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 bmr15383_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.00 _LACS_plot.Line_1_terminator_val_y_1 -1.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.87 _LACS_plot.Line_2_terminator_val_x_2 7.65 _LACS_plot.Line_2_terminator_val_y_2 5.41 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 HIS -4.07 0.00 0 108 HIS 3.61 5.56 0 34 HIS 3.97 5.80 0 10 ARG 4.57 3.31 1 11 ALA 3.24 3.33 1 12 GLN 5.03 3.93 1 13 LYS 4.27 2.71 1 14 VAL 7.42 5.19 1 15 LEU 5.31 2.62 1 16 ALA 4.04 2.93 1 17 LEU 2.53 2.45 1 18 ALA 3.22 2.53 1 19 GLN 4.95 3.65 1 20 GLU 3.36 3.02 1 21 GLU 1.97 1.95 1 22 ALA 5.99 3.56 1 23 LEU 3.55 2.81 1 24 ARG 3.89 3.34 1 25 LEU -0.49 -0.34 1 28 ASN -0.30 -0.20 1 29 ASN -4.01 -1.54 1 30 ILE 0.86 0.23 1 32 THR 7.61 5.03 1 33 GLU 4.10 1.83 1 35 ILE 6.51 4.80 1 36 LEU 4.64 3.26 1 37 LEU 4.11 2.98 1 39 LEU 2.26 2.98 1 40 VAL 3.50 2.27 1 41 ARG 2.51 2.08 1 42 GLU 3.87 3.02 1 44 GLU -2.42 0.05 1 46 ILE 4.83 1.83 1 47 ALA 1.61 2.97 1 48 ALA 4.28 3.02 1 49 LYS 3.37 2.76 1 50 ALA 4.33 2.73 1 51 LEU 4.95 3.09 1 52 GLN 4.58 3.44 1 53 ALA 3.35 2.33 1 54 LEU 0.22 -0.22 1 56 LEU -1.62 -1.58 1 58 SER 5.38 4.09 1 59 GLU 4.26 3.16 1 60 LYS 3.17 2.77 1 61 ILE 5.49 4.08 1 62 GLN 5.80 4.42 1 63 LYS 3.90 3.02 1 64 GLU 2.80 2.30 1 65 VAL 6.16 5.05 1 66 GLU 4.03 3.52 1 67 SER 3.05 2.66 1 68 LEU -0.51 1.20 1 69 ILE -0.85 0.06 1 71 ARG -1.33 -0.22 1 73 GLN -1.23 -0.40 1 74 GLU -0.74 -0.21 1 75 MET -0.91 -0.32 1 76 SER -0.54 -0.22 1 77 GLN 0.24 0.72 1 78 THR -0.53 -0.41 1 79 ILE -1.21 -0.65 1 80 HIS -2.90 -0.36 1 81 TYR -0.82 0.21 1 82 THR 1.59 0.41 1 84 ARG 4.51 3.02 1 85 ALA 3.29 3.41 1 86 LYS 5.30 4.13 1 87 LYS 3.91 2.23 1 88 VAL 7.36 5.17 1 89 ILE 6.38 4.09 1 90 GLU 3.72 3.53 1 91 LEU 2.22 2.38 1 92 SER 5.74 4.52 1 93 MET 3.69 3.51 1 94 ASP 2.40 3.74 1 95 GLU 2.81 2.43 1 96 ALA 5.88 3.56 1 97 ARG 4.73 3.47 1 98 LYS 3.86 3.36 1 99 LEU -0.14 -0.22 1 101 HIS -4.32 -0.36 1 102 SER 0.79 0.70 1 103 TYR -5.00 -2.43 1 104 VAL 0.56 -0.21 1 106 THR 7.65 5.06 1 107 GLU 4.19 1.95 1 109 ILE 4.46 2.85 1 110 LEU 4.71 3.33 1 111 LEU 4.84 3.10 1 113 LEU 2.35 2.86 1 114 ILE 3.74 3.79 1 115 ARG 2.38 2.31 1 116 GLU 4.93 4.08 