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 bmr17251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 -2.40 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.59 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 6.09 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 164 HIS -3.76 4.36 0 10 SER 1.33 1.23 1 12 LYS 2.18 1.98 1 13 VAL 4.45 3.30 1 14 GLU 5.29 4.60 1 17 MET 0.99 -1.45 1 18 VAL -5.64 -3.18 1 19 GLN -3.58 -0.46 1 20 VAL -1.67 -0.47 1 21 THR -2.09 -0.58 1 24 THR 0.89 -0.17 1 25 THR 1.27 1.18 1 26 THR -2.01 -0.57 1 27 LEU -1.42 -1.10 1 28 ASN -1.36 0.78 1 30 LEU -6.09 -1.89 1 31 TRP -5.73 -3.79 1 32 LEU -5.21 -2.50 1 33 ASP 4.48 2.87 1 34 ASP 0.68 -0.89 1 35 THR -1.74 0.46 1 36 VAL -2.75 -1.98 1 37 TYR -3.88 -1.81 1 40 ARG 4.11 2.62 1 41 HIS 4.26 3.72 1 42 VAL 2.53 1.83 1 43 ILE 1.67 1.14 1 45 THR -2.22 -0.58 1 46 ALA 4.11 3.08 1 47 GLU 2.94 2.37 1 48 ASP 1.34 2.15 1 49 MET 1.88 0.83 1 50 LEU 3.10 2.40 1 51 ASN 1.33 0.89 1 53 ASN -0.04 -1.90 1 54 TYR 6.51 6.77 1 55 GLU 5.15 4.26 1 56 ASP 1.98 2.78 1 57 LEU 2.24 2.54 1 58 LEU 3.20 2.65 1 59 ILE 3.06 2.40 1 60 ARG 0.75 0.54 1 61 LYS -2.25 -2.49 1 62 SER -3.85 -1.57 1 63 ASN 5.37 4.01 1 64 HIS 1.20 1.76 1 65 SER 2.74 1.68 1 66 PHE -3.29 -0.99 1 67 LEU -2.47 -1.37 1 68 VAL -1.33 -1.49 1 69 GLN -4.45 -1.24 1 70 ALA -3.23 -2.61 1 72 ASN 0.44 0.24 1 73 VAL -1.30 -0.24 1 74 GLN -0.56 -0.73 1 75 LEU -2.35 -1.96 1 76 ARG 0.27 0.35 1 77 VAL 2.09 0.89 1 78 ILE -0.59 -0.39 1 80 HIS -3.26 0.46 1 81 SER -2.21 -0.59 1 82 MET -3.54 -0.12 1 83 GLN -2.22 -1.08 1 84 ASN 4.23 2.88 1 86 LEU -3.45 -1.63 1 87 LEU -3.20 -1.14 1 88 ARG -2.13 -1.77 1 89 LEU -2.02 -2.38 1 90 LYS -0.92 -1.50 1 91 VAL -5.92 -3.58 1 92 ASP 0.40 0.52 1 93 THR -3.52 -0.56 1 94 SER -1.11 -1.34 1 95 ASN 3.64 -0.39 1 97 LYS 0.27 -1.60 1 98 THR 2.08 3.51 1 100 LYS 3.45 2.12 1 101 TYR -5.74 -1.53 1 102 LYS -5.24 -1.38 1 103 PHE -2.65 -4.33 1 104 VAL -5.53 -2.50 1 105 ARG -2.23 -0.90 1 106 ILE -3.33 -0.88 1 107 GLN -1.28 -0.33 1 110 GLN -0.31 0.00 1 111 THR 0.18 0.70 1 112 PHE -2.10 -1.87 1 113 SER -1.81 -0.57 1 114 VAL -4.44 -1.99 1 115 LEU -2.02 -1.88 1 116 ALA -0.03 0.23 1 118 TYR -2.71 -1.67 1 119 ASN 2.34 0.75 1 121 SER -2.00 -0.90 1 123 SER -1.11 -0.32 1 125 VAL -1.79 -1.45 1 126 TYR -4.19 -1.44 1 127 GLN -0.85 -0.19 1 129 ALA -4.29 -1.23 1 130 MET 1.17 1.32 1 131 ARG 0.26 1.91 1 133 ASN 0.84 -0.94 1 134 HIS 8.01 5.57 1 135 THR -4.92 -1.35 1 136 ILE -4.36 -0.62 1 137 LYS -2.64 -1.48 1 139 SER 2.66 1.77 1 141 LEU 1.30 -0.87 1 142 ASN 3.40 1.72 1 144 SER -2.47 -1.07 1 147 SER 3.69 3.69 1 148 VAL -5.68 -2.57 1 150 PHE -3.39 -1.00 1 151 ASN -4.73 0.10 1 152 ILE -0.19 -0.25 1 153 ASP -2.81 -1.21 1 154 TYR 5.41 2.83 1 155 ASP -0.19 -0.26 1 157 VAL 0.54 0.00 1 158 SER -1.38 -2.08 1 159 PHE 0.98 2.28 1 161 TYR -5.45 0.46 1 162 MET -4.75 -0.63 1 163 HIS -0.80 3.62 1 165 MET -3.54 -0.70 1 166 GLU -2.20 -1.14 1 167 LEU 1.53 0.36 1 169 THR 1.36 0.31 1 171 VAL -3.86 -2.47 1 172 HIS -4.62 2.07 1 173 ALA -6.37 -2.04 1 175 THR -6.01 -2.60 1 176 ASP -0.37 -0.98 1 177 LEU 3.94 -2.39 1 178 GLU -0.73 -0.60 1 180 LYS -0.47 -1.50 1 181 PHE 3.98 3.46 1 182 TYR 1.95 1.58 1 185 PHE -1.29 0.10 1 186 VAL -4.73 -2.48 1 187 ASP 1.12 -2.00 1 188 ARG -2.30 -0.55 1 189 GLN 1.11 0.96 1 190 THR -0.33 0.10 1 191 ALA 0.35 0.48 1 192 GLN -0.17 0.21 1 193 ALA -0.05 0.13 1 194 ALA 0.15 0.35 1 196 THR 0.06 0.22 1 197 ASP 0.45 0.52 1 198 THR -0.24 -0.07 1 199 THR 0.97 1.88 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 3.97 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.46 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.41 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _LACS_plot.Y_axis_chem_shift_offset 0.11 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 164 HIS -3.76 8.12 0 10 SER 1.33 -0.10 1 12 LYS 2.18 -0.20 1 13 VAL 4.45 -1.15 1 14 GLU 5.29 -0.69 1 17 MET 0.99 -2.44 1 18 VAL -5.64 2.46 1 19 GLN -3.58 3.12 1 20 VAL -1.67 1.20 1 21 THR -2.09 1.51 1 24 THR 0.89 -1.06 1 25 THR 1.27 -0.09 1 26 THR -2.01 1.44 1 27 LEU -1.42 0.32 1 28 ASN -1.36 2.14 1 30 LEU -6.09 4.20 1 31 TRP -5.73 1.94 1 32 LEU -5.21 2.71 1 33 ASP 4.48 -1.61 1 34 ASP 0.68 -1.57 1 35 THR -1.74 2.20 1 36 VAL -2.75 0.77 1 37 TYR -3.88 2.07 1 40 ARG 4.11 -1.49 1 41 HIS 4.26 -0.54 1 42 VAL 2.53 -0.70 1 43 ILE 1.67 -0.53 1 45 THR -2.22 1.64 1 46 ALA 4.11 -1.03 1 47 GLU 2.94 -0.57 1 48 ASP 1.34 0.81 1 49 MET 1.88 -1.05 1 50 LEU 3.10 -0.70 1 51 ASN 1.33 -0.44 1 53 ASN -0.04 -1.86 1 54 TYR 6.51 0.26 1 