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 bmr17523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 -3.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.79 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 3.91 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 LEU 3.09 -2.28 0 164 HIS 2.59 5.61 0 11 THR 3.51 1.84 1 12 LEU 3.31 2.50 1 13 TRP 3.25 3.10 1 14 SER 2.91 1.99 1 15 ARG -0.37 1.50 1 16 VAL 2.41 1.35 1 17 THR -3.21 -0.04 1 18 LYS 2.78 1.44 1 19 PHE -2.06 0.37 1 21 SER 0.59 -0.32 1 23 TRP -5.79 -1.56 1 25 PHE -6.36 -2.22 1 26 TRP -1.88 -1.93 1 27 VAL 1.50 2.24 1 28 SER -1.78 -0.89 1 30 THR -4.58 -1.13 1 31 VAL -1.09 0.41 1 32 PHE -6.63 -2.45 1 33 ILE -5.26 -3.24 1 34 THR 1.69 -1.46 1 35 THR -3.56 -3.24 1 36 THR 1.57 -2.51 1 37 HIS 6.05 4.35 1 38 VAL -0.55 -1.43 1 39 VAL 1.26 1.13 1 41 THR -1.55 -0.97 1 43 VAL -3.10 -2.12 1 44 LYS -1.07 -0.64 1 45 GLU -4.95 -2.44 1 46 PHE -2.90 -0.99 1 47 PHE 3.92 0.74 1 49 GLU 0.09 2.05 1 51 LEU 4.66 3.58 1 52 SER 3.18 1.78 1 53 SER -1.32 -0.07 1 54 ILE -2.81 -0.66 1 55 ALA -1.76 -1.70 1 56 ILE -0.47 0.13 1 57 HIS -3.05 -0.07 1 58 GLN 5.77 3.92 1 59 ALA -1.24 -0.66 1 61 GLU -0.55 0.02 1 62 PHE -2.60 0.16 1 63 THR -1.09 1.16 1 64 GLN -6.92 -2.04 1 65 PHE -5.63 -3.59 1 66 ARG -2.64 -1.26 1 67 PHE -0.61 1.15 1 68 SER 1.42 1.28 1 69 LYS -3.84 -2.13 1 70 LYS 2.15 0.79 1 71 MET -0.00 -1.10 1 72 ARG -3.57 -4.47 1 74 ASP 1.37 -0.17 1 75 LEU -2.62 -1.47 1 76 THR -2.12 -1.48 1 78 MET -5.12 -0.99 1 79 VAL 1.97 1.80 1 80 LEU -3.78 -2.13 1 81 GLU -3.38 -2.52 1 82 GLU 0.12 -2.10 1 86 GLU 2.86 2.03 1 88 THR 3.10 2.97 1 89 VAL 1.17 -0.46 1 91 SER -1.42 -0.50 1 92 VAL -1.85 -2.66 1 94 ILE 0.96 -0.28 1 95 LYS -3.64 -1.44 1 96 ARG -4.77 -3.44 1 97 ASP 3.58 2.85 1 98 SER 0.80 0.24 1 100 GLU 0.12 0.61 1 101 LEU 0.38 -1.55 1 102 LEU -3.67 -1.54 1 104 LEU -1.89 -0.92 1 105 ALA -2.31 -1.28 1 106 VAL -5.72 -2.79 1 107 ARG 1.03 -1.01 1 108 MET -3.36 -0.48 1 110 ALA -1.72 -0.74 1 111 ILE 1.61 0.45 1 112 ALA -4.67 -1.10 1 113 SER -0.12 -0.31 1 114 MET -4.36 -1.22 1 115 ARG -0.66 -1.26 1 116 ILE -2.27 -1.11 1 117 GLN 3.69 0.93 1 119 ARG -3.14 -1.63 1 120 LEU -0.60 -0.51 1 121 VAL -3.43 -1.78 1 122 HIS -3.18 1.80 1 125 SER -1.90 -0.78 1 127 MET -4.50 -1.85 1 128 LEU 1.20 1.07 1 129 LEU 0.10 -0.75 1 130 THR -0.23 -0.16 1 