1 118 GLU -2.50 0.41 1 120 VAL 5.06 4.29 1 121 ALA 1.25 2.85 1 122 ALA 4.03 2.97 1 123 ARG 4.28 3.38 1 124 VAL 5.89 4.41 1 125 LEU 5.89 3.56 1 126 ASN 3.72 3.94 1 127 ASN 3.83 2.51 1 128 LEU 0.09 -0.70 1 130 VAL 1.97 0.25 1 131 SER -4.31 -2.47 1 132 LEU 5.07 3.69 1 133 ASN 4.18 3.32 1 134 LYS 3.19 3.06 1 135 ALA 4.14 3.09 1 136 ARG 5.35 4.68 1 137 GLN 4.39 3.31 1 138 GLN 2.80 2.40 1 139 VAL 6.51 5.14 1 140 LEU 4.71 3.21 1 141 GLN 4.26 3.22 1 142 LEU 1.87 1.91 1 143 LEU 0.92 1.08 1 145 SER -0.56 -0.12 1 146 ASN 0.13 1.89 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15383_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.00 _LACS_plot.Line_1_terminator_val_y_1 3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.13 _LACS_plot.Line_2_terminator_val_x_2 7.65 _LACS_plot.Line_2_terminator_val_y_2 -2.24 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 HIS -4.07 4.07 0 108 HIS 3.61 1.95 0 34 HIS 3.97 1.83 0 10 ARG 4.57 -1.26 1 11 ALA 3.24 0.09 1 12 GLN 5.03 -1.10 1 13 LYS 4.27 -1.56 1 14 VAL 7.42 -2.23 1 15 LEU 5.31 -2.69 1 16 ALA 4.04 -1.11 1 17 LEU 2.53 -0.08 1 18 ALA 3.22 -0.69 1 19 GLN 4.95 -1.30 1 20 GLU 3.36 -0.34 1 21 GLU 1.97 -0.02 1 22 ALA 5.99 -2.43 1 23 LEU 3.55 -0.74 1 24 ARG 3.89 -0.55 1 25 LEU -0.49 0.15 1 28 ASN -0.30 0.10 1 29 ASN -4.01 2.47 1 30 ILE 0.86 -0.63 1 32 THR 7.61 -2.58 1 33 GLU 4.10 -2.27 1 35 ILE 6.51 -1.71 1 36 LEU 4.64 -1.38 1 37 LEU 4.11 -1.13 1 39 LEU 2.26 0.72 1 40 VAL 3.50 -1.23 1 41 ARG 2.51 -0.43 1 42 GLU 3.87 -0.85 1 44 GLU -2.42 2.47 1 46 ILE 4.83 -3.00 1 47 ALA 1.61 1.36 1 48 ALA 4.28 -1.26 1 49 LYS 3.37 -0.61 1 50 ALA 4.33 -1.60 1 51 LEU 4.95 -1.86 1 52 GLN 4.58 -1.14 1 53 ALA 3.35 -1.02 1 54 LEU 0.22 -0.44 1 56 LEU -1.62 0.04 1 58 SER 5.38 -1.29 1 59 GLU 4.26 -1.10 1 60 LYS 3.17 -0.40 1 61 ILE 5.49 -1.41 1 62 GLN 5.80 -1.38 1 63 LYS 3.90 -0.88 1 64 GLU 2.80 -0.50 1 65 VAL 6.16 -1.11 1 66 GLU 4.03 -0.51 1 67 SER 3.05 -0.39 1 68 LEU -0.51 1.71 1 69 ILE -0.85 0.91 1 71 ARG -1.33 1.11 1 73 GLN -1.23 0.83 1 74 GLU -0.74 0.53 1 75 MET -0.91 0.59 1 76 SER -0.54 0.32 1 77 GLN 0.24 0.48 1 78 THR -0.53 0.12 1 79 ILE -1.21 0.56 1 80 HIS -2.90 2.54 1 81 TYR -0.82 1.03 1 82 THR 1.59 -1.18 1 84 ARG 4.51 -1.49 1 