 1 151 LYS 0.99 3.22 1 152 HIS -0.53 1.40 1 153 LEU -0.04 -2.36 1 154 GLU 0.20 -0.23 1 156 GLU -0.61 -1.21 1 stop_ save_