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 bmr7358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 -0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.20 _LACS_plot.Line_2_terminator_val_x_2 1.49 _LACS_plot.Line_2_terminator_val_y_2 0.73 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 154 HIS 0.60 1.30 0 163 HIS -0.50 0.70 0 10 SER 0.50 0.10 1 11 ALA 0.40 0.20 1 12 GLU 0.20 0.20 1 13 LYS 0.60 0.20 1 14 ALA 0.20 0.10 1 15 SER 0.20 0.00 1 16 LYS 0.70 0.20 1 17 ASP 0.80 0.60 1 19 GLU -0.50 -0.20 1 20 ILE 0.60 0.20 1 21 HIS 0.00 0.50 1 22 ARG 0.70 0.40 1 24 GLU -0.50 -0.20 1 25 ALA 0.60 0.40 1 27 LYS 0.10 -0.10 1 28 LYS 0.20 0.00 1 29 ARG 0.30 0.10 1 30 SER 0.00 -0.30 1 31 VAL 0.30 0.00 1 33 LYS 0.10 0.00 1 34 LEU 0.40 0.00 1 35 SER 0.30 -0.10 1 36 GLN 0.20 0.20 1 37 THR 0.10 -0.10 1 38 ALA 0.00 0.00 1 39 SER 0.20 0.00 1 40 GLU -0.10 0.00 1 41 ASP 0.30 0.10 1 42 SER 0.20 0.20 1 43 ASP 0.20 0.00 1 44 VAL 0.60 0.10 1 45 PHE 0.20 0.00 1 47 GLU -0.50 -0.20 1 48 ALA 0.50 0.30 1 49 ASP 0.40 0.10 1 50 ALA 0.20 0.10 1 51 ILE 0.70 0.20 1 52 GLN 0.10 -0.10 1 53 ASN 0.20 0.00 1 54 ASN 0.20 0.10 1 56 THR -0.30 -0.20 1 57 SER -0.30 -0.20 1 58 ALA 0.30 0.20 1 59 GLU -0.20 0.00 1 60 ASP 0.30 0.20 1 61 THR 0.60 0.20 1 62 ALA 0.40 0.20 1 63 VAL 0.80 0.30 1 64 THR 0.40 0.10 1 65 ASP 0.00 0.00 1 66 SER 0.90 0.50 1 67 LYS 0.70 0.20 1 68 HIS 0.20 0.70 1 69 THR 0.30 0.10 1 70 ALA -0.50 -0.50 1 71 ASP -0.30 -0.20 1 73 LYS 1.30 0.40 1 74 ASN 0.20 -0.10 1 75 ASN 0.20 -0.10 1 76 TRP 0.60 0.10 1 77 GLN 0.60 0.30 1 79 ALA -0.50 -0.30 1 80 HIS 0.10 0.20 1 82 ALA -0.30 -0.40 1 83 ASP -0.50 -0.30 1 86 ASN -0.00 -0.30 1 87 ARG 0.60 0.20 1 89 HIS 0.00 0.70 1 90 LEU -0.10 -0.20 1 91 ILE 0.30 -0.20 1 92 ARG -0.10 -0.30 1 93 LEU -0.40 -0.40 1 94 PHE -0.30 -0.30 1 95 SER -0.40 -0.40 1 96 ARG 0.30 0.10 1 97 ASP -0.10 -0.10 1 98 ALA -0.20 -0.10 1 101 ARG 0.20 0.00 1 102 GLU -0.20 -0.20 1 103 ASP -0.10 -0.20 1 104 ASN 0.30 0.10 1 105 THR 1.20 0.90 1 106 PHE 0.80 0.20 1 107 LYS 0.00 -0.10 1 108 ASP 0.10 0.00 1 109 ARG -0.10 -0.10 1 111 SER 0.20 0.00 1 112 GLU 0.10 0.20 1 113 SER 0.30 0.00 1 114 ASP 0.50 0.30 1 115 GLU -0.20 0.00 1 116 LEU 0.60 0.10 1 117 GLN -0.30 -0.30 1 118 THR 0.20 0.10 1 119 ILE 0.10 -0.20 1 120 GLN -0.50 -0.40 1 121 GLU -1.20 -0.50 1 122 ASP -0.70 -0.60 1 124 THR 1.00 0.60 1 125 ALA 0.30 0.10 1 126 ALA 0.30 0.10 1 127 SER 0.40 0.10 1 130 LEU 0.20 0.10 1 131 ASP 0.10 -0.20 1 132 VAL 1.50 0.80 1 133 MET 0.50 -0.20 1 134 ALA 0.80 0.60 1 135 SER 0.90 0.50 1 136 GLN 0.30 0.10 1 137 LYS 0.10 -0.20 1 138 ARG 0.20 -0.10 1 140 SER 0.30 0.00 1 141 GLN 0.20 0.20 1 142 ARG 0.60 0.30 1 143 SER 0.60 0.20 1 144 LYS 1.10 0.60 1 145 TYR 0.40 0.10 1 146 LEU -0.40 -0.40 1 147 ALA 0.30 0.10 1 148 THR -0.10 -0.20 1 149 ALA 0.30 0.20 1 150 SER 0.40 0.10 1 151 THR 0.70 0.30 1 152 MET 0.50 0.20 1 153 ASP 0.50 0.20 1 155 ALA 0.40 0.20 1 156 ARG 0.50 0.00 1 157 HIS 0.20 0.90 1 159 PHE -0.40 -0.30 1 160 LEU -0.70 -0.60 1 162 ARG 0.60 -0.20 1 165 ASP 0.00 0.00 1 166 THR 0.40 0.20 1 168 ILE 0.60 0.20 1 169 LEU 0.30 0.00 1 171 SER 1.00 0.50 1 172 ILE 1.20 0.60 1 174 ARG 0.40 0.10 1 175 PHE -0.10 -0.20 1 176 PHE -0.30 -0.20 1 177 SER 0.00 -0.10 1 179 ASP 0.00 0.00 1 180 ARG 1.00 0.30 1 182 ALA 0.10 -0.10 1 184 LYS 0.10 -0.20 1 185 ARG 0.30 0.10 1 187 SER 0.00 0.00 1 189 LYS 0.10 -0.10 1 190 VAL 0.00 -0.10 1 191 SER -0.10 -0.40 1 192 LEU 0.30 -0.10 1 193 GLU -0.40 -0.20 1 194 HIS -0.10 0.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 0.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.80 _LACS_plot.Line_2_terminator_val_x_2 1.49 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 154 HIS 0.60 0.70 0 163 HIS -0.50 1.20 0 10 SER 0.50 -0.40 1 11 ALA 0.40 -0.20 1 12 GLU 0.20 0.00 1 13 LYS 0.60 -0.40 1 14 ALA 0.20 -0.10 1 15 SER 0.20 -0.20 1 16 LYS 0.70 -0.50 1 17 ASP 0.80 -0.20 1 19 GLU -0.50 0.30 1 20 ILE 0.60 -0.40 1 21 HIS 0.00 0.50 1 22 ARG 0.70 -0.30 1 24 GLU -0.50 0.30 1 25 ALA 0.60 -0.20 1 27 LYS 0.10 -0.20 1 28 LYS 0.20 -0.20 1 29 ARG 0.30 -0.20 1 30 SER 0.00 -0.30 1 31 VAL 0.30 -0.30 1 33 LYS 0.10 -0.10 1 34 LEU 0.40 -0.40 1 35 SER 0.30 -0.40 1 36 GLN 0.20 0.00 1 37 THR 0.10 -0.20 1 38 ALA 0.00 0.00 1 39 SER 0.20 -0.20 1 40 GLU -0.10 0.10 1 41 ASP 0.30 -0.20 1 42 SER 0.20 0.00 1 43 ASP 0.20 -0.20 1 44 VAL 0.60 -0.50 1 45 PHE 0.20 -0.20 1 47 GLU -0.50 0.30 1 48 ALA 0.50 -0.20 1 49 ASP 0.40 -0.30 1 50 ALA 0.20 -0.10 1 51 ILE 0.70 -0.50 1 52 GLN 0.10 -0.20 1 53 ASN 0.20 -0.20 1 54 ASN 0.20 -0.10 1 56 THR -0.30 0.10 1 57 SER -0.30 0.10 1 58 ALA 0.30 -0.10 1 59 GLU -0.20 0.20 1 60 ASP 0.30 -0.10 1 61 THR 0.60 -0.40 1 62 ALA 0.40 -0.20 1 63 VAL 0.80 -0.50 1 64 THR 0.40 -0.30 1 65 ASP 0.00 0.00 1 66 SER 0.90 -0.40 1 67 LYS 0.70 -0.50 1 68 HIS 0.20 0.50 1 69 THR 0.30 -0.20 1 70 ALA -0.50 0.00 1 71 ASP -0.30 0.10 1 73 LYS 1.30 -0.90 1 74 ASN 0.20 -0.30 1 75 ASN 0.20 -0.30 1 76 TRP 0.60 -0.50 1 77 GLN 0.60 -0.30 1 79 ALA -0.50 0.20 1 80 HIS 0.10 0.10 1 82 ALA -0.30 -0.10 1 83 ASP -0.50 0.20 1 86 ASN -0.00 -0.30 1 87 ARG 0.60 -0.40 1 89 HIS 0.00 0.70 1 90 LEU -0.10 -0.10 1 91 ILE 0.30 -0.50 1 92 ARG -0.10 -0.20 1 93 LEU -0.40 0.00 1 94 PHE -0.30 0.00 1 95 SER -0.40 0.00 1 96 ARG 0.30 -0.20 1 97 ASP -0.10 0.00 1 98 ALA -0.20 0.10 1 101 ARG 0.20 -0.20 1 102 GLU -0.20 0.00 1 103 ASP -0.10 -0.10 1 104 ASN 0.30 -0.20 1 105 THR 1.20 -0.30 1 106 PHE 0.80 -0.60 1 107 LYS 0.00 -0.10 1 108 ASP 0.10 -0.10 1 109 ARG -0.10 0.00 1 111 SER 0.20 -0.20 1 112 GLU 0.10 0.10 1 113 SER 0.30 -0.30 1 114 ASP 0.50 -0.20 1 115 GLU -0.20 0.20 1 116 LEU 0.60 -0.50 1 117 GLN -0.30 0.00 1 118 THR 0.20 -0.10 1 119 ILE 0.10 -0.30 1 120 GLN -0.50 0.10 1 121 GLU -1.20 0.70 1 122 ASP -0.70 0.10 1 124 THR 1.00 -0.40 1 125 ALA 0.30 -0.20 1 126 ALA 0.30 -0.20 1 127 SER 0.40 -0.30 1 130 LEU 0.20 -0.10 1 131 ASP 0.10 -0.30 1 132 VAL 1.50 -0.70 1 133 MET 0.50 -0.70 1 134 ALA 0.80 -0.20 1 135 SER 0.90 -0.40 1 136 GLN 0.30 -0.20 1 137 LYS 0.10 -0.30 1 138 ARG 0.20 -0.30 1 140 SER 0.30 -0.30 1 141 GLN 0.20 0.00 1 142 ARG 0.60 -0.30 1 143 SER 0.60 -0.40 1 144 LYS 1.10 -0.50 1 145 TYR 0.40 -0.30 1 146 LEU -0.40 0.00 1 147 ALA 0.30 -0.20 1 148 THR -0.10 -0.10 1 149 ALA 0.30 -0.10 1 150 SER 0.40 -0.30 1 151 THR 0.70 -0.40 1 152 MET 0.50 -0.30 1 153 ASP 0.50 -0.30 1 155 ALA 0.40 -0.20 1 156 ARG 0.50 -0.50 1 157 HIS 0.20 0.70 1 159 PHE -0.40 0.10 1 160 LEU -0.70 0.10 1 162 ARG 0.60 -0.80 1 165 ASP 0.00 0.00 1 166 THR 0.40 -0.20 1 168 ILE 0.60 -0.40 1 169 LEU 0.30 -0.30 1 171 SER 1.00 -0.50 1 172 ILE 1.20 -0.60 1 174 ARG 0.40 -0.30 1 175 PHE -0.10 -0.10 1 176 PHE -0.30 0.10 1 177 SER 0.00 -0.10 1 179 ASP 0.00 0.00 1 180 ARG 1.00 -0.70 1 182 ALA 0.10 -0.20 1 184 LYS 0.10 -0.30 1 185 ARG 0.30 -0.20 1 187 SER 0.00 0.00 1 189 LYS 0.10 -0.20 1 190 VAL 0.00 -0.10 1 191 SER -0.10 -0.30 1 192 LEU 0.30 -0.40 1 193 GLU -0.40 0.20 1 194 HIS -0.10 0.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 -0.