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 bmr19589_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.79 _LACS_plot.Line_1_terminator_val_y_1 -4.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.95 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 7.08 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 MET -6.79 0.07 0 10 ASN -0.11 1.83 1 15 VAL 0.53 -0.01 1 16 GLN -0.25 0.05 1 17 LYS -0.30 -0.12 1 18 ASN -0.12 0.18 1 19 PHE -0.83 0.03 1 20 LYS -0.81 0.11 1 21 THR 3.01 3.63 1 22 PHE 0.01 0.66 1 24 VAL -2.13 -1.46 1 26 LEU 3.38 3.53 1 27 GLU 6.18 4.19 1 28 SER 2.61 2.27 1 29 LEU -0.56 0.62 1 30 ILE 1.67 -0.51 1 31 GLU 3.21 2.27 1 32 PHE -0.21 0.14 1 33 GLU 2.58 3.28 1 34 GLN 2.77 1.82 1 35 ASP -1.96 -1.07 1 37 VAL -6.54 -3.87 1 39 ALA 4.41 3.36 1 40 ILE 4.01 2.21 1 41 VAL 4.89 3.62 1 42 ARG 4.08 3.63 1 43 GLN 4.11 3.07 1 45 ILE 6.90 5.69 1 46 TYR 3.98 3.46 1 47 VAL 5.63 4.21 1 48 ILE 6.75 4.12 1 49 ASP 3.57 2.99 1 50 LYS 2.47 2.04 1 51 PHE -2.41 0.12 1 53 LEU 4.92 2.95 1 54 ASP -0.94 -0.74 1 55 GLN 0.62 -0.35 1 56 GLU 2.03 1.74 1 65 VAL 4.58 3.44 1 66 LEU 4.04 3.03 1 67 ASP 3.77 3.60 1 68 VAL 5.83 4.74 1 69 SER 4.60 3.75 1 70 LYS 3.79 3.06 1 71 LEU 2.56 2.45 1 72 LYS 3.91 3.57 1 73 GLU 3.44 2.75 1 74 GLU 2.96 2.71 1 75 ILE 5.07 4.33 1 76 ASP 2.87 3.11 1 77 LYS 2.21 2.49 1 78 ASP -2.13 -0.29 1 80 ALA 2.45 1.67 1 81 ASN 2.43 1.03 1 82 ILE 4.92 4.35 1 83 SER 3.64 2.69 1 84 MET 1.19 1.46 1 85 ILE 1.50 1.78 1 86 LEU -0.86 -0.35 1 88 SER -0.97 -0.30 1 89 LYS -1.15 -0.45 1 91 HIS -0.14 1.66 1 92 SER -3.10 -1.47 1 93 ASP 4.30 2.71 1 94 SER 3.82 3.06 1 95 ASP 2.75 3.11 1 96 ILE 4.00 1.43 1 97 TYR 5.02 3.02 1 98 LEU 4.56 3.66 1 99 VAL 6.97 5.50 1 101 SER 4.44 4.29 1 102 LEU 3.85 3.03 1 103 LEU 3.28 3.45 1 104 LYS 5.97 4.83 1 105 THR 6.67 5.46 1 106 PHE 6.13 4.38 1 107 PHE 5.51 5.65 1 108 ALA 1.56 1.44 1 109 SER 0.52 0.71 1 110 LEU -0.36 0.77 1 112 ASP -4.69 -2.37 1 113 SER -0.42 -1.19 1 114 VAL 5.45 3.94 1 115 LEU -2.90 -3.24 1 117 LYS 5.76 4.53 1 118 ALA 2.58 1.87 1 119 LEU -1.16 -0.59 1 120 SER 5.67 5.16 1 121 SER 4.69 4.17 1 122 GLU 2.18 2.49 1 123 ILE 5.85 4.56 1 124 LYS 7.47 2.96 1 125 VAL 6.43 4.71 1 127 LEU 3.07 1.55 1 128 GLN 