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 bmr30332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.45 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 4.67 _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 232 LEU 3.56 -1.41 0 11 ASP -0.06 0.15 1 12 GLN 0.37 0.26 1 13 ARG 0.38 0.12 1 14 ARG -0.29 -0.17 1 16 SER 0.11 0.14 1 17 LEU -0.40 -0.07 1 19 ALA 0.32 0.18 1 20 LEU 0.58 0.24 1 21 HIS -0.40 1.22 1 22 PHE 0.13 -0.20 1 23 ILE 0.02 -0.13 1 24 LYS 0.96 0.69 1 26 ALA -0.25 0.09 1 28 LYS -0.21 -0.05 1 29 ARG 0.23 0.12 1 30 GLU -2.50 -2.33 1 31 SER 0.49 0.50 1 32 SER 0.81 0.78 1 34 HIS -2.62 0.58 1 83 ASN 0.02 -0.06 1 84 LEU -1.46 0.02 1 85 PHE -5.90 -1.33 1 86 VAL -5.89 -3.25 1 87 ALA -0.86 -0.44 1 88 LEU -0.55 0.90 1 89 TYR -7.68 -3.84 1 90 ASP -0.21 0.46 1 91 PHE -2.37 0.09 1 92 VAL -0.65 -1.10 1 93 ALA 0.38 0.73 1 94 SER -1.41 -0.95 1 96 ASP 1.98 1.50 1 97 ASN 1.58 0.99 1 98 THR -2.59 -0.54 1 99 LEU -5.28 -1.31 1 100 SER 0.45 0.48 1 101 ILE -5.36 -1.47 1 102 THR -3.73 -1.82 1 103 LYS 3.28 2.78 1 105 GLU -1.00 0.70 1 106 LYS -1.10 -0.58 1 107 LEU -3.79 -0.94 1 108 ARG -3.44 -1.50 1 109 VAL 0.19 0.27 1 110 LEU 0.45 0.22 1 112 TYR -5.36 -0.50 1 113 ASN 0.22 -0.59 1 114 HIS 3.56 4.62 1 115 ASN -0.84 -1.79 1 117 GLU 1.36 2.06 1 118 TRP -4.25 -1.09 1 119 ALA -5.54 -2.74 1 120 GLU 0.90 -1.45 1 121 ALA -7.80 -2.53 1 122 GLN -4.15 -0.78 1 123 THR -5.01 -2.43 1 124 LYS 3.52 2.39 1 125 ASN -1.07 0.28 1 127 GLN -4.63 -1.92 1 129 TRP -1.27 -0.17 1 130 VAL -3.40 -2.28 1 132 SER 3.31 2.84 1 133 ASN 2.54 0.22 1 134 TYR 0.90 0.10 1 135 ILE -5.23 -1.74 1 136 THR -3.80 -0.90 1 138 VAL 2.03 1.28 1 139 ASN 0.38 0.31 1 140 SER 0.86 0.85 1 141 LEU 2.29 1.37 1 142 GLU 2.20 1.65 1 143 LYS 1.65 0.56 1 144 HIS -0.46 1.12 1 145 SER 4.04 3.02 1 146 TRP -5.40 -3.47 1 147 TYR 1.87 0.91 1 148 HIS -2.96 1.88 1 151 VAL -3.20 -0.78 1 152 SER -1.73 -0.30 1 153 ARG 5.40 4.78 1 154 ASN 3.88 3.37 1 155 ALA 3.49 2.67 1 156 ALA 3.34 2.68 1 157 GLU 5.81 3.87 1 158 TYR 4.74 3.64 1 159 LEU 3.12 2.95 1 160 LEU -0.20 -0.39 1 161 SER 3.59 3.15 1 162 SER -1.44 -1.02 1 164 ILE -3.07 -0.82 1 165 ASN 2.70 1.56 1 167 SER 2.17 2.24 1 168 PHE -6.95 -1.72 1 169 LEU -2.09 -0.48 1 170 VAL -1.56 -0.82 1 171 ARG -7.29 -3.59 1 172 GLU -2.40 -1.56 1 173 SER 0.20 0.14 1 174 GLU 0.72 1.51 1 175 SER 1.28 1.46 1 176 SER -1.91 -1.58 1 179 GLN -1.01 -0.85 1 180 ARG -4.02 -0.52 1 181 SER -3.98 -0.46 1 182 ILE -3.40 -0.52 1 183 SER -1.32 0.37 1 184 LEU -7.21 -1.27 1 185 ARG -3.43 -1.16 1 186 TYR -1.03 1.66 1 187 GLU 1.82 -0.35 1 189 ARG -4.80 -1.84 1 190 VAL -0.54 -0.83 1 191 TYR -3.86 -0.92 1 192 HIS -4.93 -0.55 1 193 TYR -3.89 -1.25 1 194 ARG 0.90 0.32 1 195 ILE 1.89 0.45 1 196 ASN -1.67 -0.22 1 197 THR -0.81 -0.56 1 198 ALA -3.66 -1.32 1 199 SER 4.56 3.80 1 200 ASP -0.49 -1.32 1 202 LYS 0.72 1.69 1 203 LEU -4.97 -1.50 1 204 TYR -1.96 0.18 1 205 VAL 2.25 2.13 1 206 SER -2.23 -1.40 1 207 SER 2.81 2.64 1 208 GLU 0.83 0.61 1 209 SER -1.62 -1.60 1 210 ARG -4.75 -2.70 1 211 PHE -5.04 0.18 1 212 ASN 2.25 2.86 1 213 THR -6.51 -2.79 1 214 LEU 2.67 2.34 1 215 ALA 4.45 3.17 1 216 GLU 1.23 2.63 1 217 LEU 3.90 3.82 1 218 VAL 6.00 4.33 1 219 HIS 4.22 4.93 1 220 HIS 3.80 5.27 1 221 HIS 4.21 2.93 1 222 SER 1.85 1.66 1 223 THR 1.11 1.50 1 224 VAL -3.37 -2.23 1 225 ALA 6.01 3.91 1 226 ASP 0.07 0.17 1 228 LEU -1.32 -1.19 1 229 ILE 1.26 0.93 1 230 THR -1.37 -2.55 1 231 THR -1.50 -1.49 1 233 HIS -2.46 1.45 1 234 TYR -3.06 -0.81 1 236 ALA -0.01 -0.22 1 238 LYS 0.25 0.47 1 239 ARG 0.40 1.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 5.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.55 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 -1.34 _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 232 LEU 3.56 -4.97 0 11 ASP -0.06 0.21 1 12 GLN 0.37 -0.11 1 13 ARG 0.38 -0.26 1 14 ARG -0.29 0.12 1 16 SER 0.11 0.03 1 17 LEU -0.40 0.33 1 19 ALA 0.32 -0.14 1 20 LEU 0.58 -0.34 1 21 HIS -0.40 1.62 1 22 PHE 0.13 -0.33 1 23 ILE 0.02 -0.15 1 24 LYS 0.96 -0.27 1 26 ALA -0.25 0.34 1 28 LYS -0.21 0.16 1 29 ARG 0.23 -0.11 1 30 GLU -2.50 0.17 1 31 SER 0.49 0.01 1 32 SER 0.81 -0.03 1 34 HIS -2.62 3.20 1 83 ASN 0.02 -0.08 1 84 LEU -1.46 1.48 1 85 PHE -5.90 4.57 1 86 VAL -5.89 2.64 1 87 ALA -0.86 0.42 1 88 LEU -0.55 1.45 1 89 TYR -7.68 3.84 1 90 ASP -0.21 0.67 1 91 PHE -2.37 2.46 1 92 VAL -0.65 -0.45 1 93 ALA 0.38 0.35 1 94 SER -1.41 0.46 1 96 ASP 1.98 -0.48 1 97 ASN 1.58 -0.59 1 98 THR -2.59 2.05 1 99 LEU -5.28 3.97 1 100 SER 0.45 0.03 1 101 ILE -5.36 3.89 1 102 THR -3.73 1.91 1 103 LYS 3.28 -0.50 1 105 GLU -1.00 1.70 1 106 LYS -1.10 0.52 1 107 LEU -3.79 2.85 1 108 ARG -3.44 1.94 1 109 VAL 0.19 0.08 1 110 LEU 0.45 -0.23 1 112 TYR -5.36 4.86 1 113 ASN 0.22 -0.81 1 114 HIS 3.56 1.06 1 115 ASN -0.84 -0.95 1 117 GLU 1.36 0.70 1 118 TRP -4.25 3.16 1 119 ALA -5.54 2.80 1 120 GLU 0.90 -2.35 1 121 ALA -7.80 5.27 1 122 GLN -4.15 3.37 1 123 THR -5.01 2.58 1 124 LYS 3.52 -1.13 1 125 ASN -1.07 1.35 1 127 GLN -4.63 2.71 1 129 TRP -1.27 1.10 1 130 VAL -3.40 1.12 1 132 SER 3.31 -0.47 1 133 ASN 2.54 -2.32 1 134 TYR 0.90 -0.80 1 135 ILE -5.23 3.49 1 136 THR -3.80 2.90 1 138 VAL 2.03 -0.75 1 139 ASN 0.38 -0.07 1 140 SER 0.86 -0.01 1 141 LEU 2.29 -0.92 1 142 GLU 2.20 -0.55 1 143 LYS 1.65 -1.09 1 144 HIS -0.46 1.58 1 145 SER 4.04 -1.02 1 146 TRP -5.40 1.93 1 147 TYR 1.87 -0.96 1 148 HIS -2.96 4.84 1 151 VAL -3.20 2.42 1 152 SER -1.73 1.43 1 153 ARG 5.40 -0.62 1 154 ASN 3.88 -0.51 1 155 ALA 3.49 -0.82 1 156 ALA 3.34 -0.66 1 157 GLU 5.81 -1.94 1 158 TYR 4.74 -1.10 1 159 LEU 3.12 -0.17 1 160 LEU -0.20 -0.19 1 161 SER 3.59 -0.44 1 162 SER -1.44 0.42 1 164 ILE -3.07 2.25 1 165 ASN 2.70 -1.14 1 167 SER 2.17 0.07 1 168 PHE -6.95 5.23 1 169 LEU -2.09 1.61 1 170 VAL -1.56 0.74 1 171 ARG -7.29 3.70 1 172 GLU -2.40 0.84 1 173 SER 0.20 -0.06 1 174 GLU 0.72 0.79 1 175 SER 1.28 0.18 1 176 SER -1.91 0.33 1 179 GLN -1.01 0.16 1 180 ARG -4.02 3.50 1 181 SER -3.98 3.52 1 182 ILE -3.40 2.88 1 183 SER -1.32 1.69 1 184 LEU -7.21 5.94 1 185 ARG -3.43 2.27 1 186 TYR -1.03 2.69 1 187 GLU 1.82 -2.17 1 189 ARG -4.80 2.96 1 190 VAL -0.54 -0.29 1 191 TYR -3.86 2.94 1 192 HIS -4.93 4.38 1 193 TYR -3.89 2.64 1 194 ARG 0.90 -0.58 1 195 ILE 1.89 -1.44 1 196 ASN -1.67 1.45 1 197 THR -0.81 0.25 1 198 ALA -3.66 2.34 1 199 SER 4.56 -0.76 1 200 ASP -0.49 -0.83 1 202 LYS 0.72 0.97 1 203 LEU -4.97 3.47 1 204 TYR -1.96 2.14 1 205 VAL 2.25 -0.12 1 206 SER -2.23 0.83 1 207 SER 2.81 -0.17 1 208 GLU 0.83 -0.22 1 209 SER -1.62 0.02 1 210 ARG -4.75 2.05 1 211 PHE -5.04 5.22 1 212 ASN 2.25 0.61 1 213 THR -6.51 3.72 1 214 LEU 2.67 -0.33 1 215 ALA 4.45 -1.28 1 216 GLU 1.23 1.40 1 217 LEU 3.90 -0.08 1 218 VAL 6.00 -1.67 1 219 HIS 4.22 0.71 1 220 HIS 3.80 1.47 1 221 HIS 4.21 -1.28 1 222 SER 1.85 -0.19 1 223 THR 1.11 0.39 1 224 VAL -3.37 1.14 1 225 ALA 6.01 -2.10 1 226 ASP 0.07 0.10 1 228 LEU -1.32 0.13 1 229 ILE 1.26 -0.33 1 230 THR -1.37 -1.18 1 231 THR -1.50 0.01 1 233 HIS -2.46 3.91 1 234 TYR -3.06 2.25 1 236 ALA -0.01 -0.21 1 238 LYS 0.25 0.22 1 239 ARG 0.40 0.93 