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 bmr5872_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 -3.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 9.29 _LACS_plot.Line_2_terminator_val_y_2 6.98 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU -6.46 -2.65 0 10 LEU 3.75 2.73 1 11 GLU 4.13 3.22 1 12 GLU 2.81 2.44 1 13 VAL 4.51 2.70 1 14 ASN 3.54 3.03 1 15 ALA 3.74 2.31 1 16 TRP -0.69 -0.41 1 17 ALA 0.34 0.49 1 18 GLN 1.24 1.26 1 19 SER -1.51 -1.25 1 20 PHE 1.52 1.38 1 21 ASP 3.42 2.16 1 22 LYS 2.92 1.92 1 23 LEU 3.66 2.87 1 24 MET 1.01 -0.62 1 25 VAL 1.52 0.90 1 26 THR -2.56 -2.34 1 28 ALA 3.32 2.74 1 30 ARG 4.47 4.65 1 31 ASN 3.66 2.83 1 32 ALA 2.95 2.63 1 33 PHE 1.62 1.56 1 34 ARG 5.03 4.74 1 35 GLU 4.17 3.12 1 36 PHE 3.13 3.10 1 37 LEU 4.74 2.40 1 38 ARG 4.88 4.29 1 39 THR 2.96 2.34 1 40 GLU -1.18 -1.36 1 41 PHE 4.57 0.92 1 42 SER -1.87 -1.34 1 43 GLU 1.17 1.96 1 44 GLU 5.90 4.01 1 45 ASN 3.93 3.44 1 46 MET 1.37 0.70 1 47 LEU 5.12 3.16 1 48 PHE 3.37 2.67 1 49 TRP 7.32 7.08 1 50 MET 2.78 3.72 1 51 ALA 3.90 2.54 1 53 GLU 2.66 1.64 1 54 GLU 2.04 1.92 1 55 LEU 3.51 2.80 1 56 LYS 3.09 2.37 1 57 LYS -0.11 -0.28 1 58 GLU -0.99 -0.45 1 59 ALA -2.38 -0.27 1 60 ASN -0.39 0.03 1 61 LYS 3.98 3.47 1 62 ASN 4.04 2.97 1 63 ILE 2.90 1.61 1 64 ILE 5.42 4.22 1 65 GLU 4.73 3.86 1 66 GLU 2.52 2.60 1 67 LYS 5.97 3.48 1 68 ALA 4.40 3.03 1 69 ARG 5.67 4.08 1 70 ILE 4.35 3.79 1 71 ILE 5.05 4.27 1 72 TYR 3.76 4.18 1 73 GLU 2.74 2.32 1 74 ASP 2.47 2.27 1 75 TYR -2.13 0.68 1 76 ILE 0.97 -1.18 1 77 SER -0.34 -0.64 1 78 ILE 2.86 1.68 1 79 LEU 1.74 -0.12 1 80 SER -0.13 -0.42 1 82 LYS -1.33 -1.53 1 83 GLU -0.69 -0.05 1 84 VAL -3.19 -2.66 1 85 SER 1.07 -0.35 1 87 ASP -1.34 -0.22 1 88 SER -0.06 -0.72 1 89 ARG 4.51 3.14 1 90 VAL 4.36 3.20 1 91 ARG 4.88 4.36 1 92 GLU 3.37 2.87 1 93 VAL 5.41 4.48 1 94 ILE 5.53 5.03 1 95 ASN 4.03 3.33 1 96 ARG 3.07 2.46 1 97 ASN 0.57 1.19 1 98 MET 2.46 -0.54 1 99 VAL 3.50 1.93 1 100 GLU -1.49 -0.36 1 102 SER -4.00 -1.96 1 103 GLN 3.07 2.27 1 104 HIS 0.66 0.64 1 105 ILE 4.27 2.91 1 106 PHE -1.10 -0.72 1 107 ASP 6.16 4.54 1 108 ASP 4.28 3.24 1 109 ALA 1.82 2.48 1 110 GLN 5.99 4.45 1 111 LEU 3.53 2.67 1 112 GLN 5.73 4.26 1 113 ILE 3.23 0.54 1 114 TYR 4.99 5.37 1 115 THR 5.95 4.86 1 116 LEU 3.73 3.56 1 117 MET 3.26 4.92 1 118 HIS -0.63 1.54 1 119 ARG 1.86 