0.38 0.29 1 129 ILE 2.01 1.72 1 130 GLU 1.35 2.13 1 131 ASP -2.27 -0.01 1 133 THR 7.29 5.45 1 134 THR 6.89 5.18 1 135 ARG 4.74 4.82 1 136 LYS 5.50 4.41 1 137 ASN 4.14 2.92 1 138 PHE 3.52 3.50 1 139 MET 3.77 2.26 1 140 HIS 1.91 4.23 1 142 LEU 3.44 2.58 1 143 ILE 3.78 2.03 1 144 TYR 3.40 3.15 1 145 ASN -0.88 0.05 1 146 LEU -0.05 1.11 1 148 ASP 4.48 4.72 1 149 ALA 4.50 3.58 1 150 GLN 8.06 6.35 1 151 TYR 5.12 5.33 1 152 TRP 3.32 3.03 1 153 THR 8.97 6.95 1 154 LEU 5.33 4.76 1 155 ARG 5.39 3.10 1 156 ALA 3.22 2.84 1 157 LEU 2.48 3.09 1 158 VAL 8.12 2.57 1 159 PHE 9.34 8.44 1 162 LYS 5.58 3.38 1 163 ARG 5.25 4.93 1 164 VAL 7.28 5.39 1 165 LEU 3.16 2.65 1 166 ALA 3.00 1.78 1 167 HIS 0.60 0.58 1 168 GLU 3.30 2.73 1 169 ALA 4.03 2.91 1 170 GLN 0.54 2.51 1 171 ASN 1.51 1.24 1 172 ARG 4.97 0.82 1 173 MET 1.62 -1.98 1 174 ASN -3.31 -2.32 1 175 LEU 5.31 4.87 1 176 ARG 3.59 2.90 1 177 ALA 3.67 2.26 1 178 LEU 3.34 2.83 1 180 ILE 2.06 -0.27 1 181 ILE 1.76 1.81 1 182 TRP 1.98 2.74 1 185 THR 2.28 2.32 1 186 ILE -0.91 -0.22 1 187 ALA -2.41 -1.58 1 189 ALA -1.74 -1.17 1 190 ASN -0.04 -0.29 1 192 ASP -0.78 0.32 1 193 ASP 0.33 0.13 1 194 ALA 2.44 1.96 1 195 ASN 0.07 0.26 1 196 ASP -0.53 -0.73 1 197 VAL 1.81 1.23 1 198 ASN 4.16 3.71 1 199 PHE 2.25 3.72 1 200 GLN 2.94 3.18 1 201 ILE 5.10 4.97 1 202 MET 3.08 2.74 1 203 ALA 4.58 3.13 1 204 MET 2.43 1.91 1 205 GLU 4.55 4.56 1 206 VAL 5.38 3.84 1 207 LEU 3.74 3.58 1 208 LEU 4.93 3.28 1 209 GLU 2.68 2.91 1 210 VAL -1.20 -0.90 1 211 SER 3.67 3.06 1 212 ASP 3.56 2.82 1 213 GLN 0.64 1.44 1 214 ALA 0.29 1.16 1 215 PHE -1.20 0.87 1 218 GLU 0.13 0.68 1 219 LEU 0.06 0.34 1 220 GLU 0.03 1.55 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19589_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.79 _LACS_plot.Line_1_terminator_val_y_1 2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.05 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 -2.26 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 MET -6.79 6.86 0 10 ASN -0.11 1.94 1 15 VAL 0.53 -0.54 1 16 GLN -0.25 0.30 1 17 LYS -0.30 0.18 1 18 ASN -0.12 0.30 1 19 PHE -0.83 0.86 1 20 LYS -0.81 0.92 1 21 THR 3.01 0.62 1 22 PHE 0.01 0.65 1 24 VAL -2.13 0.67 1 26 LEU 3.38 0.15 1 