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 bmr5355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 -2.69 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.95 _LACS_plot.Line_2_terminator_val_x_2 7.16 _LACS_plot.Line_2_terminator_val_y_2 4.67 _LACS_plot.Y_axis_chem_shift_offset 0.50 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 156 GLN -5.99 0.57 0 10 HIS 0.14 1.30 1 12 MET 0.32 -0.31 1 13 ALA 0.49 -0.18 1 14 SER -1.18 -0.52 1 15 GLU -4.83 -1.18 1 16 THR -0.17 -0.40 1 18 GLU -1.98 -1.42 1 19 PHE 0.82 1.65 1 22 GLU 4.38 3.45 1 23 ILE 3.93 2.66 1 24 THR 6.90 4.58 1 25 GLN 4.84 2.83 1 26 LEU 5.35 2.92 1 27 MET 5.70 5.07 1 28 SER 4.33 2.97 1 29 LEU 3.87 2.63 1 30 ILE 5.08 2.91 1 31 ILE 4.49 3.14 1 32 ASN -0.63 0.64 1 37 ASN 0.17 -1.35 1 38 LYS 4.57 3.10 1 39 GLU 3.21 1.40 1 40 ILE 2.68 1.31 1 41 PHE 4.10 1.53 1 42 LEU 3.98 1.47 1 43 ARG 4.70 2.38 1 44 GLU 3.09 1.00 1 45 LEU 5.36 2.22 1 46 ILE 7.11 4.06 1 47 SER 5.06 3.49 1 48 ASN 3.86 2.57 1 49 ALA 3.48 2.06 1 50 SER 4.18 3.18 1 51 ASP 4.03 3.08 1 52 ALA 3.51 2.48 1 53 LEU 4.79 2.43 1 54 ASP 4.82 2.92 1 55 LYS 4.48 3.78 1 56 ILE -0.27 -1.45 1 57 ARG 5.51 3.83 1 58 TYR 4.66 2.99 1 59 LYS 3.60 2.83 1 60 SER 2.45 1.72 1 61 LEU 4.17 2.03 1 62 SER 0.14 -0.06 1 65 LYS 4.61 2.08 1 66 GLN 3.70 1.16 1 67 LEU 0.18 -0.37 1 68 GLU 3.35 2.42 1 69 THR 1.65 0.30 1 70 GLU 1.10 0.82 1 72 ASP -1.44 -0.70 1 73 LEU 0.95 -1.61 1 74 PHE -3.34 -1.57 1 75 ILE -1.74 -1.13 1 76 ARG -4.60 -1.68 1 77 ILE -0.70 -0.97 1 78 THR -1.67 -0.70 1 80 LYS 0.25 -1.18 1 82 GLU 4.43 2.24 1 83 GLN -0.97 -0.59 1 84 LYS 6.13 1.86 1 85 VAL -6.97 -3.67 1 86 LEU -5.57 -2.21 1 87 GLU -3.89 -2.60 1 88 ILE -1.17 -0.47 1 89 ARG -5.10 -3.44 1 90 ASP -7.15 -1.84 1 91 SER -1.74 -3.80 1 93 ILE 0.80 1.46 1 95 MET -4.52 -1.15 1 96 THR -1.60 -1.54 1 97 LYS 7.17 4.67 1 98 ALA 3.51 1.98 1 99 GLU 2.81 2.14 1 100 LEU 3.75 2.83 1 101 ILE 4.29 4.01 1 102 ASN 2.20 2.45 1 103 ASN 3.21 -0.69 1 104 LEU 4.71 3.20 1 113 LYS 3.50 1.99 1 114 ALA 3.15 1.20 1 115 PHE 5.24 3.99 1 116 MET 3.81 2.29 1 117 GLU 4.59 2.22 1 118 ALA 4.15 2.23 1 119 LEU 3.90 