2.18 1 120 ASP 0.44 1.49 1 121 SER 3.21 3.39 1 122 TYR 9.30 6.42 1 124 ARG 2.84 2.70 1 125 PHE 2.55 1.53 1 126 MET 2.16 1.33 1 127 ASN -2.06 -0.97 1 128 SER -2.80 0.06 1 129 ALA 3.22 2.25 1 130 VAL 4.49 3.69 1 131 TYR 3.33 3.49 1 132 LYS 4.85 3.80 1 133 ASP 4.28 2.81 1 134 LEU 3.28 2.74 1 135 LEU 3.60 2.87 1 136 GLN 4.27 3.03 1 137 SER 3.92 2.77 1 138 LEU 0.27 0.99 1 139 SER 2.42 1.88 1 140 GLU 1.02 0.91 1 141 LYS 0.88 0.55 1 142 SER 0.77 0.44 1 143 ILE 0.88 0.59 1 144 GLU 0.16 0.16 1 145 ALA 0.23 0.14 1 146 HIS -0.19 0.79 1 147 HIS 0.52 2.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5872_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 3.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 9.29 _LACS_plot.Line_2_terminator_val_y_2 -2.31 _LACS_plot.Y_axis_chem_shift_offset -0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU -6.46 3.81 0 10 LEU 3.75 -1.02 1 11 GLU 4.13 -0.91 1 12 GLU 2.81 -0.37 1 13 VAL 4.51 -1.81 1 14 ASN 3.54 -0.51 1 15 ALA 3.74 -1.43 1 16 TRP -0.69 0.28 1 17 ALA 0.34 0.15 1 18 GLN 1.24 0.02 1 19 SER -1.51 0.26 1 20 PHE 1.52 -0.14 1 21 ASP 3.42 -1.26 1 22 LYS 2.92 -1.00 1 23 LEU 3.66 -0.79 1 24 MET 1.01 -1.63 1 25 VAL 1.52 -0.62 1 26 THR -2.56 0.22 1 28 ALA 3.32 -0.58 1 30 ARG 4.47 0.18 1 31 ASN 3.66 -0.83 1 32 ALA 2.95 -0.32 1 33 PHE 1.62 -0.06 1 34 ARG 5.03 -0.29 1 35 GLU 4.17 -1.05 1 36 PHE 3.13 -0.03 1 37 LEU 4.74 -2.34 1 38 ARG 4.88 -0.59 1 39 THR 2.96 -0.62 1 40 GLU -1.18 -0.18 1 41 PHE 4.57 -3.65 1 42 SER -1.87 0.53 1 43 GLU 1.17 0.79 1 44 GLU 5.90 -1.89 1 45 ASN 3.93 -0.49 1 46 MET 1.37 -0.67 1 47 LEU 5.12 -1.96 1 48 PHE 3.37 -0.70 1 49 TRP 7.32 -0.24 1 50 MET 2.78 0.94 1 51 ALA 3.90 -1.36 1 53 GLU 2.66 -1.02 1 54 GLU 2.04 -0.12 1 55 LEU 3.51 -0.71 1 56 LYS 3.09 -0.72 1 57 LYS -0.11 -0.17 1 58 GLU -0.99 0.54 1 59 ALA -2.38 2.11 1 60 ASN -0.39 0.42 1 61 LYS 3.98 -0.51 1 62 ASN 4.04 -1.07 1 63 ILE 2.90 -1.29 1 64 ILE 5.42 -1.20 1 65 GLU 4.73 -0.87 1 66 GLU 2.52 0.08 1 67 LYS 5.97 -2.49 1 68 ALA 4.40 -1.37 1 69 ARG 5.67 -1.59 1 70 ILE 4.35 -0.56 1 71 ILE 5.05 -0.78 1 72 TYR 3.76 0.42 1 73 GLU 2.74 -0.42 1 74 ASP 2.47 -0.20 1 75 TYR -2.13 2.81 1 76 ILE 0.97 -2.15 1 77 SER -0.34 -0.30 1 78 ILE 2.86 -1.18 1 79 LEU 1.74 -1.86 1 80 SER -0.13 -0.29 1 82 LYS -1.33 -0.20 1 83 GLU -0.69 0.64 1 84 VAL -3.19 0.53 1 85 SER 1.07 -1.42 1 87 ASP -1.34 