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 1.01 _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 0.27 _LACS_plot.Line_2_terminator_val_x_2 6.01 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 167 SER 2.17 1.58 0 11 ASP -0.06 -0.06 1 12 GLN 0.37 -0.05 1 13 ARG 0.38 -0.05 1 14 ARG -0.29 -0.29 1 16 SER 0.11 -0.08 1 17 LEU -0.40 -0.19 1 19 ALA 0.32 -0.12 1 20 LEU 0.58 -0.27 1 21 HIS -0.40 -0.30 1 22 PHE 0.13 -0.17 1 23 ILE 0.02 -0.21 1 24 LYS 0.96 -0.11 1 26 ALA -0.25 0.01 1 28 LYS -0.21 0.05 1 29 ARG 0.23 0.02 1 30 GLU -2.50 0.31 1 31 SER 0.49 -0.02 1 32 SER 0.81 -0.07 1 34 HIS -2.62 -0.27 1 83 ASN 0.02 0.13 1 84 LEU -1.46 0.65 1 85 PHE -5.90 0.62 1 86 VAL -5.89 1.13 1 87 ALA -0.86 0.39 1 88 LEU -0.55 -0.43 1 89 TYR -7.68 0.20 1 90 ASP -0.21 0.22 1 91 PHE -2.37 0.38 1 92 VAL -0.65 -0.08 1 93 ALA 0.38 -0.54 1 94 SER -1.41 0.06 1 96 ASP 1.98 -0.19 1 97 ASN 1.58 0.04 1 98 THR -2.59 0.79 1 99 LEU -5.28 0.28 1 100 SER 0.45 0.60 1 101 ILE -5.36 0.90 1 102 THR -3.73 0.57 1 103 LYS 3.28 -1.03 1 105 GLU -1.00 -0.09 1 106 LYS -1.10 0.92 1 107 LEU -3.79 0.53 1 108 ARG -3.44 0.74 1 109 VAL 0.19 0.03 1 110 LEU 0.45 -0.13 1 112 TYR -5.36 1.16 1 113 ASN 0.22 0.17 1 114 HIS 3.56 -0.41 1 115 ASN -0.84 0.04 1 117 GLU 1.36 -0.33 1 118 TRP -4.25 0.36 1 119 ALA -5.54 0.59 1 120 GLU 0.90 -0.93 1 121 ALA -7.80 0.91 1 122 GLN -4.15 0.83 1 123 THR -5.01 0.58 1 124 LYS 3.52 -0.09 1 125 ASN -1.07 0.14 1 127 GLN -4.63 1.26 1 129 TRP -1.27 0.79 1 130 VAL -3.40 0.43 1 132 SER 3.31 -0.60 1 133 ASN 2.54 0.11 1 134 TYR 0.90 0.25 1 135 ILE -5.23 1.30 1 136 THR -3.80 0.62 1 138 VAL 2.03 -0.26 1 139 ASN 0.38 -0.06 1 140 SER 0.86 -0.19 1 141 LEU 2.29 -0.30 1 142 GLU 2.20 -0.29 1 143 LYS 1.65 -0.32 1 144 HIS -0.46 -0.08 1 145 SER 4.04 -0.26 1 146 TRP -5.40 -0.10 1 147 TYR 1.87 0.61 1 148 HIS -2.96 -0.23 1 151 VAL -3.20 0.20 1 152 SER -1.73 -0.05 1 153 ARG 5.40 -0.87 1 154 ASN 3.88 -0.42 1 155 ALA 3.49 -0.11 1 156 ALA 3.34 -0.41 1 157 GLU 5.81 -0.55 1 158 TYR 4.74 -0.25 1 159 LEU 3.12 -0.43 1 160 LEU -0.20 0.00 1 161 SER 3.59 -0.44 1 162 SER -1.44 0.11 1 164 ILE -3.07 0.33 1 165 ASN 2.70 0.04 1 168 PHE -6.95 1.38 1 169 LEU -2.09 0.23 1 170 VAL -1.56 1.10 1 171 ARG -7.29 0.94 1 172 GLU -2.40 0.38 1 173 SER 0.20 -0.15 1 174 GLU 0.72 -0.18 1 175 SER 1.28 -0.08 1 179 GLN -1.01 0.34 1 180 ARG -4.02 1.04 1 181 SER -3.98 1.05 1 