2.68 1 120 SER -0.26 -1.09 1 121 ALA -0.11 -0.55 1 123 ALA -3.63 -1.07 1 124 ASP 3.47 2.35 1 125 VAL 3.71 2.37 1 126 SER 1.53 0.72 1 127 MET 6.10 3.84 1 128 ILE 3.48 1.25 1 130 GLN 0.00 0.01 1 131 PHE -0.14 -2.81 1 133 VAL 3.06 3.28 1 135 PHE 4.70 2.88 1 136 TYR 4.64 3.32 1 137 SER 5.48 2.71 1 138 LEU 5.47 2.72 1 139 PHE 2.01 2.08 1 140 LEU -1.87 -2.19 1 141 VAL -4.31 -1.88 1 142 ALA -1.03 -0.31 1 143 ASP -3.01 -1.30 1 144 ARG -5.45 -3.91 1 145 VAL -3.21 -2.02 1 146 GLN -0.07 -0.94 1 147 VAL -1.68 -1.45 1 148 ILE -4.32 -1.45 1 149 SER -5.72 -2.67 1 150 LYS -2.84 -3.49 1 151 SER 4.12 1.93 1 152 ASN -0.37 0.09 1 153 ASP -3.16 -2.48 1 155 GLU 0.41 0.49 1 157 TYR -3.74 -1.14 1 158 ILE -6.56 -1.85 1 159 TRP -4.44 -1.60 1 160 GLU -4.25 -0.73 1 161 SER -0.29 -0.93 1 162 ASN 3.58 0.78 1 163 ALA -4.37 -1.65 1 166 SER -3.88 -2.77 1 167 PHE -4.93 -2.81 1 168 THR -2.45 -0.79 1 169 VAL -2.42 -0.51 1 170 THR 2.87 1.50 1 171 LEU -1.01 0.00 1 172 ASP -1.91 -1.61 1 173 GLU -1.31 0.12 1 174 VAL 0.84 0.82 1 175 ASN 0.83 -0.21 1 176 GLU -0.46 -1.38 1 177 ARG -1.13 -0.93 1 178 ILE 1.13 0.67 1 180 ARG -2.64 -0.34 1 182 THR -2.30 -0.02 1 183 ILE -1.19 -1.58 1 184 LEU -0.75 -0.99 1 185 ARG -0.17 -0.76 1 186 LEU 2.81 -0.69 1 187 PHE 0.67 0.19 1 188 LEU -1.03 -0.12 1 189 LYS 3.66 2.84 1 190 ASP 0.81 -1.15 1 191 ASP 0.17 -2.00 1 192 GLN 5.21 0.99 1 193 LEU 3.36 1.31 1 194 GLU 4.41 2.07 1 195 TYR -0.39 -1.42 1 196 LEU -0.88 -1.58 1 197 GLU 4.87 3.83 1 198 GLU 5.05 3.34 1 199 LYS 2.70 0.86 1 200 ARG 5.75 4.22 1 201 ILE 5.38 4.01 1 202 LYS 3.21 2.23 1 203 GLU 6.20 4.19 1 204 VAL 5.38 3.60 1 205 ILE 4.00 2.08 1 206 LYS 2.87 2.05 1 207 ARG -2.11 2.10 1 208 HIS -0.03 -0.39 1 209 SER 2.68 1.68 1 210 GLU 0.97 -1.08 1 211 PHE 1.64 0.42 1 212 VAL 1.03 0.16 1 213 ALA -1.78 -0.37 1 214 TYR 0.24 -1.11 1 216 ILE 0.09 -0.65 1 217 GLN 0.15 1.49 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 4.46 _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 0.05 _LACS_plot.Line_2_terminator_val_x_2 7.16 _LACS_plot.Line_2_terminator_val_y_2 -2.49 _LACS_plot.Y_axis_chem_shift_offset 0.50 