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 bmr15295_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.41 _LACS_plot.Line_1_terminator_val_y_1 -2.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.79 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 7.13 _LACS_plot.Y_axis_chem_shift_offset -0.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 HIS -2.17 3.38 0 163 SER 5.51 0.64 0 10 ASN -4.30 -1.02 1 11 VAL -4.04 -1.45 1 12 PHE -3.44 -1.07 1 17 ILE 2.18 1.48 1 18 LEU 1.60 1.72 1 19 GLU -2.11 -0.85 1 21 ALA 2.47 3.01 1 22 VAL 5.13 3.91 1 23 ALA 5.43 3.94 1 24 ALA 2.82 2.32 1 25 VAL 3.32 2.91 1 26 ILE 3.13 3.08 1 27 LEU -1.03 0.41 1 28 ASP 1.81 1.50 1 29 ARG -0.93 -1.12 1 30 THR 1.95 1.19 1 31 ALA -3.21 -0.98 1 32 ASP 0.21 0.87 1 33 THR -3.91 -0.46 1 36 ALA -6.12 -0.60 1 37 VAL -4.41 -1.64 1 38 LEU -3.48 -1.91 1 39 HIS -0.27 2.57 1 41 TYR -6.36 -0.64 1 42 HIS -6.44 0.01 1 43 ARG -1.92 -1.68 1 44 TYR -0.53 2.16 1 45 LYS -0.71 0.62 1 46 LEU -7.41 -2.34 1 47 LYS 2.71 2.55 1 49 LEU -4.96 -1.49 1 54 ILE -5.09 -1.85 1 55 VAL -6.15 -1.26 1 57 SER 1.58 1.39 1 58 ASP 3.44 3.55 1 59 SER -0.11 0.33 1 61 LYS -2.76 0.62 1 62 VAL -4.02 -0.83 1 63 ASN -0.19 0.32 1 65 LYS -6.34 -1.13 1 66 VAL -1.07 -0.52 1 67 ILE 0.38 0.27 1 68 THR -2.48 -1.30 1 70 VAL 0.62 0.54 1 71 SER -2.94 -0.61 1 72 ASP 4.85 4.68 1 73 ALA 3.35 2.88 1 74 GLU 1.72 2.53 1 75 LEU 3.44 2.91 1 76 ASN 3.80 3.91 1 77 ASN 4.00 2.85 1 78 PHE 5.75 5.17 1 79 ASP 5.22 4.05 1 80 VAL 4.67 3.93 1 84 ASN 2.28 2.41 1 85 ASP 1.82 1.81 1 86 TYR -6.32 -1.33 1 87 GLU -5.73 -2.71 1 88 ARG 0.83 -0.37 1 89 VAL -5.99 -2.39 1 90 THR 0.56 0.45 1 91 VAL -6.11 -2.95 1 92 GLU -5.05 -1.47 1 93 VAL -5.68 -4.15 1 94 VAL -1.73 -0.83 1 95 ARG 0.83 1.75 1 96 MET 1.31 1.86 1 97 ASP 3.67 1.62 1 98 ASN -1.46 -1.08 1 100 GLU -1.19 0.03 1 101 LYS -1.08 -0.42 1 102 VAL -4.58 -1.76 1 103 LYS 0.26 0.18 1 104 VAL -6.67 -3.51 1 105 GLU -4.93 -2.15 1 106 THR -1.26 0.07 1 107 TYR -1.14 0.23 1 108 VAL -3.87 -1.70 1 109 TRP -3.34 0.32 1 110 VAL 5.09 4.35 1 111 ASN -0.19 -1.33 1 112 LYS 3.95 2.36 1 113 ASP -1.34 -0.84 1 114 ASP -1.80 0.78 1 117 MET 0.58 1.54 1 118 TYR -2.83 -0.64 1 120 GLU -3.60 -0.90 1 121 TRP 0.67 2.25 1 122 ASP -4.80 -1.06 1 123 PHE 3.15 3.48 1 