1.12 1 88 SER -0.06 -0.66 1 89 ARG 4.51 -1.37 1 90 VAL 4.36 -1.16 1 91 ARG 4.88 -0.52 1 92 GLU 3.37 -0.50 1 93 VAL 5.41 -0.93 1 94 ILE 5.53 -0.50 1 95 ASN 4.03 -0.70 1 96 ARG 3.07 -0.61 1 97 ASN 0.57 0.62 1 98 MET 2.46 -3.00 1 99 VAL 3.50 -1.57 1 100 GLU -1.49 1.13 1 102 SER -4.00 2.04 1 103 GLN 3.07 -0.80 1 104 HIS 0.66 -0.02 1 105 ILE 4.27 -1.36 1 106 PHE -1.10 0.38 1 107 ASP 6.16 -1.62 1 108 ASP 4.28 -1.04 1 109 ALA 1.82 0.66 1 110 GLN 5.99 -1.54 1 111 LEU 3.53 -0.86 1 112 GLN 5.73 -1.47 1 113 ILE 3.23 -2.69 1 114 TYR 4.99 0.38 1 115 THR 5.95 -1.09 1 116 LEU 3.73 -0.17 1 117 MET 3.26 1.66 1 118 HIS -0.63 2.17 1 119 ARG 1.86 0.32 1 120 ASP 0.44 1.05 1 121 SER 3.21 0.18 1 122 TYR 9.30 -2.88 1 124 ARG 2.84 -0.14 1 125 PHE 2.55 -1.02 1 126 MET 2.16 -0.83 1 127 ASN -2.06 1.09 1 128 SER -2.80 2.86 1 129 ALA 3.22 -0.97 1 130 VAL 4.49 -0.80 1 131 TYR 3.33 0.16 1 132 LYS 4.85 -1.05 1 133 ASP 4.28 -1.47 1 134 LEU 3.28 -0.54 1 135 LEU 3.60 -0.73 1 136 GLN 4.27 -1.24 1 137 SER 3.92 -1.15 1 138 LEU 0.27 0.72 1 139 SER 2.42 -0.54 1 140 GLU 1.02 -0.11 1 141 LYS 0.88 -0.33 1 142 SER 0.77 -0.33 1 143 ILE 0.88 -0.29 1 144 GLU 0.16 0.00 1 145 ALA 0.23 -0.09 1 146 HIS -0.19 0.98 1 147 HIS 0.52 1.66 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5872_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.46 _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 -0.26 _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 7.32 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _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 118 HIS -0.63 -1.68 0 10 LEU 3.75 -0.67 1 11 GLU 4.13 -0.52 1 12 GLU 2.81 -0.55 1 13 VAL 4.51 0.39 1 14 ASN 3.54 -0.41 1 15 ALA 3.74 -0.19 1 16 TRP -0.69 -0.12 1 17 ALA 0.34 0.18 1 18 GLN 1.24 -0.09 1 19 SER -1.51 0.08 1 20 PHE 1.52 -1.20 1 21 ASP 3.42 -0.86 1 22 LYS 2.92 -0.40 1 23 LEU 3.66 -0.97 1 24 MET 1.01 -0.77 1 25 VAL 1.52 -0.02 1 26 THR -2.56 0.50 1 28 ALA 3.32 -0.16 1 30 ARG 4.47 -0.78 1 31 ASN 3.66 -0.41 1 32 ALA 2.95 -0.05 1 33 PHE 1.62 -0.83 1 34 ARG 5.03 -0.82 1 35 GLU 4.17 -0.54 1 36 PHE 3.13 -0.22 1 37 LEU 4.74 -0.09 1 38 ARG 4.88 -0.47 1 39 THR 2.96 -0.44 1 40 GLU -1.18 -0.16 1 41 PHE 4.57 -0.30 1 42 SER -1.87 0.52 1 43 GLU 1.17 -0.75 1 44 GLU 5.90 -0.37 1 45 ASN 3.93 -0.24 1 46 MET 1.37 0.03 1 47 LEU 5.12 -0.29 1 48 PHE 3.37 -1.32 1 49 TRP 7.32 -0.88 