132 ALA -0.08 0.05 1 133 ASN -0.34 -0.26 1 134 ALA 0.32 0.32 1 135 LYS 1.46 0.32 1 137 MET -0.45 -0.27 1 138 ASP 0.57 0.09 1 139 LEU -0.20 -0.18 1 141 THR -1.86 -1.07 1 142 ILE 0.81 0.70 1 145 ASP -0.21 0.48 1 148 ALA -0.35 -0.05 1 150 TYR -0.98 -1.18 1 151 VAL -7.68 -4.42 1 152 HIS -3.51 0.11 1 153 LYS -0.24 -0.86 1 154 ARG -2.64 -1.10 1 156 ASN -0.28 0.22 1 157 ASP -3.56 -0.75 1 158 TRP -2.48 -1.66 1 159 VAL -3.25 -1.88 1 160 VAL -4.99 -3.98 1 163 VAL -6.78 -3.75 1 165 ALA -2.15 0.62 1 166 ALA -3.51 -0.26 1 167 ALA -5.26 -1.20 1 168 THR -1.16 -0.85 1 169 LYS 3.64 2.44 1 170 SER 0.73 0.42 1 172 ASN 1.21 0.84 1 173 THR -0.32 0.29 1 174 VAL -5.27 -3.27 1 175 VAL -4.16 -1.14 1 179 GLN -0.17 -0.28 1 180 ALA -1.83 -0.97 1 182 GLU -0.65 -0.18 1 184 GLU -0.63 -0.20 1 185 THR 0.03 0.03 1 186 ALA -0.72 -0.51 1 187 LEU 0.00 -0.04 1 188 GLU -0.26 1.14 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 4.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 -2.13 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 93 LEU 3.09 -5.37 0 164 HIS 2.59 3.02 0 11 THR 3.51 -1.67 1 12 LEU 3.31 -0.81 1 13 TRP 3.25 -0.15 1 14 SER 2.91 -0.92 1 15 ARG -0.37 1.87 1 16 VAL 2.41 -1.06 1 17 THR -3.21 3.17 1 18 LYS 2.78 -1.34 1 19 PHE -2.06 2.43 1 21 SER 0.59 -0.91 1 23 TRP -5.79 4.23 1 25 PHE -6.36 4.14 1 26 TRP -1.88 -0.05 1 27 VAL 1.50 0.74 1 28 SER -1.78 0.89 1 30 THR -4.58 3.45 1 31 VAL -1.09 1.50 1 32 PHE -6.63 4.18 1 33 ILE -5.26 2.02 1 34 THR 1.69 -3.15 1 35 THR -3.56 0.32 1 36 THR 1.57 -4.08 1 37 HIS 6.05 -1.70 1 38 VAL -0.55 -0.88 1 39 VAL 1.26 -0.13 1 41 THR -1.55 0.58 1 43 VAL -3.10 0.98 1 44 LYS -1.07 0.43 1 45 GLU -4.95 2.51 1 46 PHE -2.90 1.91 1 47 PHE 3.92 -3.18 1 49 GLU 0.09 1.96 1 51 LEU 4.66 -1.08 1 52 SER 3.18 -1.40 1 53 SER -1.32 1.25 1 54 ILE -2.81 2.15 1 55 ALA -1.76 0.06 1 56 ILE -0.47 0.60 1 57 HIS -3.05 2.98 1 58 GLN 5.77 -1.85 1 59 ALA -1.24 0.58 1 61 GLU -0.55 0.57 1 62 PHE -2.60 2.76 1 63 THR -1.09 2.25 1 64 GLN -6.92 4.88 1 65 PHE -5.63 2.04 1 66 ARG -2.64 1.38 1 67 PHE -0.61 1.76 1 68 SER 1.42 -0.14 1 69 LYS -3.84 1.71 1 70 LYS 2.15 -1.36 1 71 MET -0.00 -1.10 1 72 ARG -3.57 -0.90 1 74 ASP 1.37 -1.54 1 75 LEU -2.62 1.15 1 76 THR -2.12 0.64 1 78 MET -5.12 4.13 1 79 VAL 1.97 -0.17 1 80 LEU -3.78 1.65 1 81 GLU -3.38 0.86 1 82 GLU 0.12 -2.22 1 86 GLU 2.86 -0.83 1 88 THR 3.10 -0.13 1 89 VAL 1.17 -1.63 1 91 SER -1.42 0.92 1 92 VAL -1.85 -0.81 1 94 ILE 0.96 -1.24 1 95 LYS -3.64 2.20 1 96 ARG -4.77 1.33 1 97 ASP 3.58 -0.73 1 98 SER 0.80 -0.56 1 100 GLU 0.12 0.49 1 101 LEU 0.38 -1.93 1 102 LEU -3.67 2.13 1 104 LEU -1.89 0.97 1 105 ALA -2.31 1.03 1 106 VAL -5.72 2.93 1 107 ARG 1.03 -2.04 1 108 MET -3.36 2.88 1 110 ALA -1.72 0.98 1 111 ILE 1.61 -1.16 1 112 ALA -4.67 3.57 1 113 SER -0.12 -0.19 1 114 MET -4.36 3.14 1 115 ARG -0.66 -0.60 1 116 ILE -2.27 1.16 1 117 GLN 3.69 -2.76 1 119 ARG -3.14 1.51 1 120 LEU -0.60 0.09 1 121 VAL -3.43 1.65 1 122 HIS -3.18 4.98 1 125 SER -1.90 1.12 1 127 MET -4.50 2.65 1 128 LEU 1.20 -0.13 1 129 LEU 0.10 -0.85 1 130 THR -0.23 0.07 1 132 ALA -0.08 0.13 1 133 ASN -0.34 0.08 1 134 ALA 0.32 0.00 1 135 LYS 1.46 -1.14 1 137 MET -0.45 0.18 1 138 ASP 0.57 -0.48 1 139 LEU -0.20 0.02 1 141 THR -1.86 0.79 1 142 ILE 0.81 -0.11 1 145 ASP -0.21 0.69 1 148 ALA -0.35 0.30 1 150 TYR -0.98 -0.20 1 151 VAL -7.68 3.26 1 152 HIS -3.51 3.62 1 153 LYS -0.24 -0.62 1 154 ARG -2.64 1.54 1 156 ASN -0.28 0.50 1 157 ASP -3.56 2.81 1 158 TRP -2.48 0.82 1 159 VAL -3.25 1.37 1 160 VAL -4.99 1.01 1 163 VAL -6.78 3.03 1 165 ALA -2.15 2.77 1 166 ALA -3.51 3.25 1 167 ALA -5.26 4.06 1 168 THR -1.16 0.31 1 169 LYS 3.64 -1.20 1 170 SER 0.73 -0.31 1 172 ASN 1.21 -0.37 1 173 THR -0.32 0.61 1 174 VAL -5.27 2.00 1 175 VAL -4.16 3.02 1 179 GLN -0.17 -0.11 1 180 ALA -1.83 0.86 1 182 GLU -0.65 0.47 1 184 GLU -0.63 0.43 1 185 THR 0.03 0.00 1 186 ALA -0.72 0.21 1 187 LEU 0.00 -0.04 1 188 GLU -0.26 1.40 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.68 _LACS_plot.Line_1_terminator_val_y_1 0.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 VAL -1.09 1.40 0 58 GLN 5.77 0.44 0 151 VAL -7.68 1.80 0 11 THR 3.51 0.42 1 12 LEU 3.31 -0.25 1 13 TRP 3.25 -0.46 1 14 SER 2.91 0.01 1 15 ARG -0.37 0.41 1 16 VAL 2.41 0.70 1 17 THR -3.21 0.76 1 18 LYS 2.78 0.45 1 19 PHE -2.06 -0.11 1 21 SER 0.59 0.04 1 23 TRP -5.79 0.78 1 25 PHE -6.36 0.86 1 26 TRP -1.88 0.36 1 27 VAL 1.50 -0.57 1 28 SER -1.78 -0.05 1 30 THR -4.58 0.45 1 32 PHE -6.63 0.14 1 33 ILE -5.26 1.02 1 34 THR 1.69 -0.14 1 35 THR -3.56 0.04 1 36 THR 1.57 0.37 1 37 HIS 6.05 -0.17 1 38 VAL -0.55 0.25 1 39 VAL 1.26 -0.65 1 41 THR -1.55 0.18 1 43 VAL -3.10 0.26 1 44 LYS -1.07 0.00 1 