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 156 GLN -5.99 6.56 0 10 HIS 0.14 1.16 1 12 MET 0.32 -0.63 1 13 ALA 0.49 -0.67 1 14 SER -1.18 0.66 1 15 GLU -4.83 3.65 1 16 THR -0.17 -0.23 1 18 GLU -1.98 0.56 1 19 PHE 0.82 0.83 1 22 GLU 4.38 -0.93 1 23 ILE 3.93 -1.27 1 24 THR 6.90 -2.32 1 25 GLN 4.84 -2.01 1 26 LEU 5.35 -2.43 1 27 MET 5.70 -0.63 1 28 SER 4.33 -1.36 1 29 LEU 3.87 -1.24 1 30 ILE 5.08 -2.17 1 31 ILE 4.49 -1.35 1 32 ASN -0.63 1.27 1 37 ASN 0.17 -1.52 1 38 LYS 4.57 -1.47 1 39 GLU 3.21 -1.81 1 40 ILE 2.68 -1.37 1 41 PHE 4.10 -2.57 1 42 LEU 3.98 -2.51 1 43 ARG 4.70 -2.32 1 44 GLU 3.09 -2.09 1 45 LEU 5.36 -3.14 1 46 ILE 7.11 -3.05 1 47 SER 5.06 -1.57 1 48 ASN 3.86 -1.29 1 49 ALA 3.48 -1.42 1 50 SER 4.18 -1.00 1 51 ASP 4.03 -0.95 1 52 ALA 3.51 -1.03 1 53 LEU 4.79 -2.36 1 54 ASP 4.82 -1.90 1 55 LYS 4.48 -0.70 1 56 ILE -0.27 -1.18 1 57 ARG 5.51 -1.68 1 58 TYR 4.66 -1.67 1 59 LYS 3.60 -0.77 1 60 SER 2.45 -0.73 1 61 LEU 4.17 -2.14 1 62 SER 0.14 -0.20 1 65 LYS 4.61 -2.53 1 66 GLN 3.70 -2.54 1 67 LEU 0.18 -0.55 1 68 GLU 3.35 -0.93 1 69 THR 1.65 -1.35 1 70 GLU 1.10 -0.28 1 72 ASP -1.44 0.74 1 73 LEU 0.95 -2.56 1 74 PHE -3.34 1.77 1 75 ILE -1.74 0.61 1 76 ARG -4.60 2.92 1 77 ILE -0.70 -0.27 1 78 THR -1.67 0.97 1 80 LYS 0.25 -1.43 1 82 GLU 4.43 -2.19 1 83 GLN -0.97 0.38 1 84 LYS 6.13 -4.27 1 85 VAL -6.97 3.30 1 86 LEU -5.57 3.36 1 87 GLU -3.89 1.29 1 88 ILE -1.17 0.70 1 89 ARG -5.10 1.66 1 90 ASP -7.15 5.31 1 91 SER -1.74 -2.06 1 93 ILE 0.80 0.66 1 95 MET -4.52 3.37 1 96 THR -1.60 0.06 1 97 LYS 7.17 -2.50 1 98 ALA 3.51 -1.53 1 99 GLU 2.81 -0.67 1 100 LEU 3.75 -0.92 1 101 ILE 4.29 -0.28 1 102 ASN 2.20 0.25 1 103 ASN 3.21 -3.90 1 104 LEU 4.71 -1.51 1 113 LYS 3.50 -1.51 1 114 ALA 3.15 -1.95 1 115 PHE 5.24 -1.25 1 116 MET 3.81 -1.52 1 117 GLU 4.59 -2.37 1 118 ALA 4.15 -1.92 1 119 LEU 3.90 -1.22 1 120 SER -0.26 -0.83 1 121 ALA -0.11 -0.44 1 123 ALA -3.63 2.56 1 124 ASP 3.47 -1.12 1 125 VAL 3.71 -1.34 1 126 SER 1.53 -0.81 1 127 MET 6.10 -2.26 1 128 ILE 3.48 -2.23 1 130 GLN 0.00 0.01 1 131 PHE -0.14 -2.67 1 133 VAL 3.06 0.22 1 135 PHE 4.70 -1.82 1 136 TYR 4.64 -1.32 1 