1 50 MET 2.78 -0.92 1 51 ALA 3.90 -0.30 1 53 GLU 2.66 -0.34 1 54 GLU 2.04 -0.55 1 55 LEU 3.51 -0.49 1 56 LYS 3.09 -0.67 1 57 LYS -0.11 -0.17 1 58 GLU -0.99 -0.24 1 59 ALA -2.38 0.11 1 60 ASN -0.39 -0.06 1 61 LYS 3.98 -0.48 1 62 ASN 4.04 -0.27 1 63 ILE 2.90 -0.17 1 64 ILE 5.42 -0.85 1 65 GLU 4.73 -0.72 1 66 GLU 2.52 -0.33 1 67 LYS 5.97 -0.31 1 68 ALA 4.40 0.00 1 69 ARG 5.67 -0.34 1 70 ILE 4.35 -0.44 1 71 ILE 5.05 -0.44 1 72 TYR 3.76 -0.65 1 73 GLU 2.74 -0.50 1 74 ASP 2.47 -0.29 1 75 TYR -2.13 0.14 1 76 ILE 0.97 -0.17 1 77 SER -0.34 -0.63 1 79 LEU 1.74 -0.21 1 83 GLU -0.69 -0.34 1 84 VAL -3.19 0.35 1 85 SER 1.07 -0.21 1 86 LEU -6.46 0.33 1 87 ASP -1.34 -0.10 1 88 SER -0.06 -0.44 1 89 ARG 4.51 -0.23 1 90 VAL 4.36 -0.34 1 91 ARG 4.88 -0.57 1 92 GLU 3.37 -0.26 1 93 VAL 5.41 -0.59 1 94 ILE 5.53 -0.62 1 95 ASN 4.03 -0.59 1 96 ARG 3.07 -0.27 1 97 ASN 0.57 -0.09 1 98 MET 2.46 -0.34 1 99 VAL 3.50 -0.32 1 102 SER -4.00 0.13 1 103 GLN 3.07 -0.60 1 104 HIS 0.66 -0.04 1 105 ILE 4.27 -0.40 1 106 PHE -1.10 0.31 1 107 ASP 6.16 -0.43 1 108 ASP 4.28 -0.04 1 109 ALA 1.82 -0.27 1 110 GLN 5.99 -0.48 1 111 LEU 3.53 0.06 1 112 GLN 5.73 -0.20 1 113 ILE 3.23 0.01 1 114 TYR 4.99 -0.66 1 115 THR 5.95 -0.41 1 116 LEU 3.73 -0.28 1 117 MET 3.26 -0.39 1 119 ARG 1.86 -0.53 1 120 ASP 0.44 0.18 1 121 SER 3.21 0.22 1 124 ARG 2.84 -0.27 1 125 PHE 2.55 -1.48 1 126 MET 2.16 -1.13 1 127 ASN -2.06 0.07 1 128 SER -2.80 -0.06 1 129 ALA 3.22 -0.25 1 130 VAL 4.49 -0.34 1 131 TYR 3.33 -0.62 1 132 LYS 4.85 -0.81 1 133 ASP 4.28 -0.34 1 134 LEU 3.28 -0.28 1 135 LEU 3.60 -0.82 1 136 GLN 4.27 -0.47 1 137 SER 3.92 -0.31 1 138 LEU 0.27 -0.14 1 139 SER 2.42 -0.24 1 140 GLU 1.02 -0.23 1 141 LYS 0.88 -0.10 1 142 SER 0.77 -0.11 1 143 ILE 0.88 -0.13 1 144 GLU 0.16 -0.24 1 145 ALA 0.23 -0.20 1 146 HIS -0.19 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5872_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.46 _LACS_plot.Line_1_terminator_val_y_1 -1.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.14 _LACS_plot.Line_2_terminator_val_x_2 7.32 _LACS_plot.Line_2_terminator_val_y_2 2.87 _LACS_plot.Y_axis_chem_shift_offset -0.52 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU -6.46 -0.82 0 10 LEU 3.75 0.14 1 11 GLU 4.13 2.99 1 12 GLU 2.81 0.00 1 13 VAL 4.51 4.41 1 14 ASN 3.54 2.71 1 15 ALA 3.74 2.34 1 16 TRP -0.69 0.99 