124 GLU 3.85 2.96 1 125 GLU 1.47 2.28 1 126 TRP 4.42 3.75 1 127 ARG 3.97 3.02 1 128 VAL 3.14 2.48 1 129 VAL 0.15 2.04 1 131 ALA 5.64 5.44 1 132 GLU 4.15 3.77 1 133 LYS 3.25 2.24 1 134 PHE 5.18 4.54 1 135 VAL 6.55 5.81 1 136 GLU 2.35 2.78 1 137 THR 9.24 6.92 1 138 PHE 3.64 1.05 1 139 ARG 5.26 4.75 1 140 LYS 3.61 3.49 1 141 MET 3.78 4.66 1 142 LEU 4.15 2.65 1 143 GLU 2.78 2.96 1 144 TRP 4.57 3.25 1 145 ASN 1.71 2.91 1 149 ASN 0.85 0.60 1 151 LYS -2.38 -0.57 1 152 SER -1.20 -0.17 1 154 GLU -0.64 -0.82 1 155 GLU 0.85 1.65 1 156 ALA 0.54 1.64 1 157 VAL 1.28 1.42 1 160 LEU 0.49 0.78 1 161 LEU 0.05 0.41 1 165 ASP 0.28 2.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15295_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.41 _LACS_plot.Line_1_terminator_val_y_1 4.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.21 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 -2.10 _LACS_plot.Y_axis_chem_shift_offset -0.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 130 HIS -2.17 5.55 0 163 SER 5.51 -4.87 0 10 ASN -4.30 3.28 1 11 VAL -4.04 2.59 1 12 PHE -3.44 2.37 1 17 ILE 2.18 -0.70 1 18 LEU 1.60 0.12 1 19 GLU -2.11 1.26 1 21 ALA 2.47 0.54 1 22 VAL 5.13 -1.22 1 23 ALA 5.43 -1.49 1 24 ALA 2.82 -0.50 1 25 VAL 3.32 -0.41 1 26 ILE 3.13 -0.05 1 27 LEU -1.03 1.44 1 28 ASP 1.81 -0.31 1 29 ARG -0.93 -0.19 1 30 THR 1.95 -0.76 1 31 ALA -3.21 2.23 1 32 ASP 0.21 0.66 1 33 THR -3.91 3.45 1 36 ALA -6.12 5.52 1 37 VAL -4.41 2.77 1 38 LEU -3.48 1.57 1 39 HIS -0.27 2.84 1 41 TYR -6.36 5.72 1 42 HIS -6.44 6.45 1 43 ARG -1.92 0.24 1 44 TYR -0.53 2.69 1 45 LYS -0.71 1.33 1 46 LEU -7.41 5.07 1 47 LYS 2.71 -0.16 1 49 LEU -4.96 3.47 1 54 ILE -5.09 3.24 1 55 VAL -6.15 4.89 1 57 SER 1.58 -0.19 1 58 ASP 3.44 0.11 1 59 SER -0.11 0.44 1 61 LYS -2.76 3.38 1 62 VAL -4.02 3.19 1 63 ASN -0.19 0.51 1 65 LYS -6.34 5.21 1 66 VAL -1.07 0.55 1 67 ILE 0.38 -0.11 1 68 THR -2.48 1.18 1 70 VAL 0.62 -0.08 1 71 SER -2.94 2.33 1 72 ASP 4.85 -0.17 1 73 ALA 3.35 -0.47 1 74 GLU 1.72 0.81 1 75 LEU 3.44 -0.53 1 76 ASN 3.80 0.11 1 77 ASN 4.00 -1.15 1 78 PHE 5.75 -0.58 1 79 ASP 5.22 -1.17 1 80 VAL 4.67 -0.74 1 84 ASN 2.28 0.13 1 85 ASP 1.82 -0.01 1 86 TYR -6.32 4.99 1 87 GLU -5.73 3.02 1 88 ARG 0.83 -1.20 1 89 VAL -5.99 3.60 1 90 THR 