137 SER 5.48 -2.77 1 138 LEU 5.47 -2.75 1 139 PHE 2.01 0.07 1 140 LEU -1.87 -0.32 1 141 VAL -4.31 2.43 1 142 ALA -1.03 0.72 1 143 ASP -3.01 1.71 1 144 ARG -5.45 1.54 1 145 VAL -3.21 1.19 1 146 GLN -0.07 -0.87 1 147 VAL -1.68 0.23 1 148 ILE -4.32 2.87 1 149 SER -5.72 3.05 1 150 LYS -2.84 -0.65 1 151 SER 4.12 -2.19 1 152 ASN -0.37 0.46 1 153 ASP -3.16 0.68 1 155 GLU 0.41 0.08 1 157 TYR -3.74 2.60 1 158 ILE -6.56 4.71 1 159 TRP -4.44 2.84 1 160 GLU -4.25 3.52 1 161 SER -0.29 -0.64 1 162 ASN 3.58 -2.80 1 163 ALA -4.37 2.72 1 166 SER -3.88 1.11 1 167 PHE -4.93 2.12 1 168 THR -2.45 1.66 1 169 VAL -2.42 1.91 1 170 THR 2.87 -1.37 1 171 LEU -1.01 1.01 1 172 ASP -1.91 0.30 1 173 GLU -1.31 1.43 1 174 VAL 0.84 -0.02 1 175 ASN 0.83 -1.04 1 176 GLU -0.46 -0.92 1 177 ARG -1.13 0.20 1 178 ILE 1.13 -0.46 1 180 ARG -2.64 2.30 1 182 THR -2.30 2.28 1 183 ILE -1.19 -0.39 1 184 LEU -0.75 -0.24 1 185 ARG -0.17 -0.59 1 186 LEU 2.81 -3.50 1 187 PHE 0.67 -0.48 1 188 LEU -1.03 0.91 1 189 LYS 3.66 -0.82 1 190 ASP 0.81 -1.96 1 191 ASP 0.17 -2.17 1 192 GLN 5.21 -4.22 1 193 LEU 3.36 -2.05 1 194 GLU 4.41 -2.34 1 195 TYR -0.39 -1.03 1 196 LEU -0.88 -0.70 1 197 GLU 4.87 -1.04 1 198 GLU 5.05 -1.71 1 199 LYS 2.70 -1.84 1 200 ARG 5.75 -1.53 1 201 ILE 5.38 -1.37 1 202 LYS 3.21 -0.98 1 203 GLU 6.20 -2.01 1 204 VAL 5.38 -1.78 1 205 ILE 4.00 -1.92 1 206 LYS 2.87 -0.82 1 207 ARG -2.11 4.21 1 208 HIS -0.03 -0.36 1 209 SER 2.68 -1.00 1 210 GLU 0.97 -2.05 1 211 PHE 1.64 -1.22 1 212 VAL 1.03 -0.87 1 213 ALA -1.78 1.41 1 214 TYR 0.24 -1.35 1 216 ILE 0.09 -0.74 1 217 GLN 0.15 1.34 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 1.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.42 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.72 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 169 VAL -2.45 1.42 0 139 PHE 5.47 0.34 0 42 LEU 3.98 -1.28 0 12 MET 0.32 0.02 1 13 ALA 0.49 0.09 1 14 SER -1.18 0.44 1 15 GLU -4.83 0.10 1 18 GLU -1.98 0.26 1 25 GLN 4.84 -0.39 1 28 SER 4.33 -0.41 1 29 LEU 3.87 -0.25 1 30 ILE 5.08 -0.58 1 31 ILE 4.49 -0.24 1 39 GLU 3.21 -0.28 1 40 ILE 2.68 -0.63 1 43 ARG 