55 GLU 5.15 -0.89 1 56 ASP 1.98 0.80 1 57 LEU 2.24 0.30 1 58 LEU 3.20 -0.55 1 59 ILE 3.06 -0.66 1 60 ARG 0.75 -0.21 1 61 LYS -2.25 -0.24 1 62 SER -3.85 2.28 1 63 ASN 5.37 -1.36 1 64 HIS 1.20 0.56 1 65 SER 2.74 -1.06 1 66 PHE -3.29 2.30 1 67 LEU -2.47 1.10 1 68 VAL -1.33 -0.16 1 69 GLN -4.45 3.21 1 70 ALA -3.23 0.62 1 72 ASN 0.44 -0.20 1 73 VAL -1.30 1.06 1 74 GLN -0.56 -0.17 1 75 LEU -2.35 0.39 1 76 ARG 0.27 0.08 1 77 VAL 2.09 -1.20 1 78 ILE -0.59 0.20 1 80 HIS -3.26 3.72 1 81 SER -2.21 1.62 1 82 MET -3.54 3.42 1 83 GLN -2.22 1.14 1 84 ASN 4.23 -1.35 1 86 LEU -3.45 1.82 1 87 LEU -3.20 2.06 1 88 ARG -2.13 0.36 1 89 LEU -2.02 -0.36 1 90 LYS -0.92 -0.58 1 91 VAL -5.92 2.34 1 92 ASP 0.40 0.12 1 93 THR -3.52 2.96 1 94 SER -1.11 -0.23 1 95 ASN 3.64 -4.03 1 97 LYS 0.27 -1.87 1 98 THR 2.08 1.43 1 100 LYS 3.45 -1.33 1 101 TYR -5.74 4.21 1 102 LYS -5.24 3.86 1 103 PHE -2.65 -1.68 1 104 VAL -5.53 3.03 1 105 ARG -2.23 1.33 1 106 ILE -3.33 2.45 1 107 GLN -1.28 0.95 1 110 GLN -0.31 0.31 1 111 THR 0.18 0.52 1 112 PHE -2.10 0.23 1 113 SER -1.81 1.24 1 114 VAL -4.44 2.45 1 115 LEU -2.02 0.14 1 116 ALA -0.03 0.26 1 118 TYR -2.71 1.04 1 119 ASN 2.34 -1.59 1 121 SER -2.00 1.10 1 123 SER -1.11 0.79 1 125 VAL -1.79 0.34 1 126 TYR -4.19 2.75 1 127 GLN -0.85 0.66 1 129 ALA -4.29 3.06 1 130 MET 1.17 0.15 1 131 ARG 0.26 1.65 1 133 ASN 0.84 -1.78 1 134 HIS 8.01 -2.44 1 135 THR -4.92 3.57 1 136 ILE -4.36 3.74 1 137 LYS -2.64 1.16 1 139 SER 2.66 -0.89 1 141 LEU 1.30 -2.17 1 142 ASN 3.40 -1.68 1 144 SER -2.47 1.40 1 147 SER 3.69 0.00 1 148 VAL -5.68 3.11 1 150 PHE -3.39 2.39 1 151 ASN -4.73 4.83 1 152 ILE -0.19 -0.06 1 153 ASP -2.81 1.60 1 154 TYR 5.41 -2.58 1 155 ASP -0.19 -0.07 1 157 VAL 0.54 -0.54 1 158 SER -1.38 -0.70 1 159 PHE 0.98 1.30 1 161 TYR -5.45 5.91 1 162 MET -4.75 4.12 1 163 HIS -0.80 4.42 1 165 MET -3.54 2.84 1 166 GLU -2.20 1.06 1 167 LEU 1.53 -1.17 1 169 THR 1.36 -1.05 1 171 VAL -3.86 1.39 1 172 HIS -4.62 6.69 1 173 ALA -6.37 4.33 1 175 THR -6.01 3.41 1 176 ASP -0.37 -0.61 1 177 LEU 3.94 -6.33 1 178 GLU -0.73 0.13 1 180 LYS -0.47 -1.03 1 181 PHE 3.98 -0.52 1 182 TYR 1.95 -0.37 1 185 PHE -1.29 1.39 1 186 VAL -4.73 2.25 1 187 ASP 1.12 -3.12 1 188 ARG -2.30 1.75 1 189 GLN 1.11 -0.15 1 190 THR -0.33 0.43 1 191 ALA 