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 bmr26717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.10 _LACS_plot.Line_1_terminator_val_y_1 -3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 4.09 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 88 MET -8.10 -0.40 0 10 ASN 3.30 1.50 1 12 ALA -0.20 -1.50 1 13 ASP 1.30 1.20 1 14 GLN 0.70 0.30 1 16 GLN 3.50 3.20 1 17 LEU 5.10 2.20 1 18 LYS 2.80 1.20 1 20 ILE -5.80 -2.20 1 21 ARG 0.50 -0.40 1 22 ALA -4.90 -1.60 1 24 ALA -0.40 0.80 1 25 ASN -2.60 -1.60 1 26 ASN -0.20 0.50 1 29 VAL 0.90 0.70 1 30 THR -1.10 -0.50 1 31 ASP -2.00 -1.90 1 32 VAL 2.90 1.00 1 33 MET 0.10 -2.20 1 34 SER -2.10 -1.60 1 35 SER 4.60 3.40 1 36 ASP 3.10 2.40 1 37 ILE -4.00 -3.30 1 38 ILE 5.90 4.90 1 40 ASN -1.10 0.80 1 41 ALA 1.10 -1.50 1 42 VAL 2.90 2.70 1 43 THR 0.50 0.80 1 44 MET -1.90 -0.30 1 45 LYS -1.80 -1.00 1 46 ASP -4.30 -0.70 1 47 SER 0.10 -0.10 1 48 ASN 0.00 1.40 1 49 VAL -1.20 -0.80 1 50 LEU -1.00 -0.90 1 51 THR 3.20 2.10 1 52 VAL -3.50 -1.00 1 54 ALA 3.40 2.00 1 56 ALA -1.80 -0.20 1 57 LYS 0.90 -0.40 1 58 VAL 0.20 -0.70 1 60 HIS -6.90 -1.50 1 61 PHE -3.20 -2.20 1 62 TRP -3.20 -2.70 1 64 HIS 0.60 1.70 1 65 GLU -7.10 -4.30 1 66 ILE 5.70 1.60 1 69 ALA -1.00 -0.10 1 70 ALA -0.30 -0.50 1 73 ASN 0.60 -0.10 1 74 ASP -0.10 -0.40 1 75 ALA 1.00 0.60 1 76 ASP 0.10 -1.30 1 79 ILE -2.90 -1.80 1 80 ALA 1.40 0.20 1 81 ALA 3.00 2.00 1 82 SER -0.20 0.20 1 83 HIS 2.60 -1.00 1 84 LYS -2.50 -1.50 1 87 ILE -4.30 -0.70 1 89 VAL -3.40 -1.40 1 90 TYR -7.70 -2.30 1 91 LEU -6.20 -1.90 1 92 ALA -2.90 -1.10 1 93 LYS 1.10 0.20 1 94 VAL -6.30 -3.40 1 95 ASP 3.60 2.40 1 96 ASN -1.40 -0.60 1 97 ALA 2.50 2.20 1 98 ALA 1.50 1.00 1 99 THR -0.40 -0.50 1 100 THR 3.70 1.50 1 102 THR 0.40 -0.40 1 103 SER 0.60 0.50 1 105 LEU 0.40 -1.00 1 106 LYS 0.20 -1.00 1 107 TRP -2.80 -0.90 1 108 PHE -4.20 -2.60 1 109 LYS -1.20 0.30 1 110 VAL 1.40 1.00 1 111 ALA -2.90 0.10 1 112 GLU -0.40 -1.00 1 113 ALA -3.10 0.10 1 115 LEU -2.80 -1.50 1 116 SER -1.90 -1.40 1 117 ASN 2.60 1.10 1 119 LYS -3.00 -1.50 1 120 TRP -3.10 -1.20 1 121 ALA 2.50 3.10 1 122 VAL 2.50 4.50 1 123 ASP 5.30 4.60 1 124 ASP 4.60 3.40 1 125 