85 ALA 3.29 0.12 1 86 LYS 5.30 -1.17 1 87 LYS 3.91 -1.68 1 88 VAL 7.36 -2.19 1 89 ILE 6.38 -2.29 1 90 GLU 3.72 -0.19 1 91 LEU 2.22 0.16 1 92 SER 5.74 -1.22 1 93 MET 3.69 -0.18 1 94 ASP 2.40 1.34 1 95 GLU 2.81 -0.38 1 96 ALA 5.88 -2.32 1 97 ARG 4.73 -1.26 1 98 LYS 3.86 -0.50 1 99 LEU -0.14 -0.08 1 101 HIS -4.32 3.96 1 102 SER 0.79 -0.09 1 103 TYR -5.00 2.57 1 104 VAL 0.56 -0.77 1 106 THR 7.65 -2.59 1 107 GLU 4.19 -2.24 1 109 ILE 4.46 -1.61 1 110 LEU 4.71 -1.38 1 111 LEU 4.84 -1.74 1 113 LEU 2.35 0.51 1 114 ILE 3.74 0.05 1 115 ARG 2.38 -0.07 1 116 GLU 4.93 -0.85 1 118 GLU -2.50 2.91 1 120 VAL 5.06 -0.77 1 121 ALA 1.25 1.60 1 122 ALA 4.03 -1.06 1 123 ARG 4.28 -0.90 1 124 VAL 5.89 -1.48 1 125 LEU 5.89 -2.33 1 126 ASN 3.72 0.22 1 127 ASN 3.83 -1.32 1 128 LEU 0.09 -0.79 1 130 VAL 1.97 -1.72 1 131 SER -4.31 1.84 1 132 LEU 5.07 -1.38 1 133 ASN 4.18 -0.86 1 134 LYS 3.19 -0.13 1 135 ALA 4.14 -1.05 1 136 ARG 5.35 -0.67 1 137 GLN 4.39 -1.08 1 138 GLN 2.80 -0.40 1 139 VAL 6.51 -1.37 1 140 LEU 4.71 -1.50 1 141 GLN 4.26 -1.04 1 142 LEU 1.87 0.04 1 143 LEU 0.92 0.16 1 145 SER -0.56 0.44 1 146 ASN 0.13 1.76 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15383_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.00 _LACS_plot.Line_1_terminator_val_y_1 0.42 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 7.65 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 81 TYR -0.82 0.63 0 109 ILE 4.46 0.23 0 10 ARG 4.57 -0.17 1 11 ALA 3.24 -0.42 1 12 GLN 5.03 -0.43 1 13 LYS 4.27 -0.08 1 14 VAL 7.42 -0.70 1 15 LEU 5.31 -0.22 1 16 ALA 4.04 -0.06 1 17 LEU 2.53 -0.21 1 18 ALA 3.22 -0.23 1 19 GLN 4.95 -0.55 1 20 GLU 3.36 -0.35 1 21 GLU 1.97 -0.13 1 22 ALA 5.99 -0.79 1 23 LEU 3.55 -0.24 1 24 ARG 3.89 -0.33 1 25 LEU -0.49 -0.13 1 27 HIS -4.07 0.20 1 28 ASN -0.30 -0.07 1 29 ASN -4.01 0.30 1 30 ILE 0.86 -0.16 1 32 THR 7.61 -0.65 1 33 GLU 4.10 -0.58 1 34 HIS 3.97 -0.47 1 35 ILE 6.51 -0.52 1 36 LEU 4.64 -0.32 1 37 LEU 4.11 -0.32 1 39 LEU 2.26 -0.22 1 40 VAL 3.50 -0.19 1 41 ARG 2.51 -0.26 1 42 GLU 3.87 -0.38 1 44 GLU -2.42 0.19 1 46 ILE 4.83 -0.55 1 47 ALA 1.61 -0.55 1 48 ALA 4.28 -0.42 1 49 LYS 3.37 -0.32 1 50 ALA 4.33 -0.41 1 51 LEU 4.95 -0.40 1 52 GLN 4.58 -0.31 1 53 ALA 