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 bmr6787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -5.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.66 _LACS_plot.Line_2_terminator_val_x_2 4.96 _LACS_plot.Line_2_terminator_val_y_2 0.79 _LACS_plot.Y_axis_chem_shift_offset 2.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 ILE 1.95 -4.87 0 10 ALA 0.53 -2.17 1 11 THR -0.29 -2.71 1 12 THR 0.17 -2.45 1 13 LEU -0.31 -1.66 1 15 ALA -5.33 -4.52 1 16 LEU -7.16 -3.80 1 17 GLU -4.84 -4.79 1 18 PHE -4.16 -4.85 1 19 SER -4.85 -4.61 1 20 LEU -8.10 -4.39 1 21 LEU -4.44 -2.92 1 22 TYR -3.24 -5.83 1 23 ASP -2.02 -5.31 1 24 GLN 2.82 0.40 1 25 ASP 4.20 0.47 1 26 ASN -1.24 -2.84 1 27 SER 2.52 -2.26 1 28 ASN -5.89 -4.48 1 29 LEU -4.40 -4.00 1 30 GLN -2.13 -3.52 1 32 THR 0.84 -2.16 1 34 ILE 4.47 1.91 1 35 ARG -3.68 -4.01 1 36 ALA -5.95 -4.98 1 37 LYS -5.21 -4.44 1 39 LEU -0.35 -2.99 1 40 LYS -3.18 -4.39 1 42 MET -3.29 -5.05 1 43 ASP -5.82 -4.22 1 45 ASN 1.34 -3.04 1 47 LEU -2.68 -5.25 1 48 ALA -2.95 -3.72 1 49 ASP -1.79 -2.92 1 51 TYR -4.55 -4.09 1 52 VAL -2.38 -4.47 1 53 LYS -4.48 -3.97 1 54 LEU -3.90 -4.16 1 55 HIS -5.56 -2.98 1 56 LEU -1.62 -3.42 1 60 ALA -0.10 -2.43 1 61 SER 1.56 -1.09 1 62 LYS 2.99 -0.31 1 63 SER 1.12 -1.75 1 64 ASN 1.02 -1.46 1 65 LYS -0.52 -2.58 1 66 LEU -5.19 -3.95 1 67 ARG -3.50 -3.66 1 68 THR -3.99 -3.38 1 69 LYS 1.10 -1.61 1 70 THR 0.12 -1.93 1 71 LEU -2.73 -4.65 1 72 ARG -1.76 -3.76 1 73 ASN 2.68 -1.74 1 74 THR -0.06 -3.59 1 75 ARG -1.89 -3.80 1 76 ASN -2.31 -2.32 1 78 VAL -0.13 -2.91 1 79 TRP 4.67 2.17 1 80 ASN 2.08 -1.24 1 81 GLU -5.40 -3.29 1 82 THR 2.76 -0.28 1 83 LEU -3.11 -4.51 1 84 GLN -5.88 -3.75 1 85 TYR -2.27 -2.80 1 86 HIS -2.62 -3.65 1 88 ILE -1.66 -5.68 1 89 THR -3.57 -3.34 1 90 GLU 3.99 0.40 1 91 GLU 3.62 0.37 1 92 ASP 3.14 0.73 1 93 MET 3.70 -2.38 1 94 GLN 1.40 -1.43 1 95 ARG -1.54 -1.76 1 96 LYS -0.63 -1.29 1 97 THR -2.37 -2.20 1 98 LEU -4.47 -4.31 1 99 ARG -2.40 -3.27 1 100 ILE -0.15 -2.55 1 101 SER -1.96 -3.34 1 102 VAL 0.62 -3.39 1 104 ASP -6.61 -5.38 1 105 GLU -0.81 -1.71 1 106 ASP -2.65 -4.30 1 107 LYS 0.97 -1.53 1 108 PHE 