0.35 0.13 1 192 GLN -0.17 0.38 1 193 ALA -0.05 0.18 1 194 ALA 0.15 0.20 1 196 THR 0.06 0.16 1 197 ASP 0.45 0.07 1 198 THR -0.24 0.17 1 199 THR 0.97 0.91 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 0.87 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.36 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 95 ASN 3.64 -1.70 0 10 SER 1.33 -0.14 1 12 LYS 2.18 -0.19 1 13 VAL 4.45 -0.43 1 14 GLU 5.29 -0.63 1 17 MET 0.99 1.11 1 18 VAL -5.64 0.91 1 19 GLN -3.58 0.65 1 20 VAL -1.67 0.55 1 21 THR -2.09 1.15 1 24 THR 0.89 0.01 1 25 THR 1.27 0.18 1 26 THR -2.01 1.11 1 27 LEU -1.42 0.55 1 28 ASN -1.36 0.58 1 30 LEU -6.09 0.80 1 31 TRP -5.73 1.17 1 32 LEU -5.21 0.21 1 33 ASP 4.48 -0.56 1 34 ASP 0.68 0.34 1 35 THR -1.74 0.83 1 36 VAL -2.75 1.01 1 37 TYR -3.88 0.74 1 40 ARG 4.11 -0.15 1 41 HIS 4.26 0.33 1 42 VAL 2.53 -0.08 1 43 ILE 1.67 0.25 1 45 THR -2.22 0.23 1 46 ALA 4.11 -0.29 1 47 GLU 2.94 -0.30 1 48 ASP 1.34 -0.22 1 49 MET 1.88 -0.24 1 50 LEU 3.10 -0.12 1 51 ASN 1.33 -0.28 1 53 ASN -0.04 0.14 1 54 TYR 6.51 -0.72 1 55 GLU 5.15 -0.39 1 56 ASP 1.98 -0.21 1 57 LEU 2.24 -0.37 1 58 LEU 3.20 -0.32 1 59 ILE 3.06 -0.07 1 60 ARG 0.75 -0.02 1 61 LYS -2.25 0.05 1 62 SER -3.85 0.31 1 63 ASN 5.37 -0.34 1 64 HIS 1.20 -0.13 1 65 SER 2.74 -0.34 1 66 PHE -3.29 0.23 1 67 LEU -2.47 0.47 1 68 VAL -1.33 0.80 1 69 GLN -4.45 0.54 1 70 ALA -3.23 0.54 1 72 ASN 0.44 -0.03 1 73 VAL -1.30 0.07 1 74 GLN -0.56 0.38 1 75 LEU -2.35 0.15 1 76 ARG 0.27 -0.13 1 77 VAL 2.09 0.12 1 78 ILE -0.59 0.38 1 80 HIS -3.26 0.73 1 81 SER -2.21 0.06 1 82 MET -3.54 0.60 1 83 GLN -2.22 0.17 1 84 ASN 4.23 -0.58 1 86 LEU -3.45 0.65 1 87 LEU -3.20 0.27 1 88 ARG -2.13 0.26 1 89 LEU -2.02 0.38 1 90 LYS -0.92 0.60 1 91 VAL -5.92 1.47 1 92 ASP 0.40 -0.34 1 93 THR -3.52 0.23 1 94 SER -1.11 0.07 1 97 LYS 0.27 0.01 1 98 THR 2.08 -0.70 1 100 LYS 3.45 -0.07 1 101 TYR -5.74 1.58 1 102 LYS -5.24 -0.02 1 103 PHE -2.65 1.36 1 104 VAL -5.53 0.57 1 105 ARG -2.23 0.81 1 106 ILE -3.33 0.59 1 107 GLN -1.28 0.36 1 110 GLN -0.31 0.24 1 111 THR 0.18 0.44 1 112 PHE -2.10 0.37 1 113 SER -1.81 0.55 1 114 VAL -4.44 0.88 1 115 LEU -2.02 0.81 1 116 ALA -0.03 -0.04 1 118 TYR -2.71 0.37 1 119 ASN 2.34 -0.61 1 121 SER -2.00 0.33 1 123 SER -1.11 0.35 1 125 VAL -1.79 0.94 