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.21 _LACS_plot.Line_2_terminator_val_x_2 1.49 _LACS_plot.Line_2_terminator_val_y_2 -0.25 _LACS_plot.Y_axis_chem_shift_offset 0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 ASP -0.70 -0.79 0 10 SER 0.50 -0.27 1 11 ALA 0.40 -0.20 1 12 GLU 0.20 -0.33 1 13 LYS 0.60 -0.24 1 14 ALA 0.20 -0.19 1 15 SER 0.20 -0.24 1 16 LYS 0.70 -0.18 1 17 ASP 0.80 -0.26 1 19 GLU -0.50 -0.28 1 20 ILE 0.60 -0.29 1 21 HIS 0.00 -0.22 1 22 ARG 0.70 -0.19 1 24 GLU -0.50 0.05 1 25 ALA 0.60 -0.23 1 27 LYS 0.10 -0.21 1 28 LYS 0.20 -0.21 1 29 ARG 0.30 -0.20 1 30 SER 0.00 -0.16 1 31 VAL 0.30 -0.12 1 33 LYS 0.10 -0.20 1 34 LEU 0.40 -0.16 1 35 SER 0.30 -0.23 1 36 GLN 0.20 -0.11 1 37 THR 0.10 -0.21 1 38 ALA 0.00 -0.14 1 39 SER 0.20 -0.24 1 40 GLU -0.10 -0.24 1 41 ASP 0.30 -0.20 1 42 SER 0.20 -0.25 1 43 ASP 0.20 -0.20 1 44 VAL 0.60 -0.28 1 45 PHE 0.20 -0.16 1 47 GLU -0.50 -0.31 1 48 ALA 0.50 -0.25 1 49 ASP 0.40 -0.30 1 50 ALA 0.20 -0.23 1 51 ILE 0.70 -0.28 1 52 GLN 0.10 -0.22 1 53 ASN 0.20 -0.20 1 54 ASN 0.20 -0.19 1 56 THR -0.30 -0.10 1 57 SER -0.30 -0.16 1 58 ALA 0.30 -0.20 1 59 GLU -0.20 -0.31 1 60 ASP 0.30 -0.18 1 61 THR 0.60 -0.25 1 62 ALA 0.40 -0.17 1 63 VAL 0.80 -0.19 1 64 THR 0.40 -0.21 1 65 ASP 0.00 -0.19 1 66 SER 0.90 -0.29 1 67 LYS 0.70 -0.25 1 68 HIS 0.20 -0.27 1 69 THR 0.30 -0.26 1 70 ALA -0.50 -0.20 1 71 ASP -0.30 -0.29 1 73 LYS 1.30 -0.33 1 74 ASN 0.20 -0.28 1 75 ASN 0.20 -0.28 1 76 TRP 0.60 -0.25 1 77 GLN 0.60 -0.38 1 79 ALA -0.50 -0.28 1 80 HIS 0.10 -0.35 1 82 ALA -0.30 -0.24 1 83 ASP -0.50 -0.29 1 86 ASN -0.00 -0.22 1 87 ARG 0.60 -0.23 1 89 HIS 0.00 -0.29 1 90 LEU -0.10 -0.19 1 91 ILE 0.30 -0.26 1 92 ARG -0.10 -0.23 1 93 LEU -0.40 -0.24 1 94 PHE -0.30 -0.59 1 95 SER -0.40 -0.25 1 96 ARG 0.30 -0.20 1 97 ASP -0.10 -0.23 1 98 ALA -0.20 -0.25 1 101 ARG 0.20 -0.23 1 102 GLU -0.20 -0.27 1 103 ASP -0.10 -0.22 1 104 ASN 0.30 -0.19 1 105 THR 1.20 -0.34 1 106 PHE 0.80 -0.24 1 107 LYS 0.00 -0.25 1 108 ASP 0.10 -0.30 1 109 ARG -0.10 -0.23 1 111 SER 0.20 -0.25 1 112 GLU 0.10 -0.21 1 113 SER 0.30 -0.24 1 114 ASP 0.50 -0.21 1 115 GLU -0.20 -0.30 1 116 LEU 0.60 -0.21 1 117 GLN -0.30 0.07 1 118 THR 0.20 -0.22 1 119 ILE 0.10 -0.19 1 120 GLN -0.50 -0.19 1 121 GLU -1.20 -0.24 1 124 THR 1.00 -0.24 1 125 ALA 0.30 -0.24 1 126 ALA 0.30 -0.20 1 127 