4.18 -1.37 1 110 HIS -0.59 -2.69 1 111 ASN -3.88 -2.77 1 112 GLU -5.98 -4.19 1 113 PHE 0.25 -1.30 1 114 ILE 3.21 0.47 1 116 GLU -7.21 -4.83 1 117 THR -0.24 -2.77 1 118 ARG -3.55 -3.99 1 119 PHE -3.18 -2.72 1 120 SER 1.67 -2.04 1 121 LEU 4.96 0.21 1 122 LYS 3.40 -0.80 1 123 LYS 0.85 -2.07 1 124 LEU -2.01 -3.37 1 125 LYS -1.40 -3.75 1 126 ALA 1.35 -1.06 1 127 ASN 3.87 -0.56 1 128 GLN -2.24 -3.56 1 129 ARG 1.49 -1.80 1 130 LYS -4.46 -4.11 1 131 ASN -2.02 -3.07 1 132 PHE -3.58 -3.11 1 133 ASN -0.43 -2.59 1 134 ILE -7.09 -5.31 1 136 LEU -0.74 -2.47 1 137 GLU -5.54 -4.65 1 138 ARG -0.10 -2.37 1 139 VAL 0.85 -2.43 1 140 ILE -0.25 -2.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.66 _LACS_plot.Line_2_terminator_val_x_2 4.96 _LACS_plot.Line_2_terminator_val_y_2 -4.17 _LACS_plot.Y_axis_chem_shift_offset 2.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 ILE 1.95 -6.82 0 10 ALA 0.53 -2.70 1 11 THR -0.29 -2.42 1 12 THR 0.17 -2.62 1 13 LEU -0.31 -1.35 1 15 ALA -5.33 0.81 1 16 LEU -7.16 3.36 1 17 GLU -4.84 0.05 1 18 PHE -4.16 -0.69 1 19 SER -4.85 0.24 1 20 LEU -8.10 3.71 1 21 LEU -4.44 1.52 1 22 TYR -3.24 -2.59 1 23 ASP -2.02 -3.29 1 24 GLN 2.82 -2.42 1 25 ASP 4.20 -3.73 1 26 ASN -1.24 -1.60 1 27 SER 2.52 -4.78 1 28 ASN -5.89 1.41 1 29 LEU -4.40 0.40 1 30 GLN -2.13 -1.39 1 32 THR 0.84 -3.00 1 34 ILE 4.47 -2.56 1 35 ARG -3.68 -0.33 1 36 ALA -5.95 0.97 1 37 LYS -5.21 0.77 1 39 LEU -0.35 -2.64 1 40 LYS -3.18 -1.21 1 42 MET -3.29 -1.76 1 43 ASP -5.82 1.60 1 45 ASN 1.34 -4.38 1 47 LEU -2.68 -2.57 1 48 ALA -2.95 -0.77 1 49 ASP -1.79 -1.13 1 51 TYR -4.55 0.46 1 52 VAL -2.38 -2.09 1 53 LYS -4.48 0.51 1 54 LEU -3.90 -0.26 1 55 HIS -5.56 2.58 1 56 LEU -1.62 -1.80 1 60 ALA -0.10 -2.33 1 61 SER 1.56 -2.65 1 62 LYS 2.99 -3.30 1 63 SER 1.12 -2.87 1 64 ASN 1.02 -2.48 1 65 LYS -0.52 -2.06 1 66 LEU -5.19 1.24 1 67 ARG -3.50 -0.16 1 68 THR -3.99 0.61 1 69 LYS 1.10 -2.71 1 70 THR 0.12 -2.05 1 71 LEU -2.73 -1.92 1 72 ARG -1.76 -2.00 1 73 ASN 2.68 -4.42 1 74 THR -0.06 -3.53 1 75 ARG -1.89 -1.91 1 76 ASN -2.31 -0.01 1 78 VAL -0.13 -2.78 1 79 TRP 4.67 -2.50 1 80 ASN 2.08 -3.32 1 81 GLU -5.40 2.11 1 82 