0.56 -0.11 1 91 VAL -6.11 3.16 1 92 GLU -5.05 3.58 1 93 VAL -5.68 1.53 1 94 VAL -1.73 0.90 1 95 ARG 0.83 0.92 1 96 MET 1.31 0.55 1 97 ASP 3.67 -2.05 1 98 ASN -1.46 0.38 1 100 GLU -1.19 1.22 1 101 LYS -1.08 0.66 1 102 VAL -4.58 2.82 1 103 LYS 0.26 -0.08 1 104 VAL -6.67 3.16 1 105 GLU -4.93 2.78 1 106 THR -1.26 1.33 1 107 TYR -1.14 1.37 1 108 VAL -3.87 2.17 1 109 TRP -3.34 3.66 1 110 VAL 5.09 -0.74 1 111 ASN -0.19 -1.14 1 112 LYS 3.95 -1.59 1 113 ASP -1.34 0.50 1 114 ASP -1.80 2.58 1 117 MET 0.58 0.96 1 118 TYR -2.83 2.19 1 120 GLU -3.60 2.70 1 121 TRP 0.67 1.58 1 122 ASP -4.80 3.74 1 123 PHE 3.15 0.33 1 124 GLU 3.85 -0.89 1 125 GLU 1.47 0.81 1 126 TRP 4.42 -0.67 1 127 ARG 3.97 -0.95 1 128 VAL 3.14 -0.66 1 129 VAL 0.15 1.89 1 131 ALA 5.64 -0.20 1 132 GLU 4.15 -0.38 1 133 LYS 3.25 -1.01 1 134 PHE 5.18 -0.64 1 135 VAL 6.55 -0.74 1 136 GLU 2.35 0.43 1 137 THR 9.24 -2.32 1 138 PHE 3.64 -2.59 1 139 ARG 5.26 -0.51 1 140 LYS 3.61 -0.12 1 141 MET 3.78 0.88 1 142 LEU 4.15 -1.50 1 143 GLU 2.78 0.18 1 144 TRP 4.57 -1.32 1 145 ASN 1.71 1.20 1 149 ASN 0.85 -0.25 1 151 LYS -2.38 1.81 1 152 SER -1.20 1.03 1 154 GLU -0.64 -0.18 1 155 GLU 0.85 0.80 1 156 ALA 0.54 1.10 1 157 VAL 1.28 0.14 1 160 LEU 0.49 0.29 1 161 LEU 0.05 0.36 1 165 ASP 0.28 1.75 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15295_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.41 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 -0.86 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 ILE -5.09 1.96 0 10 ASN -4.30 1.00 1 11 VAL -4.04 0.77 1 12 PHE -3.44 0.72 1 17 ILE 2.18 -0.39 1 18 LEU 1.60 -0.77 1 21 ALA 2.47 0.01 1 22 VAL 5.13 -0.35 1 23 ALA 5.43 -0.42 1 24 ALA 2.82 0.14 1 25 VAL 3.32 -0.08 1 26 ILE 3.13 -0.57 1 27 LEU -1.03 -0.08 1 28 ASP 1.81 -0.14 1 29 ARG -0.93 0.25 1 30 THR 1.95 -0.08 1 31 ALA -3.21 0.08 1 32 ASP 0.21 0.13 1 33 THR -3.91 1.18 1 36 ALA -6.12 0.93 1 37 VAL -4.41 0.80 1 38 LEU -3.48 0.21 1 39 HIS -0.27 0.09 1 41 TYR -6.36 -0.28 1 42 HIS -6.44 -0.08 1 43 ARG -1.92 0.72 1 44 TYR -0.53 -0.15 1 45 LYS -0.71 -0.11 1 46 LEU -7.41 0.44 1 47 LYS 2.71 -0.11 1 55 VAL -6.15 0.72 1 58 ASP 3.44 -0.28 1 59 SER -0.11 0.10 1 61 LYS -2.76 0.95 1 62 VAL -4.02 0.21 1 63 ASN -0.19 0.48 1 65 LYS -6.34 0.86 1 66 VAL -1.07 