LEU 2.90 3.10 1 126 ILE 5.20 5.10 1 127 ALA 3.60 2.50 1 128 ASN -0.10 0.00 1 129 ASN 3.30 1.80 1 131 TRP -3.80 -1.10 1 132 SER -2.60 -1.80 1 133 TYR -5.40 -0.70 1 134 PHE -3.20 -0.90 1 135 ASP -1.70 -1.50 1 136 MET 0.60 -0.70 1 138 THR 3.20 2.70 1 140 ILE -0.50 0.00 1 141 ALA 0.50 -0.60 1 144 GLN 1.80 0.70 1 145 TYR -4.80 -0.60 1 146 LEU -4.40 -1.60 1 147 MET -6.40 -1.80 1 148 ARG -5.00 -1.20 1 149 ALA -3.60 -1.90 1 150 GLU -7.70 -1.90 1 151 LEU -4.00 -1.00 1 152 ILE -2.60 -2.00 1 153 ALA -3.80 -1.80 1 154 LEU -0.80 -0.50 1 155 HIS 4.60 4.50 1 156 ASN -2.00 -1.80 1 157 ALA 0.90 1.40 1 159 SER -3.60 -2.10 1 160 GLN 3.70 2.20 1 161 ALA 4.10 1.50 1 163 ALA 1.70 1.10 1 164 GLN -3.20 -1.50 1 165 PHE 0.40 0.20 1 166 TYR 1.80 1.30 1 167 ILE -9.10 -1.80 1 170 ALA -6.70 -3.20 1 171 GLN 0.20 -0.60 1 172 ILE -5.80 -1.60 1 173 ASN -3.30 -1.20 1 174 VAL -2.50 -1.10 1 175 THR -4.70 -2.80 1 179 SER -2.10 -1.20 1 180 ALA -0.10 1.20 1 181 SER -2.30 -1.80 1 183 SER 0.50 0.80 1 184 ASN 0.50 -0.30 1 185 THR -4.50 -2.20 1 186 VAL -6.30 -3.30 1 187 SER -2.90 -1.40 1 188 PHE -3.30 0.80 1 191 ALA 2.80 1.90 1 192 TYR -6.60 -6.00 1 193 SER -4.30 -2.50 1 194 ALA 1.70 1.10 1 195 SER -0.70 -1.10 1 199 ILE 0.30 2.20 1 200 LEU 0.80 -1.20 1 201 ILE -1.20 -1.30 1 202 ASN -1.90 -2.30 1 203 ILE 1.90 1.50 1 204 TYR 0.80 0.30 1 207 SER 0.10 -0.30 1 209 LYS -0.50 -0.20 1 210 THR 1.60 -1.40 1 211 ASP -1.60 -1.70 1 212 ASN -0.90 0.60 1 215 LYS 1.70 -0.10 1 217 TYR -2.30 -0.60 1 218 GLN 0.10 -1.40 1 219 ILE 1.60 1.90 1 223 ALA -0.20 -0.40 1 224 LEU -0.60 0.70 1 225 PHE 1.40 1.70 1 226 THR -4.40 -2.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.10 _LACS_plot.Line_1_terminator_val_y_1 6.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -1.81 _LACS_plot.Y_axis_chem_shift_offset 0.25 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 88 MET -8.10 7.70 0 10 ASN 3.30 -1.80 1 12 ALA -0.20 -1.30 1 13 ASP 1.30 -0.10 1 14 GLN 0.70 -0.40 1 16 GLN 3.50 -0.30 1 17 LEU 5.10 -2.90 1 18 LYS 2.80 -1.60 1 20 ILE -5.80 3.60 1 21 ARG 0.50 -0.90 1 22 ALA -4.90 3.30 1 24 ALA -0.40 1.20 1 25 ASN -2.60 1.00 1 26 ASN -0.20 0.70 1 29 VAL 0.90 -0.20 1 30 THR -1.10 0.60 1 31 ASP -2.00 0.10 1 32 VAL 2.90 -1.90 1 33 MET 0.10 -2.30 1 34 SER -2.10 0.50 1 35 SER 4.60 -1.20 1 36 ASP 3.10 -0.70 1 37 ILE -4.00 0.70 1 38 ILE 5.90 -1.00 1 40 ASN -1.10 1.90 1 41 ALA 1.10 -2.60 1 42 VAL 2.90 -0.20 1 43 THR 0.50 0.30 1 44 MET -1.90 1.60 1 45 LYS -1.80 0.80 1 46 ASP -4.30 3.60 1 47 SER 0.10 -0.20 1 48 ASN 0.00 1.40 1 49 VAL -1.20 0.40 1 50 LEU -1.00 0.10 1 51 THR 3.20 -1.10 1 52 VAL -3.50 2.50 1 54 ALA 3.40 -1.40 1 56 ALA -1.80 1.60 1 57 LYS 0.90 -1.30 1 58 VAL 0.20 -0.90 1 60 HIS -6.90 5.40 1 61 PHE -3.20 1.00 1 62 TRP -3.20 0.50 1 64 HIS 0.60 1.10 1 65 GLU -7.10 2.80 1 66 ILE 5.70 -4.10 1 69 ALA -1.00 0.90 1 70 ALA -0.30 -0.20 1 73 ASN 0.60 -0.70 1 74 ASP -0.10 -0.30 1 75 ALA 1.00 -0.40 1 76 ASP 0.10 -1.40 1 79 ILE -2.90 1.10 1 80 ALA 1.40 -1.20 1 81 ALA 3.00 -1.00 1 82 SER -0.20 0.40 1 83 HIS 2.60 -3.60 1 84 LYS -2.50 1.00 1 87 ILE -4.30 3.60 1 89 VAL -3.40 2.00 1 90 TYR -7.70 5.40 1 91 LEU -6.20 4.30 1 92 ALA -2.90 1.80 1 93 LYS 1.10 -0.90 1 94 VAL -6.30 2.90 1 95 ASP 3.60 -1.20 1 96 ASN -1.40 0.80 1 97 ALA 2.50 -0.30 1 98 ALA 1.50 -0.50 1 99 THR -0.40 -0.10 1 100 THR 3.70 -2.20 1 102 THR 0.40 -0.80 1 103 SER 0.60 -0.10 1 105 LEU 0.40 -1.40 1 106 LYS 0.20 -1.20 1 107 TRP -2.80 1.90 1 108 PHE -4.20 1.60 1 109 LYS -1.20 1.50 1 110 VAL 1.40 -0.40 1 111 ALA -2.90 3.00 1 112 GLU -0.40 -0.60 1 113 ALA -3.10 3.20 1 115 LEU -2.80 1.30 1 116 SER -1.90 0.50 1 117 ASN 2.60 -1.50 1 119 LYS -3.00 1.50 1 120 TRP -3.10 1.90 1 121 ALA 2.50 0.60 1 122 VAL 2.50 2.00 1 123 ASP 5.30 -0.70 1 124 ASP 4.60 -1.20 1 125 LEU 2.90 0.20 1 126 ILE 5.20 -0.10 1 127 ALA 3.60 -1.10 1 128 ASN -0.10 0.10 1 129 ASN 3.30 -1.50 1 131 TRP -3.80 2.70 1 132 SER -2.60 0.80 1 133 TYR -5.40 4.70 1 134 PHE -3.20 2.30 1 135 ASP -1.70 0.20 1 136 MET 0.60 -1.30 1 138 THR 3.20 -0.50 1 140 ILE -0.50 0.50 1 141 ALA 0.50 -1.10 1 144 GLN 1.80 -1.10 1 145 TYR -4.80 4.20 1 146 LEU -4.40 2.80 1 147 MET -6.40 4.60 1 148 ARG -5.00 3.80 1 149 ALA -3.60 1.70 1 150 GLU -7.70 5.80 1 151 LEU -4.00 3.00 1 152 ILE -2.60 0.60 1 153 ALA -3.80 2.00 1 154 LEU -0.80 0.30 1 155 HIS 4.60 -0.10 1 156 ASN -2.00 0.20 1 157 ALA 0.90 0.50 1 159 SER -3.60 1.50 1 160 GLN 3.70 -1.50 1 161 ALA 4.10 -2.60 1 163 ALA 1.70 -0.60 1 164 GLN -3.20 1.70 1 165 PHE 0.40 -0.20 1 166 TYR 1.80 -0.50 1 167 ILE -9.10 7.30 1 170 ALA -6.70 3.50 1 171 GLN 0.20 -0.80 1 172 ILE -5.80 4.20 1 173 ASN -3.30 2.10 1 174 VAL -2.50 1.40 1 175 THR -4.70 1.90 1 179 SER -2.10 0.90 1 180 ALA -0.10 1.30 1 181 SER -2.30 0.50 1 183 SER 0.50 0.30 1 184 ASN 0.50 -0.80 1 185 THR -4.50 2.30 1 186 VAL -6.30 3.00 1 187 SER -2.90 1.50 1 188 PHE -3.30 4.10 1 191 ALA 2.80 -0.90 1 192 TYR -6.60 0.60 1 193 SER -4.30 1.80 1 194 ALA 1.70 -0.60 1 195 SER -0.70 -0.40 1 199 ILE 0.30 1.90 1 200 LEU 0.80 -2.00 1 201 ILE -1.20 -0.10 1 202 ASN -1.90 -0.40 1 203 ILE 1.90 -0.40 1 204 TYR 0.80 -0.50 1 207 SER 0.10 -0.40 1 209 LYS -0.50 0.30 1 210 THR 1.60 -3.00 1 211 ASP -1.60 -0.10 1 212 ASN -0.90 1.50 1 215 LYS 1.70 -1.80 1 217 TYR -2.30 1.70 1 218 GLN 0.10 -1.50 1 219 ILE 1.60 0.30 1 223 ALA -0.20 -0.20 1 224 LEU -0.60 1.30 1 225 PHE 1.40 0.30 1 226 THR -4.40 1.80 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.10 _LACS_plot.Line_1_terminator_val_y_1 0.97 _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 0.18 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _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 167 ILE -9.10 1.52 0 38 ILE 5.90 0.32 0 133 TYR -5.40 1.69 0 10 ASN 3.30 -0.26 1 12 ALA -0.20 0.23 1 13 ASP 1.30 -0.49 1 14 GLN 0.70 -0.25 1 16 GLN 3.50 -0.41 1 17 LEU 5.10 -0.98 1 18 LYS 2.80 -0.19 1 20 ILE -5.80 0.21 1 21 ARG 0.50 0.67 1 22 ALA -4.90 0.76 1 24 ALA -0.40 -0.30 1 25 ASN -2.60 -0.09 1 26 ASN -0.20 -0.04 1 29 VAL 0.90 -0.05 1 30 THR -1.10 0.61 1 31 ASP -2.00 0.16 1 32 VAL 2.90 -0.51 1 33 MET 0.10 0.31 1 34 SER -2.10 -0.06 1 35 SER 4.60 -0.20 1 36 ASP 3.10 -0.67 1 37 ILE -4.00 -0.39 1 40 ASN -1.10 -0.20 1 41 ALA 1.10 0.14 1 42 VAL 2.90 -0.71 1 43 THR 0.50 0.19 1 44 MET -1.90 0.27 1 45 LYS -1.80 0.52 1 46 ASP -4.30 0.22 1 47 SER 0.10 0.02 1 48 ASN 0.00 -0.19 1 49 VAL -1.20 0.06 1 50 LEU -1.00 0.13 1 51 THR 3.20 0.43 1 52 VAL -3.50 -0.04 1 54 ALA 3.40 -0.57 1 56 ALA -1.80 0.01 1 57 LYS 0.90 0.37 1 58 VAL 0.20 0.54 1 60 HIS -6.90 0.88 1 61 PHE -3.20 0.11 1 62 TRP -3.20 0.00 