27 GLU 6.18 -1.99 1 28 SER 2.61 -0.34 1 29 LEU -0.56 1.18 1 30 ILE 1.67 -2.18 1 31 GLU 3.21 -0.94 1 32 PHE -0.21 0.35 1 33 GLU 2.58 0.70 1 34 GLN 2.77 -0.95 1 35 ASP -1.96 0.89 1 37 VAL -6.54 2.67 1 39 ALA 4.41 -1.05 1 40 ILE 4.01 -1.80 1 41 VAL 4.89 -1.27 1 42 ARG 4.08 -0.45 1 43 GLN 4.11 -1.04 1 45 ILE 6.90 -1.21 1 46 TYR 3.98 -0.52 1 47 VAL 5.63 -1.42 1 48 ILE 6.75 -2.63 1 49 ASP 3.57 -0.58 1 50 LYS 2.47 -0.43 1 51 PHE -2.41 2.53 1 53 LEU 4.92 -1.97 1 54 ASP -0.94 0.20 1 55 GLN 0.62 -0.97 1 56 GLU 2.03 -0.29 1 65 VAL 4.58 -1.14 1 66 LEU 4.04 -1.01 1 67 ASP 3.77 -0.17 1 68 VAL 5.83 -1.09 1 69 SER 4.60 -0.85 1 70 LYS 3.79 -0.73 1 71 LEU 2.56 -0.11 1 72 LYS 3.91 -0.34 1 73 GLU 3.44 -0.69 1 74 GLU 2.96 -0.25 1 75 ILE 5.07 -0.74 1 76 ASP 2.87 0.24 1 77 LYS 2.21 0.28 1 78 ASP -2.13 1.84 1 80 ALA 2.45 -0.78 1 81 ASN 2.43 -1.40 1 82 ILE 4.92 -0.57 1 83 SER 3.64 -0.95 1 84 MET 1.19 0.27 1 85 ILE 1.50 0.28 1 86 LEU -0.86 0.51 1 88 SER -0.97 0.67 1 89 LYS -1.15 0.70 1 91 HIS -0.14 1.80 1 92 SER -3.10 1.63 1 93 ASP 4.30 -1.59 1 94 SER 3.82 -0.76 1 95 ASP 2.75 0.36 1 96 ILE 4.00 -2.57 1 97 TYR 5.02 -2.00 1 98 LEU 4.56 -0.90 1 99 VAL 6.97 -1.47 1 101 SER 4.44 -0.15 1 102 LEU 3.85 -0.82 1 103 LEU 3.28 0.17 1 104 LYS 5.97 -1.14 1 105 THR 6.67 -1.21 1 106 PHE 6.13 -1.75 1 107 PHE 5.51 0.14 1 108 ALA 1.56 -0.12 1 109 SER 0.52 0.19 1 110 LEU -0.36 1.13 1 112 ASP -4.69 2.32 1 113 SER -0.42 -0.77 1 114 VAL 5.45 -1.51 1 115 LEU -2.90 -0.34 1 117 LYS 5.76 -1.23 1 118 ALA 2.58 -0.71 1 119 LEU -1.16 0.57 1 120 SER 5.67 -0.51 1 121 SER 4.69 -0.52 1 122 GLU 2.18 0.31 1 123 ILE 5.85 -1.29 1 124 LYS 7.47 -4.51 1 125 VAL 6.43 -1.72 1 127 LEU 3.07 -1.52 1 128 GLN 0.38 -0.09 1 129 ILE 2.01 -0.29 1 130 GLU 1.35 0.78 1 131 ASP -2.27 2.26 1 133 THR 7.29 -1.84 1 134 THR 6.89 -1.71 1 135 ARG 4.74 0.08 1 136 LYS 5.50 -1.09 1 137 ASN 4.14 -1.22 1 138 PHE 3.52 -0.02 1 139 MET 3.77 -1.51 1 140 HIS 1.91 2.32 1 142 LEU 3.44 -0.86 1 143 ILE 3.78 -1.75 1 144 TYR 3.40 -0.25 1 145 ASN -0.88 0.93 1 146 LEU -0.05 1.16 1 148 ASP 4.48 0.24 1 149 ALA 4.50 -0.92 1 150 GLN 8.06 -1.71 1 151 TYR 5.12 0.21 1 152 TRP 3.32 -0.29 1 153 THR 8.97 -2.02 1 154 LEU 5.33 -0.57 1 155 ARG 5.39 -2.29 1 156 ALA 3.22 -0.38 1 157 LEU 2.48 0.61 1 158 VAL 8.12 -5.55 1 159 PHE 9.34 -0.90 1 162 LYS 5.58 -2.20 1 163 ARG 5.25 -0.32 1 164 VAL 7.28 -1.89 1 165 LEU 3.16 -0.51 1 166 ALA 3.00 -1.22 1 167 HIS 0.60 -0.02 1 168 GLU 3.30 -0.57 1 169 ALA 4.03 -1.12 1 170 GLN 0.54 1.97 1 171 ASN 1.51 -0.27 1 172 ARG 4.97 -4.15 1 173 MET 1.62 -3.60 1 174 ASN -3.31 0.99 1 175 LEU 5.31 -0.44 1 176 ARG 3.59 -0.69 1 177 ALA 3.67 -1.41 1 178 LEU 3.34 -0.51 1 180 ILE 2.06 -2.33 1 181 ILE 1.76 0.05 1 182 TRP 1.98 0.76 1 185 THR 2.28 0.04 1 186 ILE -0.91 0.69 1 187 ALA -2.41 0.83 1 189 ALA -1.74 0.57 1 190 ASN -0.04 -0.25 1 192 ASP -0.78 1.10 1 193 ASP 0.33 -0.20 1 194 ALA 2.44 -0.48 1 195 ASN 0.07 0.19 1 196 ASP -0.53 -0.20 1 197 VAL 1.81 -0.58 1 198 ASN 4.16 -0.45 1 199 PHE 2.25 1.47 1 200 GLN 2.94 0.24 1 201 ILE 5.10 -0.13 1 202 MET 3.08 -0.34 1 203 ALA 4.58 -1.45 1 204 MET 2.43 -0.52 1 205 GLU 4.55 0.01 1 206 VAL 5.38 -1.54 1 207 LEU 3.74 -0.16 1 208 LEU 4.93 -1.65 1 209 GLU 2.68 0.23 1 210 VAL -1.20 0.30 1 211 SER 3.67 -0.61 1 212 ASP 3.56 -0.74 1 213 GLN 0.64 0.80 1 214 ALA 0.29 0.87 1 215 PHE -1.20 2.07 1 218 GLU 0.13 0.55 1 219 LEU 0.06 0.28 1 220 GLU 0.03 1.52 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19589_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.79 _LACS_plot.Line_1_terminator_val_y_1 0.29 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.02 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 176 ARG 3.59 -2.32 0 10 ASN -0.11 -0.23 1 11 MET -6.79 0.06 1 15 VAL 0.53 0.00 1 16 GLN -0.25 0.24 1 17 LYS -0.30 0.05 1 18 ASN -0.12 -0.04 1 19 PHE -0.83 -0.02 1 20 LYS -0.81 0.29 1 21 THR 3.01 0.12 1 22 PHE 0.01 -0.60 1 24 VAL -2.13 0.27 1 26 LEU 3.38 -0.40 1 27 GLU 6.18 -0.47 1 28 SER 2.61 -0.11 1 29 LEU -0.56 -0.61 1 30 ILE 1.67 0.09 1 31 GLU 3.21 0.11 1 32 PHE -0.21 -1.02 1 33 GLU 2.58 0.07 1 34 GLN 2.77 -0.28 1 35 ASP -1.96 0.07 1 37 VAL -6.54 0.52 1 39 ALA 4.41 -0.41 1 40 ILE 4.01 -0.34 1 41 VAL 4.89 -0.84 1 42 ARG 4.08 -0.61 1 43 GLN 4.11 -0.07 1 45 ILE 6.90 -1.34 1 46 TYR 3.98 -0.27 1 47 VAL 5.63 -0.62 1 48 ILE 6.75 -0.66 1 49 ASP 3.57 -0.28 1 50 LYS 2.47 -0.58 1 51 PHE -2.41 0.35 1 53 LEU 4.92 -0.52 1 54 ASP -0.94 0.37 1 55 GLN 0.62 -0.26 1 56 GLU 2.03 -0.25 1 65 VAL 4.58 -0.37 1 66 LEU 4.04 -0.20 1 67 ASP 3.77 -0.16 1 68 VAL 5.83 -0.64 1 69 SER 4.60 -0.36 1 70 LYS 3.79 -0.23 1 71 LEU 2.56 0.63 1 72 LYS 3.91 -0.86 1 73 GLU 3.44 -0.31 1 74 GLU 2.96 -0.23 1 75 ILE 5.07 0.04 1 76 ASP 2.87 0.36 1 77 LYS 2.21 -0.23 1 78 ASP -2.13 0.00 1 80 ALA 2.45 -0.09 1 81 ASN 2.43 -0.66 1 82 ILE 4.92 -0.40 1 83 SER 3.64 -0.33 1 84 MET 1.19 -0.07 1 85 ILE 1.50 -0.27 1 86 LEU -0.86 -0.23 1 88 SER -0.97 -0.05 1 89 LYS -1.15 0.04 1 92 SER -3.10 0.01 1 93 ASP 4.30 -0.44 1 95 ASP 2.75 -0.15 1 96 ILE 4.00 -0.51 1 97 TYR 5.02 -0.15 1 98 LEU 4.56 -0.32 1 99 VAL 6.97 -0.34 1 101 SER 4.44 -0.26 1 102 LEU 3.85 -0.23 1 103 LEU 3.28 0.02 1 104 LYS 5.97 -0.23 1 105 THR 6.67 0.18 1 106 PHE 6.13 -0.38 1 107 PHE 5.51 -0.30 1 108 ALA 1.56 0.09 1 109 SER 0.52 0.04 1 110 LEU -0.36 -0.64 1 112 ASP -4.69 0.19 1 113 SER -0.42 -0.25 1 114 VAL 5.45 -0.24 1 115 LEU -2.90 0.59 1 117 LYS 5.76 0.07 1 118 ALA 2.58 -0.01 1 119 LEU -1.16 0.36 1 120 SER 5.67 0.04 1 121 SER 4.69 -0.25 1 122 GLU 2.18 -0.22 1 123 ILE 5.85 -0.71 1 124 LYS 7.47 0.34 1 125 VAL 6.43 0.00 1 127 LEU 3.07 -0.48 1 128 GLN 0.38 -0.13 1 129 ILE 2.01 -0.43 1 130 GLU 1.35 -0.33 1 131 ASP -2.27 -0.04 1 133 THR 7.29 -0.21 1 134 THR 6.89 -0.39 1 135 ARG 4.74 -0.42 1 136 LYS 5.50 -0.35 1 137 ASN 4.14 -0.34 1 138 PHE 3.52 -0.51 1 139 MET 3.77 0.01 1 140 HIS 1.91 -0.78 1 142 LEU 3.44 -0.28 1 143 ILE 3.78 -0.57 1 144 TYR 3.40 -0.44 1 145 ASN -0.88 -0.04 1 146 LEU -0.05 -0.09 1 148 ASP 4.48 -0.25 1 149 ALA 4.50 -0.01 1 150 GLN 8.06 -0.45 1 151 TYR 5.12 -0.75 1 152 TRP 3.32 -0.34 1 153 THR 8.97 -0.25 1 154 LEU 5.33 -0.02 1 156 ALA 3.22 -0.23 1 157 LEU 2.48 -0.16 1 158 VAL 8.12 0.19 1 159 PHE 9.34 -1.30 1 162 LYS 5.58 -0.36 1 163 ARG 5.25 -0.08 1 164 VAL 7.28 -0.75 1 165 LEU 3.16 -0.35 1 166 ALA 3.00 0.02 1 167 HIS 0.60 -0.71 1 168 GLU 3.30 0.25 1 169 ALA 4.03 -0.27 1 170 GLN 0.54 0.23 1 171 ASN 1.51 -0.36 1 172 ARG 4.97 -0.29 1 173 MET 1.62 -0.43 1 174 ASN -3.31 0.06 1 175 LEU 5.31 -0.01 1 177 ALA 3.67 -0.30 1 178 LEU 3.34 -0.44 1 180 ILE 2.06 0.09 1 181 ILE 1.76 -0.39 1 182 TRP 1.98 -0.40 1 185 THR 2.28 0.02 1 186 ILE -0.91 -0.33 1 187 ALA -2.41 0.32 1 189 ALA -1.74 -0.27 1 190 ASN -0.04 -0.99 1 192 ASP -0.78 -0.04 1 193 ASP 0.33 -0.16 1 194 ALA 2.44 -0.22 1 195 ASN 0.07 -0.02 1 196 ASP -0.53 0.14 1 197 VAL 1.81 0.39 1 198 ASN 4.16 -0.19 1 199 PHE 2.25 -0.56 1 200 GLN 2.94 -0.28 1 201 ILE 5.10 -0.73 1 202 MET 3.08 0.03 1 203 ALA 4.58 -0.57 1 204 MET 2.43 -0.28 1 205 GLU 4.55 -0.15 1 206 VAL 5.38 -0.33 1 207 LEU 3.74 -0.40 1 208 LEU 4.93 -0.20 1 209 GLU 2.68 -0.22 1 210 VAL -1.20 0.47 1 211 SER 3.67 -0.10 1 212 ASP 3.56 -0.26 1 213 GLN 0.64 0.06 1 214 ALA 0.29 -0.61 1 215 PHE -1.20 -0.89 1 218 GLU 0.13 -0.17 1 219 LEU 0.06 0.06 1 220 GLU 0.03 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19589_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.79 _LACS_plot.Line_1_terminator_val_y_1 -1.08 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.20 _LACS_plot.Line_2_terminator_val_x_2 9.34 _LACS_plot.Line_2_terminator_val_y_2 2.39 _LACS_plot.Y_axis_chem_shift_offset -0.55 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 180 ILE 2.06 -3.46 0 37 VAL -6.54 -1.83 0 173 MET 1.62 -3.89 0 11 MET -6.79 0.65 0 10 ASN -0.11 4.02 1 15 VAL 0.53 -0.23 1 16 GLN -0.25 -0.29 1 17 LYS -0.30 -0.83 1 18 ASN -0.12 -0.89 1 20 LYS -0.81 -2.01 1 21 THR 3.01 -0.84 1 22 PHE 0.01 2.11 1 24 VAL -2.13 -1.97 1 26 LEU 3.38 0.92 1 27 GLU 6.18 1.91 1 28 SER 2.61 1.17 1 29 LEU -0.56 -1.17 1 30 ILE 1.67 2.78 1 31 GLU 3.21 0.30 1 32 PHE -0.21 3.53 1 34 GLN 2.77 -0.54 1 35 ASP -1.96 1.06 1 39 ALA 4.41 2.27 1 40 ILE 4.01 -0.47 1 41 VAL 4.89 0.25 1 42 ARG 4.08 3.17 1 43 GLN 4.11 2.32 1 45 ILE 6.90 -0.13 1 46 TYR 3.98 1.39 1 47 VAL 5.63 1.61 1 48 ILE 6.75 2.11 1 49 ASP 3.57 3.16 1 50 LYS 2.47 1.80 1 51 PHE -2.41 1.47 1 53 LEU 4.92 -0.10 1 54 ASP -0.94 -1.20 1 55 GLN 0.62 -0.58 1 56 GLU 2.03 2.46 1 65 VAL 4.58 1.52 1 66 LEU 4.04 1.87 1 67 ASP 3.77 2.74 1 68 VAL 5.83 1.10 1 69 SER 4.60 1.47 1 70 LYS 3.79 1.75 1 71 LEU 2.56 0.67 1 72 LYS 3.91 0.96 1 73 GLU 3.44 3.26 1 74 GLU 2.96 3.40 1 75 ILE 5.07 1.24 1 76 ASP 2.87 1.81 1 77 LYS 2.21 0.84 1 78 ASP -2.13 -1.32 1 80 ALA 2.45 2.11 1 81 ASN 2.43 1.71 1 82 ILE 4.92 -0.17 1 83 SER 3.64 0.82 1 84 MET 1.19 0.42 1 85 ILE 1.50 -0.91 1 88 SER -0.97 -1.83 1 91 HIS -0.14 0.97 1 92 SER -3.10 1.81 1 93 ASP 4.30 1.80 1 94 SER 