1 17 ALA 0.34 -0.04 1 18 GLN 1.24 0.99 1 19 SER -1.51 -1.15 1 20 PHE 1.52 0.70 1 21 ASP 3.42 1.97 1 22 LYS 2.92 1.93 1 23 LEU 3.66 -0.96 1 24 MET 1.01 2.01 1 25 VAL 1.52 -0.13 1 28 ALA 3.32 2.96 1 30 ARG 4.47 2.64 1 31 ASN 3.66 2.73 1 32 ALA 2.95 1.45 1 33 PHE 1.62 2.25 1 34 ARG 5.03 1.17 1 35 GLU 4.17 3.01 1 36 PHE 3.13 2.16 1 37 LEU 4.74 2.70 1 38 ARG 4.88 3.61 1 39 THR 2.96 -0.32 1 40 GLU -1.18 -1.41 1 41 PHE 4.57 1.95 1 42 SER -1.87 0.80 1 43 GLU 1.17 1.25 1 44 GLU 5.90 0.30 1 45 ASN 3.93 1.72 1 46 MET 1.37 1.63 1 47 LEU 5.12 2.40 1 48 PHE 3.37 0.51 1 49 TRP 7.32 2.25 1 50 MET 2.78 2.10 1 51 ALA 3.90 3.27 1 53 GLU 2.66 2.30 1 54 GLU 2.04 2.99 1 55 LEU 3.51 0.39 1 56 LYS 3.09 0.25 1 57 LYS -0.11 0.25 1 58 GLU -0.99 -1.62 1 59 ALA -2.38 0.10 1 60 ASN -0.39 0.58 1 61 LYS 3.98 0.85 1 62 ASN 4.04 3.11 1 63 ILE 2.90 0.98 1 64 ILE 5.42 0.64 1 65 GLU 4.73 1.53 1 66 GLU 2.52 2.66 1 67 LYS 5.97 3.04 1 68 ALA 4.40 1.48 1 69 ARG 5.67 2.01 1 70 ILE 4.35 1.59 1 71 ILE 5.05 1.90 1 72 TYR 3.76 2.24 1 73 GLU 2.74 1.19 1 74 ASP 2.47 1.55 1 75 TYR -2.13 -1.12 1 76 ILE 0.97 -0.13 1 77 SER -0.34 0.74 1 79 LEU 1.74 -0.30 1 83 GLU -0.69 0.80 1 84 VAL -3.19 0.08 1 85 SER 1.07 -1.46 1 87 ASP -1.34 0.63 1 88 SER -0.06 2.18 1 89 ARG 4.51 2.55 1 90 VAL 4.36 2.77 1 91 ARG 4.88 1.19 1 92 GLU 3.37 2.42 1 93 VAL 5.41 2.39 1 94 ILE 5.53 1.47 1 95 ASN 4.03 3.02 1 96 ARG 3.07 1.64 1 97 ASN 0.57 0.91 1 98 MET 2.46 0.28 1 99 VAL 3.50 -0.12 1 102 SER -4.00 -0.59 1 103 GLN 3.07 -0.99 1 104 HIS 0.66 2.42 1 105 ILE 4.27 -0.96 1 106 PHE -1.10 -0.28 1 107 ASP 6.16 2.41 1 108 ASP 4.28 2.96 1 109 ALA 1.82 0.80 1 110 GLN 5.99 2.35 1 111 LEU 3.53 2.51 1 112 GLN 5.73 3.34 1 113 ILE 3.23 1.37 1 114 TYR 4.99 1.37 1 115 THR 5.95 1.15 1 116 LEU 3.73 1.56 1 117 MET 3.26 1.35 1 118 HIS -0.63 2.22 1 119 ARG 1.86 0.92 1 120 ASP 0.44 1.24 1 121 SER 3.21 0.93 1 124 ARG 2.84 3.68 1 125 PHE 2.55 2.68 1 126 MET 2.16 -0.79 1 127 ASN -2.06 -0.75 1 128 SER -2.80 -0.27 1 129 ALA 3.22 1.30 1 130 VAL 4.49 1.91 1 131 TYR 3.33 0.55 1 132 LYS 4.85 3.14 1 133 ASP 4.28 3.03 1 134 LEU 3.28 1.14 1 135 LEU 3.60 2.18 1 136 GLN 4.27 2.51 1 137 SER 3.92 2.04 1 138 LEU 0.27 0.89 1 139 SER 2.42 0.67 1 140 GLU 1.02 0.65 1 141 LYS 0.88 0.50 1 142 SER 0.77 0.44 1 143 ILE 0.88 0.26 1 144 GLU 0.16 -0.18 1 145 ALA 0.23 -0.18 1 146 HIS -0.19 -0.13 1 stop_ save_