3.35 -0.13 1 54 LEU 0.22 0.00 1 56 LEU -1.62 0.21 1 58 SER 5.38 -0.62 1 59 GLU 4.26 -0.24 1 60 LYS 3.17 -0.21 1 61 ILE 5.49 -0.68 1 62 GLN 5.80 -0.63 1 63 LYS 3.90 -0.24 1 64 GLU 2.80 -0.21 1 65 VAL 6.16 -0.73 1 66 GLU 4.03 -0.41 1 67 SER 3.05 -0.12 1 68 LEU -0.51 0.13 1 69 ILE -0.85 0.34 1 71 ARG -1.33 0.36 1 73 GLN -1.23 0.24 1 74 GLU -0.74 0.00 1 75 MET -0.91 0.10 1 76 SER -0.54 0.08 1 77 GLN 0.24 0.05 1 78 THR -0.53 0.00 1 79 ILE -1.21 0.29 1 80 HIS -2.90 0.22 1 82 THR 1.59 0.13 1 84 ARG 4.51 -0.13 1 85 ALA 3.29 -0.44 1 86 LYS 5.30 -0.51 1 87 LYS 3.91 -0.09 1 88 VAL 7.36 -0.71 1 89 ILE 6.38 -0.49 1 90 GLU 3.72 -0.24 1 91 LEU 2.22 -0.16 1 92 SER 5.74 -0.29 1 93 MET 3.69 -0.57 1 94 ASP 2.40 -0.21 1 95 GLU 2.81 -0.44 1 96 ALA 5.88 -0.81 1 97 ARG 4.73 -0.33 1 98 LYS 3.86 -0.38 1 99 LEU -0.14 -0.13 1 101 HIS -4.32 0.26 1 102 SER 0.79 -0.16 1 103 TYR -5.00 0.30 1 104 VAL 0.56 -0.02 1 106 THR 7.65 -0.62 1 107 GLU 4.19 -0.61 1 108 HIS 3.61 -0.50 1 110 LEU 4.71 -0.40 1 111 LEU 4.84 -0.40 1 113 LEU 2.35 -0.28 1 114 ILE 3.74 -0.56 1 115 ARG 2.38 -0.38 1 116 GLU 4.93 -0.62 1 118 GLU -2.50 0.20 1 120 VAL 5.06 -0.70 1 121 ALA 1.25 -0.63 1 122 ALA 4.03 -0.54 1 123 ARG 4.28 -0.35 1 124 VAL 5.89 -0.57 1 125 LEU 5.89 -0.53 1 126 ASN 3.72 -0.40 1 127 ASN 3.83 -0.29 1 128 LEU 0.09 0.08 1 130 VAL 1.97 -0.18 1 131 SER -4.31 0.17 1 132 LEU 5.07 -0.36 1 133 ASN 4.18 -0.32 1 134 LYS 3.19 -0.21 1 135 ALA 4.14 -0.43 1 136 ARG 5.35 -0.64 1 137 GLN 4.39 -0.34 1 138 GLN 2.80 -0.26 1 139 VAL 6.51 -0.69 1 140 LEU 4.71 -0.28 1 141 GLN 4.26 -0.19 1 142 LEU 1.87 -0.11 1 143 LEU 0.92 -0.06 1 145 SER -0.56 0.14 1 146 ASN 0.13 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15383_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.00 _LACS_plot.Line_1_terminator_val_y_1 -1.50 _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 -0.28 _LACS_plot.Line_2_terminator_val_x_2 7.65 _LACS_plot.Line_2_terminator_val_y_2 2.72 _LACS_plot.Y_axis_chem_shift_offset -0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 VAL 1.97 -2.99 0 103 TYR -5.00 -2.72 0 101 HIS -4.32 1.52 0 10 ARG 4.57 2.01 1 11 ALA 3.24 1.44 1 12 GLN 5.03 3.51 1 13 LYS 4.27 1.83 1 14 VAL 7.42 1.17 1 15 LEU 5.31 