3.82 1.81 1 95 ASP 2.75 1.34 1 96 ILE 4.00 1.73 1 97 TYR 5.02 3.91 1 98 LEU 4.56 0.25 1 99 VAL 6.97 1.90 1 101 SER 4.44 2.86 1 102 LEU 3.85 0.56 1 103 LEU 3.28 1.63 1 104 LYS 5.97 2.11 1 105 THR 6.67 2.37 1 106 PHE 6.13 1.78 1 107 PHE 5.51 2.67 1 108 ALA 1.56 0.67 1 109 SER 0.52 -1.10 1 110 LEU -0.36 1.24 1 112 ASP -4.69 -0.92 1 113 SER -0.42 2.05 1 114 VAL 5.45 -0.82 1 117 LYS 5.76 3.34 1 118 ALA 2.58 1.32 1 119 LEU -1.16 1.21 1 120 SER 5.67 1.51 1 121 SER 4.69 1.93 1 122 GLU 2.18 2.62 1 123 ILE 5.85 0.53 1 124 LYS 7.47 1.51 1 125 VAL 6.43 1.76 1 127 LEU 3.07 0.56 1 128 GLN 0.38 0.36 1 129 ILE 2.01 0.18 1 130 GLU 1.35 0.31 1 131 ASP -2.27 -0.16 1 133 THR 7.29 1.21 1 134 THR 6.89 1.89 1 135 ARG 4.74 1.43 1 136 LYS 5.50 1.74 1 137 ASN 4.14 2.88 1 138 PHE 3.52 3.31 1 139 MET 3.77 1.32 1 140 HIS 1.91 3.11 1 142 LEU 3.44 2.18 1 143 ILE 3.78 1.70 1 144 TYR 3.40 0.55 1 145 ASN -0.88 0.11 1 146 LEU -0.05 -0.76 1 148 ASP 4.48 0.82 1 149 ALA 4.50 1.59 1 150 GLN 8.06 0.82 1 151 TYR 5.12 0.90 1 152 TRP 3.32 4.24 1 153 THR 8.97 0.64 1 154 LEU 5.33 0.95 1 155 ARG 5.39 1.79 1 156 ALA 3.22 3.07 1 157 LEU 2.48 2.16 1 158 VAL 8.12 1.32 1 159 PHE 9.34 0.77 1 162 LYS 5.58 3.55 1 163 ARG 5.25 2.47 1 164 VAL 7.28 3.99 1 165 LEU 3.16 2.53 1 166 ALA 3.00 1.34 1 167 HIS 0.60 0.80 1 168 GLU 3.30 1.51 1 169 ALA 4.03 0.98 1 170 GLN 0.54 0.80 1 171 ASN 1.51 1.75 1 172 ARG 4.97 -0.13 1 174 ASN -3.31 -0.29 1 175 LEU 5.31 -0.78 1 176 ARG 3.59 0.04 1 177 ALA 3.67 3.28 1 178 LEU 3.34 0.48 1 181 ILE 1.76 1.84 1 182 TRP 1.98 2.40 1 185 THR 2.28 -0.07 1 186 ILE -0.91 -3.38 1 187 ALA -2.41 -0.86 1 189 ALA -1.74 -0.48 1 190 ASN -0.04 3.73 1 192 ASP -0.78 -0.02 1 193 ASP 0.33 -1.01 1 194 ALA 2.44 0.30 1 195 ASN 0.07 0.20 1 196 ASP -0.53 0.77 1 197 VAL 1.81 1.08 1 198 ASN 4.16 1.40 1 199 PHE 2.25 0.02 1 200 GLN 2.94 1.98 1 201 ILE 5.10 1.48 1 202 MET 3.08 2.49 1 203 ALA 4.58 0.86 1 204 MET 2.43 0.69 1 205 GLU 4.55 2.51 1 206 VAL 5.38 1.47 1 207 LEU 3.74 1.06 1 208 LEU 4.93 2.97 1 209 GLU 2.68 2.26 1 210 VAL -1.20 0.93 1 211 SER 3.67 0.20 1 212 ASP 3.56 0.75 1 213 GLN 0.64 1.02 1 214 ALA 0.29 -1.25 1 215 PHE -1.20 0.99 1 218 GLU 0.13 3.82 1 219 LEU 0.06 -1.13 1 220 GLU 0.03 4.26 1 stop_ save_