4.70 -0.74 1 44 GLU 3.09 -0.37 1 45 LEU 5.36 -0.26 1 46 ILE 7.11 -0.54 1 47 SER 5.06 -0.25 1 48 ASN 3.86 -0.40 1 49 ALA 3.48 -0.22 1 51 ASP 4.03 -0.28 1 52 ALA 3.51 -0.21 1 53 LEU 4.79 -0.51 1 55 LYS 4.48 -0.20 1 56 ILE -0.27 0.32 1 57 ARG 5.51 -0.47 1 58 TYR 4.66 -0.24 1 59 LYS 3.60 -0.29 1 60 SER 2.45 -0.16 1 61 LEU 4.17 -0.22 1 62 SER 0.14 0.12 1 65 LYS 4.61 -0.25 1 66 GLN 3.70 -0.59 1 67 LEU 0.18 -0.12 1 68 GLU 3.35 -0.50 1 69 THR 1.65 -0.44 1 70 GLU 1.10 -0.06 1 72 ASP -1.44 0.25 1 73 LEU 0.95 -0.12 1 74 PHE -3.34 0.33 1 75 ILE -1.74 0.75 1 76 ARG -4.60 1.22 1 77 ILE -0.70 0.88 1 78 THR -1.67 0.25 1 80 LYS 0.25 0.37 1 82 GLU 4.43 -0.18 1 83 GLN -0.97 0.12 1 84 LYS 6.13 -0.81 1 85 VAL -6.97 0.96 1 86 LEU -5.57 0.32 1 87 GLU -3.89 1.37 1 88 ILE -1.17 0.52 1 89 ARG -5.10 1.47 1 90 ASP -7.15 0.95 1 95 MET -4.52 0.41 1 99 GLU 2.81 -0.56 1 102 ASN 2.20 -0.20 1 104 LEU 3.21 -0.18 1 114 ALA 3.50 -0.17 1 117 GLU 3.81 -0.45 1 118 ALA 4.59 -0.20 1 120 SER 3.90 -0.26 1 121 ALA -0.26 0.19 1 123 ALA -0.11 0.03 1 124 ASP -3.63 0.14 1 127 MET 1.53 0.06 1 130 GLN 3.48 -0.28 1 131 PHE 0.00 -0.10 1 133 VAL -0.14 0.83 1 137 SER 4.64 0.07 1 140 LEU 2.01 -0.06 1 141 VAL -1.87 0.42 1 142 ALA -4.31 0.72 1 143 ASP -1.03 0.27 1 144 ARG -3.01 0.72 1 145 VAL -5.45 1.60 1 146 GLN -3.21 1.31 1 147 VAL -0.07 0.77 1 148 ILE -1.68 1.01 1 149 SER -4.32 1.07 1 150 LYS -5.72 0.50 1 151 SER -2.84 0.48 1 152 ASN 4.12 -0.36 1 155 GLU -3.16 0.10 1 156 GLN 0.41 0.79 1 157 TYR -5.99 0.48 1 158 ILE -3.74 0.98 1 159 TRP -6.56 1.26 1 160 GLU -4.44 1.31 1 161 SER -4.25 0.33 1 162 ASN -0.29 0.59 1 163 ALA 3.58 -0.40 1 166 SER -4.37 0.92 1 167 PHE -3.88 0.58 1 168 THR -4.93 1.26 1 170 THR -2.42 0.69 1 172 ASP -1.01 -0.22 1 173 GLU -1.91 0.35 1 174 VAL -1.31 0.35 1 175 ASN 0.84 0.07 1 176 GLU 0.83 -0.23 1 177 ARG -0.46 0.07 1 178 ILE -1.13 0.00 1 182 THR -2.64 0.99 1 183 ILE -2.30 0.33 1 184 LEU -1.19 0.56 1 185 ARG -0.75 0.14 1 186 LEU -0.17 0.10 1 187 PHE 2.81 -0.04 1 188 LEU 0.67 0.00 1 189 LYS -1.03 -0.05 1 190 ASP 3.66 -0.33 1 191 ASP 0.81 0.20 1 192 GLN 0.17 0.62 1 193 LEU 5.21 -0.30 1 195 