1 126 TYR -4.19 -0.16 1 127 GLN -0.85 0.38 1 129 ALA -4.29 0.10 1 130 MET 1.17 -0.13 1 131 ARG 0.26 -0.18 1 133 ASN 0.84 0.04 1 134 HIS 8.01 -0.70 1 135 THR -4.92 0.71 1 136 ILE -4.36 0.39 1 137 LYS -2.64 0.45 1 139 SER 2.66 -0.15 1 141 LEU 1.30 -0.35 1 142 ASN 3.40 -0.25 1 144 SER -2.47 0.57 1 147 SER 3.69 0.19 1 148 VAL -5.68 1.45 1 150 PHE -3.39 1.18 1 151 ASN -4.73 0.38 1 152 ILE -0.19 0.46 1 153 ASP -2.81 0.21 1 154 TYR 5.41 -0.56 1 155 ASP -0.19 -0.24 1 157 VAL 0.54 -0.04 1 158 SER -1.38 0.69 1 159 PHE 0.98 0.42 1 161 TYR -5.45 1.00 1 162 MET -4.75 0.39 1 163 HIS -0.80 -0.50 1 164 HIS -3.76 0.20 1 165 MET -3.54 0.54 1 166 GLU -2.20 0.56 1 167 LEU 1.53 0.00 1 169 THR 1.36 -0.17 1 171 VAL -3.86 0.51 1 172 HIS -4.62 0.73 1 173 ALA -6.37 1.08 1 175 THR -6.01 0.25 1 176 ASP -0.37 -0.09 1 177 LEU 3.94 -0.51 1 178 GLU -0.73 -0.19 1 180 LYS -0.47 0.19 1 181 PHE 3.98 -0.80 1 182 TYR 1.95 -0.02 1 185 PHE -1.29 -0.28 1 186 VAL -4.73 -0.19 1 187 ASP 1.12 0.25 1 188 ARG -2.30 0.25 1 189 GLN 1.11 0.04 1 190 THR -0.33 0.02 1 191 ALA 0.35 0.02 1 192 GLN -0.17 -0.01 1 193 ALA -0.05 -0.02 1 194 ALA 0.15 0.03 1 196 THR 0.06 0.03 1 197 ASP 0.45 0.07 1 198 THR -0.24 0.07 1 199 THR 0.97 -0.19 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17251_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.37 _LACS_plot.Line_1_terminator_val_y_1 -2.20 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.99 _LACS_plot.Line_2_terminator_val_x_2 8.01 _LACS_plot.Line_2_terminator_val_y_2 2.02 _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 134 HIS 8.01 -0.19 0 199 THR 0.97 4.57 0 12 LYS 2.18 1.60 1 13 VAL 4.45 1.64 1 14 GLU 5.29 2.46 1 17 MET 0.99 0.80 1 18 VAL -5.64 -1.72 1 19 GLN -3.58 -1.22 1 20 VAL -1.67 -2.03 1 21 THR -2.09 -0.43 1 24 THR 0.89 -0.04 1 25 THR 1.27 -2.54 1 26 THR -2.01 -1.30 1 27 LEU -1.42 -2.47 1 28 ASN -1.36 -2.47 1 30 LEU -6.09 1.23 1 31 TRP -5.73 -1.56 1 32 LEU -5.21 -0.89 1 33 ASP 4.48 -1.09 1 34 ASP 0.68 -1.34 1 35 THR -1.74 -2.69 1 36 VAL -2.75 -2.11 1 37 TYR -3.88 0.35 1 41 HIS 4.26 1.91 1 43 ILE 1.67 -1.09 1 45 THR -2.22 1.05 1 46 ALA 4.11 2.65 1 47 GLU 2.94 2.13 1 48 ASP 1.34 0.64 1 49 MET 1.88 0.61 1 50 LEU 3.10 0.18 1 53 ASN -0.04 0.44 1 54 TYR 6.51 1.25 1 55 GLU 5.15 2.13 1 56 