2.25 1 16 ALA 4.04 3.86 1 17 LEU 2.53 1.59 1 18 ALA 3.22 1.38 1 19 GLN 4.95 1.31 1 20 GLU 3.36 3.20 1 21 GLU 1.97 1.31 1 22 ALA 5.99 1.65 1 23 LEU 3.55 3.58 1 24 ARG 3.89 1.97 1 25 LEU -0.49 -1.75 1 27 HIS -4.07 0.39 1 28 ASN -0.30 -1.35 1 29 ASN -4.01 -2.10 1 30 ILE 0.86 -1.15 1 32 THR 7.61 2.30 1 33 GLU 4.10 -0.19 1 34 HIS 3.97 3.92 1 35 ILE 6.51 0.60 1 36 LEU 4.64 -0.30 1 37 LEU 4.11 2.00 1 39 LEU 2.26 1.80 1 40 VAL 3.50 1.63 1 41 ARG 2.51 1.36 1 42 GLU 3.87 2.75 1 44 GLU -2.42 0.62 1 46 ILE 4.83 0.08 1 47 ALA 1.61 0.38 1 48 ALA 4.28 3.02 1 49 LYS 3.37 2.98 1 50 ALA 4.33 0.90 1 51 LEU 4.95 1.46 1 52 GLN 4.58 4.68 1 53 ALA 3.35 1.64 1 54 LEU 0.22 -1.16 1 56 LEU -1.62 -3.06 1 58 SER 5.38 1.59 1 59 GLU 4.26 0.75 1 60 LYS 3.17 2.31 1 61 ILE 5.49 0.77 1 62 GLN 5.80 1.89 1 63 LYS 3.90 3.01 1 64 GLU 2.80 2.96 1 65 VAL 6.16 1.66 1 66 GLU 4.03 2.40 1 67 SER 3.05 0.74 1 68 LEU -0.51 0.72 1 69 ILE -0.85 -0.16 1 71 ARG -1.33 1.01 1 73 GLN -1.23 -2.85 1 74 GLU -0.74 -0.46 1 75 MET -0.91 -0.27 1 76 SER -0.54 1.16 1 77 GLN 0.24 -0.25 1 78 THR -0.53 -1.14 1 79 ILE -1.21 -1.11 1 80 HIS -2.90 -0.03 1 81 TYR -0.82 1.61 1 82 THR 1.59 -2.11 1 84 ARG 4.51 0.78 1 85 ALA 3.29 1.60 1 86 LYS 5.30 2.77 1 87 LYS 3.91 1.77 1 88 VAL 7.36 2.47 1 89 ILE 6.38 1.87 1 90 GLU 3.72 3.96 1 91 LEU 2.22 1.69 1 92 SER 5.74 1.34 1 93 MET 3.69 2.24 1 94 ASP 2.40 1.70 1 95 GLU 2.81 2.22 1 96 ALA 5.88 1.38 1 97 ARG 4.73 4.79 1 98 LYS 3.86 2.01 1 99 LEU -0.14 -1.09 1 102 SER 0.79 -1.88 1 104 VAL 0.56 -0.65 1 106 THR 7.65 2.22 1 107 GLU 4.19 -0.43 1 108 HIS 3.61 3.56 1 109 ILE 4.46 1.40 1 110 LEU 4.71 -0.58 1 111 LEU 4.84 1.63 1 113 LEU 2.35 1.45 1 114 ILE 3.74 2.20 1 115 ARG 2.38 1.34 1 116 GLU 4.93 3.34 1 118 GLU -2.50 0.87 1 120 VAL 5.06 1.04 1 121 ALA 1.25 0.10 1 122 ALA 4.03 1.98 1 123 ARG 4.28 2.60 1 124 VAL 5.89 0.16 1 125 LEU 5.89 1.03 1 126 ASN 3.72 4.41 1 127 ASN 3.83 2.18 1 128 LEU 0.09 -1.05 1 131 SER -4.31 0.38 1 132 LEU 5.07 0.76 1 133 ASN 4.18 2.74 1 134 LYS 3.19 2.58 1 135 ALA 4.14 0.76 1 136 ARG 5.35 1.42 1 137 GLN 4.39 2.62 1 138 GLN 2.80 2.66 1 139 VAL 6.51 0.90 1 140 LEU 4.71 2.77 1 141 GLN 4.26 3.20 1 142 LEU 1.87 1.40 1 143 LEU 0.92 0.72 1 145 SER -0.56 -1.16 1 stop_ save_