0.48 1 67 ILE 0.38 0.37 1 68 THR -2.48 0.83 1 70 VAL 0.62 0.12 1 71 SER -2.94 0.37 1 72 ASP 4.85 -0.31 1 74 GLU 1.72 -0.41 1 75 LEU 3.44 -0.22 1 76 ASN 3.80 -0.28 1 77 ASN 4.00 -0.37 1 78 PHE 5.75 0.03 1 79 ASP 5.22 -0.31 1 80 VAL 4.67 -0.47 1 84 ASN 2.28 -0.07 1 85 ASP 1.82 -0.40 1 86 TYR -6.32 0.93 1 87 GLU -5.73 0.51 1 88 ARG 0.83 0.43 1 89 VAL -5.99 0.53 1 90 THR 0.56 0.85 1 91 VAL -6.11 0.58 1 92 GLU -5.05 0.91 1 93 VAL -5.68 0.74 1 94 VAL -1.73 0.44 1 95 ARG 0.83 -0.24 1 96 MET 1.31 -0.05 1 97 ASP 3.67 -0.19 1 98 ASN -1.46 0.09 1 100 GLU -1.19 -0.06 1 101 LYS -1.08 0.95 1 102 VAL -4.58 0.41 1 103 LYS 0.26 0.65 1 104 VAL -6.67 0.86 1 105 GLU -4.93 0.98 1 106 THR -1.26 0.24 1 107 TYR -1.14 0.68 1 108 VAL -3.87 0.77 1 109 TRP -3.34 0.04 1 110 VAL 5.09 -0.53 1 111 ASN -0.19 0.17 1 112 LYS 3.95 -0.22 1 113 ASP -1.34 0.21 1 117 MET 0.58 0.45 1 118 TYR -2.83 0.45 1 121 TRP 0.67 -0.37 1 122 ASP -4.80 0.28 1 124 GLU 3.85 -0.21 1 125 GLU 1.47 -0.44 1 126 TRP 4.42 -0.50 1 127 ARG 3.97 -0.41 1 128 VAL 3.14 -0.42 1 129 VAL 0.15 -0.29 1 130 HIS -2.17 -0.14 1 131 ALA 5.64 -0.70 1 132 GLU 4.15 -0.40 1 133 LYS 3.25 0.00 1 134 PHE 5.18 -0.69 1 135 VAL 6.55 -0.64 1 136 GLU 2.35 -0.23 1 137 THR 9.24 -0.32 1 138 PHE 3.64 -0.14 1 139 ARG 5.26 -0.43 1 140 LYS 3.61 -0.20 1 141 MET 3.78 -0.44 1 142 LEU 4.15 -0.19 1 143 GLU 2.78 -0.25 1 144 TRP 4.57 -0.44 1 145 ASN 1.71 -0.80 1 149 ASN 0.85 -0.20 1 151 LYS -2.38 0.35 1 152 SER -1.20 0.17 1 154 GLU -0.64 -0.39 1 155 GLU 0.85 -0.26 1 156 ALA 0.54 -0.03 1 157 VAL 1.28 -0.07 1 160 LEU 0.49 0.04 1 161 LEU 0.05 0.17 1 163 SER 5.51 0.10 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15295_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.41 _LACS_plot.Line_1_terminator_val_y_1 -2.15 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.26 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 3.01 _LACS_plot.Y_axis_chem_shift_offset -0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 106 THR -1.26 -4.30 0 165 ASP 0.28 4.88 0 10 ASN -4.30 -1.85 1 11 VAL -4.04 -1.15 1 12 PHE -3.44 -1.43 1 17 ILE 2.18 -1.51 1 18 LEU 1.60 1.20 1 19 GLU -2.11 0.65 1 21 ALA 2.47 2.53 1 22 VAL 5.13 1.66 1 23 ALA 5.43 1.41 1 24 ALA 2.82 3.31 1 25 VAL 3.32 0.36 1 26 ILE 3.13 0.44 1 