1 64 HIS 0.60 0.09 1 65 GLU -7.10 0.34 1 66 ILE 5.70 -0.48 1 69 ALA -1.00 -0.21 1 70 ALA -0.30 -0.20 1 73 ASN 0.60 -0.13 1 74 ASP -0.10 -0.15 1 75 ALA 1.00 -0.04 1 76 ASP 0.10 -0.49 1 79 ILE -2.90 -0.30 1 80 ALA 1.40 -0.48 1 81 ALA 3.00 -0.78 1 82 SER -0.20 -0.38 1 83 HIS 2.60 -0.26 1 84 LYS -2.50 0.70 1 87 ILE -4.30 1.11 1 88 MET -8.10 0.53 1 89 VAL -3.40 0.94 1 90 TYR -7.70 1.03 1 91 LEU -6.20 1.43 1 92 ALA -2.90 0.33 1 93 LYS 1.10 -0.55 1 94 VAL -6.30 0.52 1 95 ASP 3.60 -0.32 1 96 ASN -1.40 -0.28 1 97 ALA 2.50 -0.48 1 98 ALA 1.50 -0.17 1 99 THR -0.40 0.00 1 100 THR 3.70 -0.03 1 102 THR 0.40 0.17 1 103 SER 0.60 0.14 1 105 LEU 0.40 -0.17 1 106 LYS 0.20 0.22 1 107 TRP -2.80 0.77 1 108 PHE -4.20 0.82 1 109 LYS -1.20 -0.42 1 110 VAL 1.40 -0.08 1 111 ALA -2.90 0.28 1 112 GLU -0.40 0.83 1 113 ALA -3.10 0.18 1 115 LEU -2.80 -0.15 1 116 SER -1.90 0.09 1 117 ASN 2.60 -0.48 1 119 LYS -3.00 0.33 1 120 TRP -3.10 0.65 1 121 ALA 2.50 0.07 1 122 VAL 2.50 -0.76 1 123 ASP 5.30 -0.25 1 124 ASP 4.60 -0.11 1 125 LEU 2.90 -0.48 1 126 ILE 5.20 -0.82 1 127 ALA 3.60 -0.09 1 128 ASN -0.10 0.27 1 129 ASN 3.30 -0.26 1 131 TRP -3.80 0.41 1 132 SER -2.60 -0.05 1 134 PHE -3.20 0.33 1 135 ASP -1.70 0.61 1 136 MET 0.60 0.10 1 138 THR 3.20 -0.53 1 140 ILE -0.50 -0.02 1 141 ALA 0.50 -0.17 1 144 GLN 1.80 0.79 1 145 TYR -4.80 0.91 1 146 LEU -4.40 0.99 1 147 MET -6.40 0.91 1 148 ARG -5.00 0.67 1 149 ALA -3.60 0.60 1 150 GLU -7.70 1.18 1 151 LEU -4.00 0.47 1 152 ILE -2.60 0.38 1 153 ALA -3.80 -0.06 1 154 LEU -0.80 0.00 1 155 HIS 4.60 -0.58 1 156 ASN -2.00 0.45 1 157 ALA 0.90 -0.36 1 159 SER -3.60 0.15 1 160 GLN 3.70 0.27 1 161 ALA 4.10 0.14 1 163 ALA 1.70 -0.47 1 164 GLN -3.20 -0.09 1 165 PHE 0.40 -0.17 1 166 TYR 1.80 0.19 1 170 ALA -6.70 1.28 1 171 GLN 0.20 0.15 1 172 ILE -5.80 1.43 1 173 ASN -3.30 0.42 1 174 VAL -2.50 1.20 1 175 THR -4.70 0.40 1 179 SER -2.10 0.21 1 180 ALA -0.10 0.00 1 181 SER -2.30 -0.14 1 183 SER 0.50 -0.04 1 184 ASN 0.50 0.35 1 185 THR -4.50 0.85 1 186 VAL -6.30 0.69 1 187 SER -2.90 -0.24 1 188 PHE -3.30 -0.64 1 191 ALA 2.80 -0.53 1 192 TYR -6.60 0.81 1 193 SER -4.30 0.27 1 194 ALA 1.70 -0.07 1 195 SER -0.70 0.19 1 199 