ASP 1.98 2.12 1 57 LEU 2.24 2.89 1 58 LEU 3.20 1.99 1 59 ILE 3.06 0.70 1 60 ARG 0.75 0.50 1 61 LYS -2.25 -1.78 1 62 SER -3.85 0.87 1 63 ASN 5.37 1.51 1 64 HIS 1.20 2.30 1 65 SER 2.74 -2.14 1 66 PHE -3.29 -2.17 1 67 LEU -2.47 -1.72 1 68 VAL -1.33 -1.90 1 69 GLN -4.45 -2.09 1 70 ALA -3.23 -0.37 1 72 ASN 0.44 -0.44 1 73 VAL -1.30 -1.93 1 74 GLN -0.56 -0.22 1 75 LEU -2.35 -1.75 1 76 ARG 0.27 -1.05 1 77 VAL 2.09 0.20 1 78 ILE -0.59 -0.40 1 80 HIS -3.26 -1.49 1 81 SER -2.21 -3.18 1 82 MET -3.54 -1.44 1 83 GLN -2.22 -2.09 1 84 ASN 4.23 -0.20 1 86 LEU -3.45 -0.91 1 87 LEU -3.20 -3.14 1 88 ARG -2.13 -0.53 1 89 LEU -2.02 -2.07 1 90 LYS -0.92 0.18 1 91 VAL -5.92 -0.15 1 92 ASP 0.40 -0.64 1 93 THR -3.52 -2.27 1 94 SER -1.11 0.55 1 97 LYS 0.27 -1.09 1 98 THR 2.08 -0.63 1 100 LYS 3.45 0.29 1 101 TYR -5.74 -1.97 1 102 LYS -5.24 -2.49 1 103 PHE -2.65 0.28 1 104 VAL -5.53 -2.76 1 106 ILE -3.33 -3.28 1 107 GLN -1.28 0.25 1 110 GLN -0.31 -0.01 1 111 THR 0.18 -0.17 1 112 PHE -2.10 -3.10 1 113 SER -1.81 -2.07 1 114 VAL -4.44 -0.94 1 115 LEU -2.02 -2.35 1 116 ALA -0.03 -1.33 1 118 TYR -2.71 0.12 1 119 ASN 2.34 0.08 1 121 SER -2.00 -0.46 1 123 SER -1.11 0.16 1 125 VAL -1.79 -1.10 1 126 TYR -4.19 -1.25 1 127 GLN -0.85 -0.30 1 129 ALA -4.29 -0.67 1 130 MET 1.17 1.45 1 133 ASN 0.84 0.41 1 135 THR -4.92 -0.55 1 136 ILE -4.36 -0.90 1 137 LYS -2.64 -3.24 1 141 LEU 1.30 -1.00 1 142 ASN 3.40 2.26 1 144 SER -2.47 -0.28 1 147 SER 3.69 2.74 1 148 VAL -5.68 -1.37 1 150 PHE -3.39 -2.75 1 151 ASN -4.73 -1.43 1 152 ILE -0.19 -1.57 1 153 ASP -2.81 -0.56 1 154 TYR 5.41 -1.46 1 155 ASP -0.19 -1.86 1 157 VAL 0.54 -1.54 1 158 SER -1.38 -0.60 1 159 PHE 0.98 0.30 1 161 TYR -5.45 -3.50 1 164 HIS -3.76 0.83 1 165 MET -3.54 -2.93 1 166 GLU -2.20 -0.70 1 167 LEU 1.53 0.60 1 169 THR 1.36 0.84 1 171 VAL -3.86 -2.44 1 173 ALA -6.37 -0.51 1 175 THR -6.01 -0.47 1 176 ASP -0.37 2.22 1 177 LEU 3.94 -1.72 1 178 GLU -0.73 0.57 1 180 LYS -0.47 -3.35 1 181 PHE 3.98 2.75 1 182 TYR 1.95 0.13 1 185 PHE -1.29 -2.85 1 187 ASP 1.12 -1.64 1 188 ARG -2.30 -1.37 1 189 GLN 1.11 -0.22 1 190 THR -0.33 -0.49 1 191 ALA 0.35 -0.37 1 192 GLN -0.17 -0.30 1 193 ALA -0.05 -0.37 1 194 ALA 0.15 -0.39 1 196 THR 0.06 -0.28 1 197 ASP 0.45 0.09 1 198 THR -0.24 -0.54 1 stop_ save_