SER 0.40 -0.22 1 130 LEU 0.20 -0.21 1 131 ASP 0.10 -0.22 1 132 VAL 1.50 -0.26 1 133 MET 0.50 -0.34 1 134 ALA 0.80 -0.27 1 135 SER 0.90 -0.29 1 136 GLN 0.30 -0.20 1 137 LYS 0.10 -0.22 1 138 ARG 0.20 -0.21 1 140 SER 0.30 -0.26 1 141 GLN 0.20 -0.17 1 142 ARG 0.60 -0.19 1 143 SER 0.60 -0.28 1 144 LYS 1.10 -0.30 1 145 TYR 0.40 -0.22 1 146 LEU -0.40 -0.24 1 147 ALA 0.30 -0.18 1 148 THR -0.10 -0.23 1 149 ALA 0.30 -0.17 1 150 SER 0.40 -0.17 1 151 THR 0.70 -0.21 1 152 MET 0.50 -0.24 1 153 ASP 0.50 -0.30 1 154 HIS 0.60 -0.42 1 155 ALA 0.40 -0.26 1 156 ARG 0.50 -0.28 1 157 HIS 0.20 -0.29 1 159 PHE -0.40 -0.18 1 160 LEU -0.70 -0.28 1 162 ARG 0.60 0.08 1 163 HIS -0.50 -0.32 1 165 ASP 0.00 -0.14 1 166 THR 0.40 -0.23 1 168 ILE 0.60 -0.22 1 169 LEU 0.30 -0.16 1 171 SER 1.00 -0.29 1 172 ILE 1.20 -0.19 1 174 ARG 0.40 -0.28 1 175 PHE -0.10 -0.19 1 176 PHE -0.30 -0.66 1 177 SER 0.00 -0.29 1 179 ASP 0.00 -0.23 1 180 ARG 1.00 -0.24 1 182 ALA 0.10 -0.28 1 184 LYS 0.10 -0.18 1 187 SER 0.00 -0.22 1 189 LYS 0.10 -0.18 1 190 VAL 0.00 -0.16 1 191 SER -0.10 -0.19 1 192 LEU 0.30 -0.20 1 193 GLU -0.40 -0.34 1 194 HIS -0.10 -0.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7358_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.20 _LACS_plot.Line_1_terminator_val_y_1 -0.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 1.49 _LACS_plot.Line_2_terminator_val_y_2 0.38 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 121 GLU -1.20 -0.90 0 163 HIS -0.50 0.80 0 157 HIS 0.20 1.30 0 10 SER 0.50 -0.10 1 11 ALA 0.40 0.20 1 12 GLU 0.20 0.20 1 13 LYS 0.60 -0.20 1 14 ALA 0.20 0.10 1 15 SER 0.20 0.40 1 16 LYS 0.70 0.00 1 17 ASP 0.80 0.50 1 19 GLU -0.50 0.00 1 20 ILE 0.60 -0.30 1 21 HIS 0.00 0.80 1 22 ARG 0.70 0.40 1 24 GLU -0.50 0.00 1 25 ALA 0.60 0.60 1 27 LYS 0.10 0.00 1 28 LYS 0.20 -0.10 1 29 ARG 0.30 -0.10 1 30 SER 0.00 -0.30 1 31 VAL 0.30 0.20 1 33 LYS 0.10 0.10 1 34 LEU 0.40 -0.20 1 35 SER 0.30 -0.20 1 36 GLN 0.20 0.00 1 37 THR 0.10 -0.50 1 38 ALA 0.00 -0.10 1 39 SER 0.20 0.10 1 40 GLU -0.10 -0.40 1 41 ASP 0.30 -0.20 1 42 SER 0.20 -0.40 1 43 ASP 0.20 -0.20 1 44 VAL 0.60 -0.40 1 45 PHE 0.20 0.40 1 47 GLU -0.50 0.00 1 48 ALA 0.50 -0.10 1 49 ASP 0.40 -0.30 1 50 ALA 0.20 0.00 1 51 ILE 0.70 0.10 1 52 GLN 0.10 -0.40 1 53 ASN 0.20 -0.30 1 54 ASN 0.20 0.50 1 56 THR -0.30 -0.10 