TYR 4.41 -0.36 1 196 LEU -0.39 0.03 1 197 GLU -0.88 -0.03 1 199 LYS 5.05 -0.39 1 200 ARG 2.70 -0.12 1 201 ILE 5.75 -0.71 1 202 LYS 5.38 -0.53 1 203 GLU 3.21 -0.33 1 205 ILE 5.38 -0.57 1 207 ARG 2.87 -0.36 1 208 HIS -2.11 0.16 1 210 GLU 2.68 -0.52 1 211 PHE 0.97 0.04 1 212 VAL 1.64 -0.15 1 213 ALA 1.03 -0.23 1 216 ILE 0.24 0.50 1 217 GLN 0.09 0.08 1 218 LEU 0.15 0.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.15 _LACS_plot.Line_1_terminator_val_y_1 -2.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.46 _LACS_plot.Line_2_terminator_val_x_2 7.16 _LACS_plot.Line_2_terminator_val_y_2 3.16 _LACS_plot.Y_axis_chem_shift_offset -0.36 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 LYS 6.13 -2.28 0 10 HIS 0.14 2.51 1 12 MET 0.32 0.48 1 13 ALA 0.49 0.21 1 14 SER -1.18 -0.24 1 15 GLU -4.83 -1.63 1 16 THR -0.17 -1.48 1 18 GLU -1.98 2.09 1 19 PHE 0.82 1.44 1 22 GLU 4.38 2.59 1 23 ILE 3.93 2.07 1 24 THR 6.90 3.18 1 25 GLN 4.84 3.09 1 26 LEU 5.35 1.32 1 28 SER 4.33 2.54 1 29 LEU 3.87 3.41 1 30 ILE 5.08 1.93 1 31 ILE 4.49 1.35 1 32 ASN -0.63 0.99 1 37 ASN 0.17 0.40 1 38 LYS 4.57 0.69 1 39 GLU 3.21 -0.12 1 40 ILE 2.68 0.99 1 41 PHE 4.10 0.80 1 42 LEU 3.98 1.20 1 43 ARG 4.70 3.48 1 44 GLU 3.09 3.45 1 45 LEU 5.36 4.01 1 46 ILE 7.11 1.89 1 47 SER 5.06 2.98 1 48 ASN 3.86 3.36 1 49 ALA 3.48 1.35 1 50 SER 4.18 2.65 1 51 ASP 4.03 2.59 1 52 ALA 3.51 4.72 1 53 LEU 4.79 1.14 1 54 ASP 4.82 3.58 1 55 LYS 4.48 4.51 1 56 ILE -0.27 0.51 1 57 ARG 5.51 4.02 1 58 TYR 4.66 4.23 1 59 LYS 3.60 2.99 1 60 SER 2.45 0.97 1 61 LEU 4.17 1.94 1 62 SER 0.14 0.41 1 65 LYS 4.61 3.53 1 66 GLN 3.70 1.68 1 67 LEU 0.18 2.16 1 68 GLU 3.35 1.02 1 69 THR 1.65 1.66 1 70 GLU 1.10 -1.86 1 72 ASP -1.44 -0.20 1 73 LEU 0.95 -2.38 1 74 PHE -3.34 -3.55 1 75 ILE -1.74 -1.36 1 76 ARG -4.60 -0.58 1 77 ILE -0.70 -1.22 1 78 THR -1.67 0.12 1 80 LYS 0.25 1.46 1 82 GLU 4.43 1.51 1 83 GLN -0.97 -0.97 1 85 VAL -6.97 -2.40 1 86 LEU -5.57 -2.35 1 87 GLU -3.89 0.19 1 88 ILE -1.17 -1.39 1 89 ARG -5.10 -1.95 1 90 ASP -7.15 1.06 1 91 SER -1.74 0.01 1 93 ILE 0.80 -1.61 1 95 MET -4.52 -0.13 1 96 THR -1.60 -0.23 1 