182 ILE -3.40 0.78 1 183 SER -1.32 1.18 1 184 LEU -7.21 1.08 1 185 ARG -3.43 0.96 1 186 TYR -1.03 0.15 1 187 GLU 1.82 -0.70 1 189 ARG -4.80 0.29 1 190 VAL -0.54 0.60 1 191 TYR -3.86 -0.31 1 192 HIS -4.93 0.92 1 193 TYR -3.89 0.20 1 194 ARG 0.90 0.17 1 195 ILE 1.89 -0.26 1 196 ASN -1.67 -0.10 1 197 THR -0.81 0.69 1 198 ALA -3.66 0.47 1 199 SER 4.56 -0.29 1 200 ASP -0.49 -0.03 1 202 LYS 0.72 0.06 1 203 LEU -4.97 1.23 1 204 TYR -1.96 0.59 1 205 VAL 2.25 0.19 1 206 SER -2.23 0.40 1 207 SER 2.81 -0.97 1 208 GLU 0.83 -0.21 1 209 SER -1.62 -0.14 1 210 ARG -4.75 0.74 1 211 PHE -5.04 0.23 1 212 ASN 2.25 -0.06 1 213 THR -6.51 0.58 1 214 LEU 2.67 -0.34 1 215 ALA 4.45 -0.36 1 216 GLU 1.23 -0.45 1 217 LEU 3.90 -1.38 1 218 VAL 6.00 -1.24 1 219 HIS 4.22 -0.62 1 220 HIS 3.80 -0.70 1 221 HIS 4.21 0.27 1 222 SER 1.85 0.22 1 223 THR 1.11 -0.13 1 224 VAL -3.37 -0.09 1 225 ALA 6.01 -0.79 1 226 ASP 0.07 -0.44 1 228 LEU -1.32 -0.49 1 229 ILE 1.26 -0.52 1 230 THR -1.37 -0.37 1 231 THR -1.50 -0.35 1 232 LEU 3.56 -0.82 1 233 HIS -2.46 0.04 1 234 TYR -3.06 0.41 1 236 ALA -0.01 -0.06 1 238 LYS 0.25 -0.24 1 239 ARG 0.40 -0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30332_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.32 _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 6.01 _LACS_plot.Line_2_terminator_val_y_2 1.48 _LACS_plot.Y_axis_chem_shift_offset 0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 219 HIS 4.22 5.00 0 239 ARG 0.40 4.53 0 11 ASP -0.06 0.18 1 12 GLN 0.37 -0.04 1 13 ARG 0.38 -0.35 1 14 ARG -0.29 -0.57 1 16 SER 0.11 -0.58 1 17 LEU -0.40 -0.56 1 19 ALA 0.32 0.50 1 21 HIS -0.40 0.68 1 22 PHE 0.13 -0.49 1 23 ILE 0.02 -0.61 1 24 LYS 0.96 0.41 1 26 ALA -0.25 0.40 1 28 LYS -0.21 -0.18 1 29 ARG 0.23 -0.26 1 30 GLU -2.50 -0.07 1 31 SER 0.49 0.30 1 32 SER 0.81 0.02 1 34 HIS -2.62 2.46 1 83 ASN 0.02 -1.21 1 84 LEU -1.46 -1.58 1 85 PHE -5.90 -1.90 1 86 VAL -5.89 -1.68 1 87 ALA -0.86 1.07 1 88 LEU -0.55 -2.58 1 89 TYR -7.68 -2.48 1 90 ASP -0.21 -0.05 1 91 PHE -2.37 -2.44 1 92 VAL -0.65 -2.18 1 93 ALA 0.38 -0.52 1 94 SER -1.41 -0.11 1 96 ASP 1.98 -0.13 1 97 ASN 1.58 -0.01 1 98 THR -2.59 -0.71 1 99 LEU -5.28 -3.42 1 100 SER 0.45 -0.14 1 101 ILE -5.36 -1.20 1 102 THR -3.73 -1.56 1 103 LYS 3.28 0.68 1 105 GLU -1.00 -1.37 1 106 LYS -1.10 -0.01 1 107 LEU -3.79 -3.26 1 108 ARG -3.44 -0.69 1 109 