27 LEU -1.03 -1.03 1 28 ASP 1.81 -1.76 1 29 ARG -0.93 -1.94 1 30 THR 1.95 -0.41 1 31 ALA -3.21 -1.08 1 32 ASP 0.21 -0.79 1 33 THR -3.91 2.54 1 36 ALA -6.12 -3.54 1 37 VAL -4.41 -3.04 1 38 LEU -3.48 -2.55 1 39 HIS -0.27 2.49 1 41 TYR -6.36 -4.05 1 42 HIS -6.44 -1.91 1 43 ARG -1.92 -2.27 1 44 TYR -0.53 1.89 1 45 LYS -0.71 -1.50 1 46 LEU -7.41 0.37 1 47 LYS 2.71 0.33 1 49 LEU -4.96 1.57 1 54 ILE -5.09 -1.40 1 55 VAL -6.15 -1.30 1 57 SER 1.58 -0.36 1 58 ASP 3.44 0.85 1 59 SER -0.11 0.26 1 61 LYS -2.76 -0.82 1 62 VAL -4.02 -1.67 1 63 ASN -0.19 -0.50 1 65 LYS -6.34 -2.52 1 66 VAL -1.07 -1.01 1 67 ILE 0.38 -0.49 1 68 THR -2.48 1.25 1 70 VAL 0.62 0.35 1 71 SER -2.94 0.93 1 72 ASP 4.85 2.40 1 73 ALA 3.35 3.36 1 74 GLU 1.72 2.72 1 75 LEU 3.44 0.85 1 76 ASN 3.80 2.00 1 77 ASN 4.00 2.59 1 78 PHE 5.75 1.75 1 79 ASP 5.22 3.76 1 80 VAL 4.67 1.10 1 84 ASN 2.28 1.24 1 85 ASP 1.82 -1.77 1 86 TYR -6.32 -0.80 1 87 GLU -5.73 -1.98 1 88 ARG 0.83 -0.33 1 89 VAL -5.99 -1.99 1 90 THR 0.56 0.59 1 91 VAL -6.11 -2.81 1 92 GLU -5.05 -0.50 1 93 VAL -5.68 -2.38 1 94 VAL -1.73 1.48 1 95 ARG 0.83 1.24 1 96 MET 1.31 1.00 1 97 ASP 3.67 2.07 1 98 ASN -1.46 1.37 1 100 GLU -1.19 -0.48 1 101 LYS -1.08 0.84 1 102 VAL -4.58 -1.98 1 103 LYS 0.26 0.14 1 104 VAL -6.67 -2.87 1 105 GLU -4.93 0.24 1 107 TYR -1.14 -0.30 1 108 VAL -3.87 -0.78 1 109 TRP -3.34 1.15 1 110 VAL 5.09 0.54 1 111 ASN -0.19 0.21 1 112 LYS 3.95 -1.16 1 113 ASP -1.34 -0.44 1 114 ASP -1.80 1.42 1 117 MET 0.58 0.04 1 118 TYR -2.83 -2.29 1 120 GLU -3.60 -1.89 1 121 TRP 0.67 -2.39 1 122 ASP -4.80 -1.44 1 123 PHE 3.15 0.20 1 124 GLU 3.85 2.48 1 125 GLU 1.47 2.17 1 126 TRP 4.42 1.95 1 127 ARG 3.97 2.00 1 128 VAL 3.14 -0.12 1 129 VAL 0.15 1.64 1 130 HIS -2.17 2.60 1 131 ALA 5.64 1.11 1 132 GLU 4.15 2.99 1 133 LYS 3.25 3.41 1 134 PHE 5.18 1.23 1 135 VAL 6.55 1.12 1 136 GLU 2.35 2.75 1 137 THR 9.24 1.77 1 138 PHE 3.64 2.11 1 139 ARG 5.26 3.06 1 140 LYS 3.61 3.01 1 141 MET 3.78 2.12 1 142 LEU 4.15 1.96 1 143 GLU 2.78 2.47 1 144 TRP 4.57 0.76 1 145 ASN 1.71 1.12 1 149 ASN 0.85 0.59 1 151 LYS -2.38 1.00 1 152 SER -1.20 0.16 1 154 GLU -0.64 1.95 1 155 GLU 0.85 1.18 1 156 ALA 0.54 1.11 1 157 VAL 1.28 0.61 1 160 LEU 0.49 -0.33 1 161 LEU 0.05 -0.33 1 163 SER 5.51 0.35 1 stop_ save_