1 57 SER -0.30 -0.20 1 58 ALA 0.30 0.00 1 59 GLU -0.20 -0.30 1 60 ASP 0.30 0.30 1 61 THR 0.60 -0.30 1 62 ALA 0.40 0.20 1 63 VAL 0.80 0.30 1 64 THR 0.40 -0.50 1 65 ASP 0.00 0.10 1 66 SER 0.90 0.20 1 67 LYS 0.70 -0.20 1 68 HIS 0.20 0.80 1 69 THR 0.30 -0.80 1 70 ALA -0.50 -0.90 1 71 ASP -0.30 -0.20 1 73 LYS 1.30 0.00 1 74 ASN 0.20 -0.40 1 75 ASN 0.20 -0.30 1 76 TRP 0.60 0.40 1 77 GLN 0.60 0.00 1 79 ALA -0.50 -0.70 1 80 HIS 0.10 0.00 1 82 ALA -0.30 -0.70 1 83 ASP -0.50 -0.10 1 86 ASN -0.00 -0.50 1 87 ARG 0.60 -0.50 1 89 HIS 0.00 0.50 1 90 LEU -0.10 -0.80 1 91 ILE 0.30 -0.60 1 92 ARG -0.10 -0.80 1 93 LEU -0.40 -0.80 1 94 PHE -0.30 -0.30 1 95 SER -0.40 -0.30 1 96 ARG 0.30 -0.50 1 97 ASP -0.10 -1.00 1 98 ALA -0.20 -0.80 1 101 ARG 0.20 0.10 1 102 GLU -0.20 -0.60 1 103 ASP -0.10 -0.30 1 104 ASN 0.30 0.30 1 105 THR 1.20 -0.20 1 106 PHE 0.80 -0.20 1 107 LYS 0.00 -0.90 1 108 ASP 0.10 -0.80 1 109 ARG -0.10 -0.60 1 111 SER 0.20 0.20 1 112 GLU 0.10 -0.10 1 113 SER 0.30 -0.20 1 114 ASP 0.50 0.10 1 115 GLU -0.20 0.00 1 116 LEU 0.60 -0.20 1 117 GLN -0.30 0.00 1 118 THR 0.20 -0.40 1 119 ILE 0.10 -0.50 1 120 GLN -0.50 -0.50 1 122 ASP -0.70 0.00 1 124 THR 1.00 0.10 1 125 ALA 0.30 -0.10 1 126 ALA 0.30 0.20 1 127 SER 0.40 0.60 1 130 LEU 0.20 -0.50 1 131 ASP 0.10 0.30 1 132 VAL 1.50 0.40 1 133 MET 0.50 0.40 1 134 ALA 0.80 0.40 1 135 SER 0.90 0.10 1 136 GLN 0.30 -0.20 1 137 LYS 0.10 -0.40 1 138 ARG 0.20 -0.30 1 140 SER 0.30 0.10 1 141 GLN 0.20 0.00 1 142 ARG 0.60 0.10 1 143 SER 0.60 0.10 1 144 LYS 1.10 -0.40 1 145 TYR 0.40 -0.40 1 146 LEU -0.40 -1.00 1 147 ALA 0.30 0.10 1 148 THR -0.10 -0.30 1 149 ALA 0.30 0.10 1 150 SER 0.40 0.50 1 151 THR 0.70 0.10 1 152 MET 0.50 -0.40 1 153 ASP 0.50 0.00 1 154 HIS 0.60 1.00 1 155 ALA 0.40 0.00 1 156 ARG 0.50 -0.10 1 159 PHE -0.40 -0.70 1 160 LEU -0.70 -1.30 1 162 ARG 0.60 -0.20 1 165 ASP 0.00 0.10 1 166 THR 0.40 0.50 1 168 ILE 0.60 0.00 1 169 LEU 0.30 -0.40 1 171 SER 1.00 0.20 1 172 ILE 1.20 0.40 1 174 ARG 0.40 -0.40 1 175 PHE -0.10 -0.50 1 176 PHE -0.30 -0.50 1 177 SER 0.00 0.10 1 179 ASP 0.00 0.20 1 180 ARG 1.00 0.50 1 182 ALA 0.10 -0.60 1 184 LYS 0.10 0.10 1 185 ARG 0.30 0.40 1 187 SER 0.00 0.40 1 189 LYS 0.10 0.00 1 190 VAL 0.00 -0.30 1 191 SER -0.10 -0.10 1 192 LEU 0.30 -0.40 1 193 GLU -0.40 -0.50 1 194 HIS -0.10 0.60 1 stop_ save_