97 LYS 7.17 1.84 1 98 ALA 3.51 3.42 1 99 GLU 2.81 2.70 1 100 LEU 3.75 1.12 1 101 ILE 4.29 3.01 1 103 ASN 3.21 1.16 1 104 LEU 4.71 2.58 1 113 LYS 3.50 3.26 1 114 ALA 5.24 3.75 1 116 MET 3.81 3.36 1 117 GLU 4.59 3.89 1 118 ALA 4.15 4.21 1 119 LEU 3.90 0.60 1 120 SER -0.26 0.33 1 121 ALA -0.11 -1.96 1 123 ALA -3.63 1.61 1 124 ASP 3.47 -0.12 1 125 VAL 3.71 1.91 1 126 SER 1.53 0.84 1 127 MET 6.10 -0.31 1 128 ILE 3.48 1.34 1 130 GLN 0.00 0.85 1 131 PHE -0.14 -0.03 1 133 VAL 3.06 -0.41 1 135 PHE 4.70 1.33 1 136 TYR 4.64 1.82 1 137 SER 5.48 0.40 1 138 LEU 5.47 0.33 1 139 PHE 2.01 1.89 1 140 LEU -1.87 -2.88 1 141 VAL -4.31 -1.98 1 142 ALA -1.03 -0.14 1 143 ASP -3.01 -2.80 1 144 ARG -5.45 -2.20 1 145 VAL -3.21 -0.86 1 146 GLN -0.07 -1.38 1 147 VAL -1.68 -0.07 1 148 ILE -4.32 -2.31 1 149 SER -5.72 -2.18 1 150 LYS -2.84 2.74 1 151 SER 4.12 2.29 1 152 ASN -0.37 -0.99 1 153 ASP -3.16 -1.92 1 155 GLU 0.41 0.28 1 156 GLN -5.99 -1.47 1 157 TYR -3.74 0.16 1 158 ILE -6.56 0.03 1 159 TRP -4.44 -1.76 1 160 GLU -4.25 -0.60 1 161 SER -0.29 0.39 1 162 ASN 3.58 -0.59 1 163 ALA -4.37 -1.76 1 166 SER -3.88 -2.35 1 167 PHE -4.93 0.69 1 168 THR -2.45 0.49 1 169 VAL -2.42 -0.64 1 170 THR 2.87 -0.42 1 171 LEU -1.01 1.45 1 172 ASP -1.91 0.25 1 173 GLU -1.31 0.47 1 174 VAL 0.84 1.46 1 175 ASN 0.83 -0.36 1 176 GLU -0.46 2.00 1 177 ARG -1.13 0.48 1 178 ILE 1.13 -1.55 1 180 ARG -2.64 -0.94 1 182 THR -2.30 -1.15 1 183 ILE -1.19 -1.95 1 184 LEU -0.75 -2.64 1 185 ARG -0.17 -2.10 1 186 LEU 2.81 -0.09 1 187 PHE 0.67 0.69 1 188 LEU -1.03 2.30 1 189 LYS 3.66 1.35 1 190 ASP 0.81 1.56 1 191 ASP 0.17 0.24 1 192 GLN 5.21 2.83 1 193 LEU 3.36 0.65 1 194 GLU -0.39 -0.08 1 196 LEU -0.88 0.99 1 197 GLU 4.87 1.74 1 198 GLU 5.05 2.77 1 199 LYS 2.70 2.32 1 200 ARG 5.75 2.47 1 201 ILE 5.38 3.20 1 202 LYS 3.21 2.96 1 203 GLU 6.20 3.17 1 204 VAL 5.38 2.43 1 205 ILE 4.00 1.87 1 206 LYS 2.87 2.57 1 207 ARG -2.11 3.68 1 208 HIS -0.03 1.19 1 209 SER 2.68 0.83 1 210 GLU 0.97 0.46 1 211 PHE 1.64 0.50 1 212 VAL 1.03 -1.09 1 213 ALA -1.78 -2.29 1 214 TYR 0.24 0.69 1 216 ILE 0.09 -1.79 1 217 GLN 0.15 4.77 1 stop_ save_