VAL 0.19 -0.06 1 110 LEU 0.45 -0.56 1 112 TYR -5.36 0.57 1 113 ASN 0.22 1.51 1 114 HIS 3.56 1.70 1 115 ASN -0.84 1.04 1 117 GLU 1.36 -0.10 1 118 TRP -4.25 -3.06 1 119 ALA -5.54 -2.94 1 120 GLU 0.90 -2.75 1 121 ALA -7.80 -2.54 1 122 GLN -4.15 0.04 1 123 THR -5.01 0.78 1 124 LYS 3.52 0.43 1 125 ASN -1.07 -0.48 1 127 GLN -4.63 -1.13 1 129 TRP -1.27 0.46 1 130 VAL -3.40 -2.75 1 132 SER 3.31 0.52 1 133 ASN 2.54 0.26 1 134 TYR 0.90 -1.22 1 135 ILE -5.23 -2.90 1 136 THR -3.80 -2.36 1 138 VAL 2.03 -0.37 1 140 SER 0.86 0.85 1 141 LEU 2.29 -0.30 1 142 GLU 2.20 -0.31 1 143 LYS 1.65 0.16 1 144 HIS -0.46 3.46 1 145 SER 4.04 -0.44 1 146 TRP -5.40 -0.44 1 147 TYR 1.87 -1.09 1 148 HIS -2.96 1.03 1 151 VAL -3.20 -1.30 1 152 SER -1.73 -0.31 1 153 ARG 5.40 1.87 1 154 ASN 3.88 2.92 1 155 ALA 3.49 2.57 1 156 ALA 3.34 1.26 1 157 GLU 5.81 2.39 1 158 TYR 4.74 4.19 1 159 LEU 3.12 1.35 1 160 LEU -0.20 -0.16 1 161 SER 3.59 -0.50 1 162 SER -1.44 -0.62 1 164 ILE -3.07 -0.20 1 165 ASN 2.70 2.08 1 167 SER 2.17 -0.46 1 168 PHE -6.95 -4.20 1 169 LEU -2.09 -3.31 1 170 VAL -1.56 -2.99 1 171 ARG -7.29 -1.96 1 172 GLU -2.40 -0.83 1 173 SER 0.20 1.27 1 174 GLU 0.72 0.88 1 175 SER 1.28 0.56 1 176 SER -1.91 -2.63 1 179 GLN -1.01 -0.88 1 180 ARG -4.02 -0.91 1 181 SER -3.98 -1.89 1 182 ILE -3.40 -0.58 1 183 SER -1.32 -2.40 1 184 LEU -7.21 -3.85 1 185 ARG -3.43 -1.50 1 186 TYR -1.03 -1.64 1 187 GLU 1.82 -0.10 1 189 ARG -4.80 -2.73 1 190 VAL -0.54 -2.21 1 191 TYR -3.86 -2.06 1 192 HIS -4.93 1.44 1 193 TYR -3.89 -0.77 1 194 ARG 0.90 -0.65 1 195 ILE 1.89 -0.77 1 196 ASN -1.67 -2.10 1 197 THR -0.81 0.45 1 198 ALA -3.66 1.85 1 199 SER 4.56 0.11 1 200 ASP -0.49 0.88 1 202 LYS 0.72 -1.78 1 203 LEU -4.97 0.55 1 204 TYR -1.96 -2.52 1 205 VAL 2.25 0.16 1 206 SER -2.23 0.81 1 207 SER 2.81 0.20 1 208 GLU 0.83 0.06 1 209 SER -1.62 -3.87 1 210 ARG -4.75 -0.40 1 211 PHE -5.04 -0.50 1 212 ASN 2.25 0.97 1 213 THR -6.51 -0.13 1 214 LEU 2.67 0.64 1 215 ALA 4.45 2.60 1 216 GLU 1.23 1.69 1 217 LEU 3.90 0.52 1 218 VAL 6.00 1.40 1 220 HIS 3.80 3.49 1 221 HIS 4.21 0.87 1 222 SER 1.85 -0.43 1 223 THR 1.11 -0.62 1 224 VAL -3.37 -3.29 1 225 ALA 6.01 2.62 1 226 ASP 0.07 -2.16 1 228 LEU -1.32 0.34 1 229 ILE 1.26 -3.05 1 230 THR -1.37 -3.59 1 231 THR -1.50 0.41 1 232 LEU 3.56 -2.09 1 233 HIS -2.46 0.81 1 236 ALA -0.01 -0.46 1 238 LYS 0.25 -0.44 1 stop_ save_