THR 2.76 -3.04 1 83 LEU -3.11 -1.40 1 84 GLN -5.88 2.13 1 85 TYR -2.27 -0.53 1 86 HIS -2.62 -1.03 1 88 ILE -1.66 -4.02 1 89 THR -3.57 0.23 1 90 GLU 3.99 -3.59 1 91 GLU 3.62 -3.25 1 92 ASP 3.14 -2.41 1 93 MET 3.70 -6.08 1 94 GLN 1.40 -2.83 1 95 ARG -1.54 -0.22 1 96 LYS -0.63 -0.66 1 97 THR -2.37 0.17 1 98 LEU -4.47 0.16 1 99 ARG -2.40 -0.87 1 100 ILE -0.15 -2.40 1 101 SER -1.96 -1.38 1 102 VAL 0.62 -4.01 1 104 ASP -6.61 1.23 1 105 GLU -0.81 -0.90 1 106 ASP -2.65 -1.65 1 107 LYS 0.97 -2.50 1 108 PHE 4.18 -5.55 1 110 HIS -0.59 -2.10 1 111 ASN -3.88 1.11 1 112 GLU -5.98 1.79 1 113 PHE 0.25 -1.55 1 114 ILE 3.21 -2.74 1 116 GLU -7.21 2.38 1 117 THR -0.24 -2.53 1 118 ARG -3.55 -0.44 1 119 PHE -3.18 0.46 1 120 SER 1.67 -3.71 1 121 LEU 4.96 -4.75 1 122 LYS 3.40 -4.20 1 123 LYS 0.85 -2.92 1 124 LEU -2.01 -1.36 1 125 LYS -1.40 -2.35 1 126 ALA 1.35 -2.41 1 127 ASN 3.87 -4.43 1 128 GLN -2.24 -1.32 1 129 ARG 1.49 -3.29 1 130 LYS -4.46 0.35 1 131 ASN -2.02 -1.05 1 132 PHE -3.58 0.47 1 133 ASN -0.43 -2.16 1 134 ILE -7.09 1.78 1 136 LEU -0.74 -1.73 1 137 GLU -5.54 0.89 1 138 ARG -0.10 -2.27 1 139 VAL 0.85 -3.28 1 140 ILE -0.25 -2.55 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 1.00 _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 0.29 _LACS_plot.Line_2_terminator_val_x_2 4.96 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 104 ASP -6.61 0.24 0 49 ASP -1.79 1.10 0 24 GLN 2.82 -1.08 0 10 ALA 0.53 0.01 1 11 THR -0.29 0.05 1 12 THR 0.17 0.01 1 13 LEU -0.31 -0.04 1 15 ALA -5.33 1.03 1 16 LEU -7.16 0.73 1 17 GLU -4.84 1.33 1 18 PHE -4.16 0.80 1 19 SER -4.85 1.19 1 20 LEU -8.10 1.18 1 21 LEU -4.44 0.13 1 22 TYR -3.24 0.76 1 23 ASP -2.02 0.05 1 25 ASP 4.20 -0.35 1 26 ASN -1.24 0.17 1 27 SER 2.52 -0.47 1 28 ASN -5.89 1.05 1 29 LEU -4.40 0.90 1 30 GLN -2.13 0.40 1 32 THR 0.84 -0.29 1 33 ILE 1.95 -0.12 1 34 ILE 4.47 -0.19 1 35 ARG -3.68 1.11 1 36 ALA -5.95 1.39 1 37 LYS -5.21 0.82 1 39 LEU -0.35 0.10 1 40 LYS -3.18 -0.02 1 42 MET -3.29 0.51 1 43 ASP -5.82 0.73 1 45 ASN 1.34 -0.26 1 47 LEU -2.68 0.13 1 48 ALA -2.95 -0.09 1 51 TYR -4.55 0.19 1 52 VAL -2.38 0.64 1 53 LYS -4.48 0.69 1 54 LEU -3.90 0.82 1 55 HIS -5.56 0.42 1 56 LEU -1.62 0.43 1 60 ALA -0.10 0.14 1 61 SER 1.56 -0.13 1 62 LYS 2.99 -0.14 1 63 SER 1.12 -0.02 1 64 ASN 1.02 0.09 1 65 LYS -0.52 0.67 1 66 LEU -5.19 0.24 1 67 ARG -3.50 1.16 1 68 THR -3.99 0.18 1 69 LYS 1.10 0.02 1 70 THR 0.12 -0.14 1 71 LEU -2.73 0.29 1 72 ARG -1.76 0.57 1 73 ASN 2.68 -0.57 1 74 THR -0.06 0.11 1 75 ARG -1.89 -0.12 1 76 ASN -2.31 0.38 1 78 VAL -0.13 -0.01 1 79 TRP 4.67 -0.14 1 80 ASN 2.08 -0.38 1 81 GLU -5.40 0.40 1 82 THR 2.76 -0.46 1 83 LEU -3.11 0.29 1 84 GLN -5.88 0.85 1 85 TYR -2.27 -0.02 1 86 HIS -2.62 0.68 1 88 ILE -1.66 0.23 1 89 THR -3.57 0.37 1 90 GLU 3.99 -0.47 1 91 GLU 3.62 -0.45 1 92 ASP 3.14 -0.51 1 93 MET 3.70 -0.49 1 94 GLN 1.40 -0.43 1 95 ARG -1.54 0.13 1 96 LYS -0.63 0.64 1 97 THR -2.37 0.23 1 98 LEU -4.47 0.50 1 99 ARG -2.40 0.43 1 100 ILE -0.15 0.31 1 101 SER -1.96 0.64 1 102 VAL 0.62 0.41 1 105 GLU -0.81 0.24 1 106 ASP -2.65 0.63 1 107 LYS 0.97 -0.30 1 108 PHE 4.18 -0.27 1 110 HIS -0.59 0.07 1 111 ASN -3.88 0.52 1 112 GLU -5.98 0.33 1 113 PHE 0.25 -0.10 1 114 ILE 3.21 -0.22 1 116 GLU -7.21 1.39 1 117 THR -0.24 0.25 1 118 ARG -3.55 0.96 1 119 PHE -3.18 0.10 1 120 SER 1.67 -0.28 1 121 LEU 4.96 -0.48 1 122 LYS 3.40 -0.32 1 123 LYS 0.85 -0.19 1 124 LEU -2.01 0.26 1 125 LYS -1.40 0.17 1 126 ALA 1.35 -0.12 1 127 ASN 3.87 -0.57 1 128 GLN -2.24 0.25 1 129 ARG 1.49 0.28 1 130 LYS -4.46 0.15 1 131 ASN -2.02 -0.26 1 132 PHE -3.58 -0.20 1 133 ASN -0.43 0.46 1 134 ILE -7.09 0.66 1 136 LEU -0.74 -0.34 1 137 GLU -5.54 0.44 1 138 ARG -0.10 0.04 1 139 VAL 0.85 -0.26 1 140 ILE -0.25 -0.11 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6787_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _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 -0.85 _LACS_plot.Line_2_terminator_val_x_2 4.96 _LACS_plot.Line_2_terminator_val_y_2 1.00 _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 74 THR -0.06 6.28 0 10 ALA 0.53 0.59 1 11 THR -0.29 0.60 1 12 THR 0.17 0.06 1 13 LEU -0.31 -1.37 1 15 ALA -5.33 -1.85 1 16 LEU -7.16 -3.69 1 17 GLU -4.84 -0.46 1 18 PHE -4.16 -3.63 1 19 SER -4.85 -0.62 1 20 LEU -8.10 -2.35 1 21 LEU -4.44 -3.22 1 22 TYR -3.24 -2.73 1 23 ASP -2.02 -0.39 1 24 GLN 2.82 2.82 1 25 ASP 4.20 1.39 1 26 ASN -1.24 -1.50 1 27 SER 2.52 -1.13 1 28 ASN -5.89 -1.45 1 29 LEU -4.40 -3.33 1 30 GLN -2.13 -0.57 1 32 THR 0.84 -0.67 1 33 ILE 1.95 -1.25 1 34 ILE 4.47 0.01 1 35 ARG -3.68 -3.44 1 36 ALA -5.95 -1.83 1 37 LYS -5.21 0.84 1 39 LEU -0.35 -0.66 1 40 LYS -3.18 -0.18 1 42 MET -3.29 -0.17 1 45 ASN 1.34 1.05 1 47 LEU -2.68 -4.30 1 48 ALA -2.95 -3.49 1 49 ASP -1.79 1.97 1 51 TYR -4.55 -4.13 1 52 VAL -2.38 -1.60 1 53 LYS -4.48 -1.79 1 54 LEU -3.90 -1.16 1 55 HIS -5.56 -0.59 1 56 LEU -1.62 -2.51 1 60 ALA -0.10 0.73 1 61 SER 1.56 1.57 1 62 LYS 2.99 1.34 1 63 SER 1.12 0.23 1 64 ASN 1.02 0.48 1 65 LYS -0.52 -1.20 1 66 LEU -5.19 -1.90 1 67 ARG -3.50 -0.35 1 68 THR -3.99 1.14 1 69 LYS 1.10 1.01 1 70 THR 0.12 0.40 1 71 LEU -2.73 -2.65 1 72 ARG -1.76 1.27 1 73 ASN 2.68 0.50 1 75 ARG -1.89 -1.61 1 76 ASN -2.31 1.71 1 78 VAL -0.13 -1.04 1 79 TRP 4.67 0.53 1 80 ASN 2.08 -0.78 1 81 GLU -5.40 -1.34 1 82 THR 2.76 -1.43 1 83 LEU -3.11 -2.24 1 84 GLN -5.88 -1.89 1 85 TYR -2.27 -0.22 1 86 HIS -2.62 0.56 1 88 ILE -1.66 -0.17 1 89 THR -3.57 0.97 1 90 GLU 3.99 2.74 1 91 GLU 3.62 2.62 1 92 ASP 3.14 2.41 1 93 MET 3.70 1.32 1 94 GLN 1.40 2.31 1 95 ARG -1.54 1.66 1 96 LYS -0.63 -0.15 1 97 THR -2.37 -2.57 1 98 LEU -4.47 -3.25 1 99 ARG -2.40 -1.65 1 100 ILE -0.15 -1.59 1 101 SER -1.96 -1.99 1 102 VAL 0.62 -1.09 1 104 ASP -6.61 -1.57 1 106 ASP -2.65 -1.57 1 107 LYS 0.97 0.72 1 108 PHE 4.18 0.92 1 110 HIS -0.59 -0.63 1 111 ASN -3.88 -0.78 1 112 GLU -5.98 -0.72 1 113 PHE 0.25 -0.72 1 114 ILE 3.21 -0.85 1 116 GLU -7.21 -1.61 1 117 THR -0.24 -3.26 1 118 ARG -3.55 -0.82 1 119 PHE -3.18 -1.52 1 120 SER 1.67 -1.02 1 121 LEU 4.96 0.14 1 122 LYS 3.40 0.71 1 123 LYS 0.85 0.61 1 124 LEU -2.01 -1.68 1 125 LYS -1.40 0.58 1 126 ALA 1.35 -0.11 1 127 ASN 3.87 -1.31 1 128 GLN -2.24 -0.86 1 129 ARG 1.49 -0.50 1 130 LYS -4.46 -2.96 1 131 ASN -2.02 -1.11 1 132 PHE -3.58 -0.71 1 133 ASN -0.43 -0.27 1 134 ILE -7.09 -0.55 1 136 LEU -0.74 -1.80 1 137 GLU -5.54 -0.49 1 138 ARG -0.10 -0.40 1 139 VAL 0.85 -0.18 1 140 ILE -0.25 -0.20 1 stop_ save_