ILE 0.30 -0.28 1 200 LEU 0.80 0.52 1 201 ILE -1.20 0.20 1 202 ASN -1.90 -0.60 1 203 ILE 1.90 0.43 1 204 TYR 0.80 0.33 1 207 SER 0.10 0.00 1 209 LYS -0.50 0.24 1 210 THR 1.60 0.05 1 211 ASP -1.60 -0.09 1 212 ASN -0.90 -0.29 1 215 LYS 1.70 -0.01 1 217 TYR -2.30 -0.15 1 218 GLN 0.10 -0.39 1 219 ILE 1.60 -0.61 1 223 ALA -0.20 -0.06 1 224 LEU -0.60 -0.70 1 225 PHE 1.40 -0.02 1 226 THR -4.40 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26717_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.10 _LACS_plot.Line_1_terminator_val_y_1 -5.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.69 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 -1.94 _LACS_plot.Y_axis_chem_shift_offset 3.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 17 LEU 5.10 -5.70 0 167 ILE -9.10 -2.80 0 150 GLU -7.70 -7.98 0 65 GLU -7.10 -0.70 0 10 ASN 3.30 -3.00 1 12 ALA -0.20 -3.30 1 13 ASP 1.30 -1.50 1 14 GLN 0.70 -2.40 1 16 GLN 3.50 -3.10 1 18 LYS 2.80 -2.10 1 20 ILE -5.80 -3.10 1 21 ARG 0.50 -4.50 1 22 ALA -4.90 -3.80 1 24 ALA -0.40 -2.20 1 25 ASN -2.60 -3.90 1 26 ASN -0.20 -1.70 1 29 VAL 0.90 -2.60 1 30 THR -1.10 -3.10 1 31 ASP -2.00 -3.50 1 32 VAL 2.90 -3.50 1 33 MET 0.10 -2.40 1 34 SER -2.10 -1.00 1 35 SER 4.60 -1.00 1 36 ASP 3.10 -3.10 1 37 ILE -4.00 -5.30 1 38 ILE 5.90 -4.60 1 40 ASN -1.10 -2.90 1 41 ALA 1.10 -3.90 1 42 VAL 2.90 -1.40 1 43 THR 0.50 -3.30 1 44 MET -1.90 -5.60 1 45 LYS -1.80 -5.30 1 46 ASP -4.30 -2.50 1 47 SER 0.10 -3.30 1 48 ASN 0.00 -4.50 1 49 VAL -1.20 -2.60 1 50 LEU -1.00 -3.80 1 51 THR 3.20 -3.30 1 52 VAL -3.50 -5.70 1 54 ALA 3.40 -1.30 1 56 ALA -1.80 -4.90 1 57 LYS 0.90 -3.10 1 58 VAL 0.20 -4.50 1 60 HIS -6.90 -4.10 1 61 PHE -3.20 -5.40 1 62 TRP -3.20 -5.00 1 64 HIS 0.60 -3.40 1 66 ILE 5.70 -1.80 1 69 ALA -1.00 -2.40 1 70 ALA -0.30 -3.60 1 73 ASN 0.60 -3.60 1 74 ASP -0.10 -2.80 1 75 ALA 1.00 -3.10 1 76 ASP 0.10 -6.70 1 79 ILE -2.90 -7.20 1 80 ALA 1.40 -2.80 1 81 ALA 3.00 -3.00 1 82 SER -0.20 -0.10 1 83 HIS 2.60 -4.40 1 84 LYS -2.50 -5.10 1 87 ILE -4.30 -2.40 1 88 MET -8.10 -5.60 1 89 VAL -3.40 -4.00 1 90 TYR -7.70 -4.10 1 91 LEU -6.20 -4.90 1 92 ALA -2.90 -4.30 1 93 LYS 1.10 -2.80 1 94 VAL -6.30 -5.10 1 95 ASP 3.60 -1.40 1 96 ASN -1.40 -2.80 1 97 ALA 2.50 -4.10 1 98 ALA 1.50 -1.20 1 99 THR -0.40 -0.70 1 100 THR 3.70 -2.30 1 102 THR 0.40 -2.70 1 103 SER 0.60 -1.00 1 105 LEU 0.40 -4.00 1 106 LYS 0.20 -4.60 1 107 TRP -2.80 -2.10 1 108 PHE -4.20 -5.40 1 109 LYS -1.20 -3.90 1 110 VAL 1.40 -4.30 1 111 ALA -2.90 -5.00 1 112 GLU -0.40 -6.30 1 113 ALA -3.10 -5.00 1 115 LEU -2.80 -5.10 1 116 SER -1.90 -2.60 1 117 ASN 2.60 -2.70 1 119 LYS -3.00 -4.10 1 120 TRP -3.10 0.50 1 121 ALA 2.50 0.60 1 122 VAL 2.50 -2.80 1 123 ASP 5.30 0.50 1 124 ASP 4.60 -2.10 1 125 LEU 2.90 -0.90 1 126 ILE 5.20 0.60 1 127 ALA 3.60 -1.90 1 128 ASN -0.10 -1.90 1 129 ASN 3.30 -3.30 1 131 TRP -3.80 -3.50 1 132 SER -2.60 -4.70 1 133 TYR -5.40 -1.60 1 134 PHE -3.20 -7.20 1 135 ASP -1.70 -3.20 1 136 MET 0.60 -2.50 1 138 THR 3.20 -0.80 1 140 ILE -0.50 -5.20 1 141 ALA 0.50 -3.00 1 144 GLN 1.80 -2.90 1 145 TYR -4.80 -3.20 1 146 LEU -4.40 -5.10 1 147 MET -6.40 -5.50 1 148 ARG -5.00 -6.30 1 149 ALA -3.60 -6.14 1 151 LEU -4.00 -4.80 1 152 ILE -2.60 -5.40 1 153 ALA -3.80 0.00 1 154 LEU -0.80 -3.20 1 155 HIS 4.60 -0.50 1 156 ASN -2.00 -2.20 1 157 ALA 0.90 -4.30 1 159 SER -3.60 -3.80 1 160 GLN 3.70 -2.00 1 161 ALA 4.10 -4.00 1 163 ALA 1.70 -5.80 1 164 GLN -3.20 -6.60 1 165 PHE 0.40 -4.70 1 166 TYR 1.80 -4.40 1 170 ALA -6.70 -5.10 1 171 GLN 0.20 -4.40 1 172 ILE -5.80 -6.40 1 173 ASN -3.30 -3.70 1 174 VAL -2.50 -1.50 1 175 THR -4.70 -3.50 1 179 SER -2.10 -2.70 1 180 ALA -0.10 -3.10 1 181 SER -2.30 0.80 1 183 SER 0.50 -2.70 1 184 ASN 0.50 -3.60 1 185 THR -4.50 -2.60 1 186 VAL -6.30 -4.50 1 187 SER -2.90 -4.60 1 188 PHE -3.30 -2.50 1 191 ALA 2.80 -2.70 1 192 TYR -6.60 -2.50 1 193 SER -4.30 -2.70 1 194 ALA 1.70 -3.20 1 195 SER -0.70 -2.70 1 199 ILE 0.30 -5.60 1 200 LEU 0.80 -6.50 1 201 ILE -1.20 -7.50 1 202 ASN -1.90 -2.40 1 203 ILE 1.90 -3.90 1 204 TYR 0.80 -0.80 1 207 SER 0.10 -2.10 1 209 LYS -0.50 -1.30 1 210 THR 1.60 -2.50 1 211 ASP -1.60 -0.10 1 212 ASN -0.90 -0.30 1 215 LYS 1.70 -2.30 1 217 TYR -2.30 -3.90 1 218 GLN 0.10 -5.80 1 219 ILE 1.60 -2.00 1 223 ALA -0.20 -2.60 1 224 LEU -0.60 -3.50 1 225 PHE 1.40 -4.80 1 226 THR -4.40 -5.30 1 stop_ save_