45 GLU -4.95 0.42 1 46 PHE -2.90 0.14 1 47 PHE 3.92 -0.37 1 49 GLU 0.09 -0.31 1 51 LEU 4.66 -0.52 1 52 SER 3.18 -0.26 1 53 SER -1.32 0.31 1 54 ILE -2.81 0.04 1 55 ALA -1.76 0.36 1 56 ILE -0.47 0.54 1 57 HIS -3.05 0.29 1 59 ALA -1.24 -0.17 1 61 GLU -0.55 -0.03 1 62 PHE -2.60 -0.07 1 63 THR -1.09 0.42 1 64 GLN -6.92 0.64 1 65 PHE -5.63 0.52 1 66 ARG -2.64 1.22 1 67 PHE -0.61 -0.01 1 68 SER 1.42 -0.02 1 69 LYS -3.84 0.13 1 70 LYS 2.15 -0.64 1 71 MET -0.00 -0.27 1 72 ARG -3.57 -0.18 1 74 ASP 1.37 -0.39 1 75 LEU -2.62 0.11 1 76 THR -2.12 0.39 1 78 MET -5.12 0.37 1 79 VAL 1.97 -0.33 1 80 LEU -3.78 1.09 1 81 GLU -3.38 0.21 1 82 GLU 0.12 -0.23 1 86 GLU 2.86 -0.68 1 88 THR 3.10 0.41 1 89 VAL 1.17 0.72 1 91 SER -1.42 0.84 1 92 VAL -1.85 0.38 1 93 LEU 3.09 -0.58 1 94 ILE 0.96 -0.42 1 95 LYS -3.64 0.23 1 96 ARG -4.77 0.44 1 97 ASP 3.58 -0.06 1 98 SER 0.80 -0.21 1 100 GLU 0.12 -0.44 1 101 LEU 0.38 -0.14 1 102 LEU -3.67 0.05 1 104 LEU -1.89 0.11 1 105 ALA -2.31 0.71 1 106 VAL -5.72 0.53 1 107 ARG 1.03 0.23 1 108 MET -3.36 0.45 1 110 ALA -1.72 0.12 1 111 ILE 1.61 0.24 1 112 ALA -4.67 0.28 1 113 SER -0.12 0.73 1 114 MET -4.36 0.16 1 115 ARG -0.66 0.52 1 116 ILE -2.27 0.05 1 117 GLN 3.69 -0.54 1 119 ARG -3.14 0.25 1 120 LEU -0.60 0.21 1 125 SER -1.90 0.74 1 127 MET -4.50 0.73 1 128 LEU 1.20 -0.02 1 129 LEU 0.10 0.11 1 130 THR -0.23 0.43 1 132 ALA -0.08 -0.02 1 133 ASN -0.34 -0.04 1 134 ALA 0.32 -0.05 1 135 LYS 1.46 -0.08 1 137 MET -0.45 -0.01 1 138 ASP 0.57 -0.08 1 139 LEU -0.20 0.00 1 141 THR -1.86 0.42 1 142 ILE 0.81 0.07 1 145 ASP -0.21 0.15 1 148 ALA -0.35 -0.51 1 150 TYR -0.98 0.33 1 152 HIS -3.51 0.31 1 153 LYS -0.24 -0.41 1 154 ARG -2.64 0.22 1 156 ASN -0.28 -0.15 1 157 ASP -3.56 0.31 1 158 TRP -2.48 0.11 1 159 VAL -3.25 0.40 1 160 VAL -4.99 1.18 1 163 VAL -6.78 1.13 1 164 HIS 2.59 -0.21 1 165 ALA -2.15 0.51 1 166 ALA -3.51 -0.01 1 167 ALA -5.26 0.70 1 168 THR -1.16 0.41 1 169 LYS 3.64 -0.23 1 170 SER 0.73 -0.08 1 172 ASN 1.21 0.00 1 173 THR -0.32 0.88 1 174 VAL -5.27 0.93 1 175 VAL -4.16 -0.04 1 179 GLN -0.17 0.42 1 180 ALA -1.83 -0.16 1 182 GLU -0.65 -0.14 1 184 GLU -0.63 -0.03 1 185 THR 0.03 -0.07 1 186 ALA -0.72 0.00 1 187 LEU 0.00 -0.04 1 188 GLU -0.26 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17523_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.68 _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 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.14 _LACS_plot.Line_2_terminator_val_x_2 6.04 _LACS_plot.Line_2_terminator_val_y_2 1.12 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 122 HIS -3.18 5.68 0 11 THR 3.51 1.91 1 12 LEU 3.31 1.18 1 13 TRP 3.25 3.28 1 14 SER 2.91 1.22 1 15 ARG -0.37 1.00 1 16 VAL 2.41 -0.21 1 17 THR -3.21 -1.97 1 18 LYS 2.78 -0.62 1 19 PHE -2.06 -3.11 1 21 SER 0.59 -0.59 1 23 TRP -5.79 -1.60 1 25 PHE -6.36 -1.69 1 26 TRP -1.88 -1.65 1 27 VAL 1.50 -1.45 1 28 SER -1.78 -2.45 1 30 THR -4.58 -0.68 1 31 VAL -1.09 -3.15 1 32 PHE -6.63 -1.92 1 33 ILE -5.26 -3.76 1 34 THR 1.69 -3.10 1 36 THR 1.57 2.71 1 37 HIS 6.05 1.35 1 38 VAL -0.55 -0.23 1 39 VAL 1.26 0.00 1 41 THR -1.55 1.00 1 43 VAL -3.10 -0.38 1 44 LYS -1.07 -0.94 1 45 GLU -4.95 -2.90 1 46 PHE -2.90 -0.23 1 47 PHE 3.92 0.04 1 51 LEU 4.66 0.74 1 52 SER 3.18 0.69 1 53 SER -1.32 -1.76 1 54 ILE -2.81 -2.07 1 55 ALA -1.76 -1.32 1 56 ILE -0.47 -1.10 1 57 HIS -3.05 -1.25 1 59 ALA -1.24 -0.66 1 61 GLU -0.55 -2.84 1 62 PHE -2.60 -1.44 1 63 THR -1.09 -4.77 1 64 GLN -6.92 -2.66 1 65 PHE -5.63 -1.11 1 66 ARG -2.64 -0.07 1 67 PHE -0.61 -0.24 1 68 SER 1.42 -1.36 1 69 LYS -3.84 -2.48 1 70 LYS 2.15 -1.95 1 71 MET -0.00 1.55 1 72 ARG -3.57 -1.00 1 74 ASP 1.37 -1.17 1 75 LEU -2.62 -1.05 1 76 THR -2.12 1.76 1 78 MET -5.12 -1.98 1 79 VAL 1.97 -3.03 1 80 LEU -3.78 -1.45 1 81 GLU -3.38 -1.27 1 82 GLU 0.12 -1.58 1 86 GLU 2.86 0.38 1 88 THR 3.10 -1.68 1 89 VAL 1.17 0.31 1 91 SER -1.42 -2.23 1 92 VAL -1.85 0.14 1 93 LEU 3.09 -4.79 1 94 ILE 0.96 -1.35 1 95 LYS -3.64 -1.37 1 96 ARG -4.77 2.12 1 97 ASP 3.58 0.37 1 98 SER 0.80 0.84 1 100 GLU 0.12 -2.55 1 101 LEU 0.38 -1.76 1 102 LEU -3.67 1.62 1 104 LEU -1.89 -2.19 1 105 ALA -2.31 -0.94 1 106 VAL -5.72 -2.74 1 107 ARG 1.03 0.24 1 108 MET -3.36 1.27 1 110 ALA -1.72 0.94 1 111 ILE 1.61 -0.73 1 112 ALA -4.67 -2.28 1 113 SER -0.12 -0.62 1 114 MET -4.36 -2.73 1 115 ARG -0.66 -0.65 1 116 ILE -2.27 -1.16 1 117 GLN 3.69 -0.13 1 119 ARG -3.14 -2.09 1 120 LEU -0.60 -1.57 1 121 VAL -3.43 -3.28 1 125 SER -1.90 -1.27 1 127 MET -4.50 -0.92 1 128 LEU 1.20 -0.58 1 129 LEU 0.10 -0.39 1 130 THR -0.23 0.24 1 132 ALA -0.08 -0.25 1 133 ASN -0.34 -0.26 1 134 ALA 0.32 -0.17 1 135 LYS 1.46 0.49 1 137 MET -0.45 -0.82 1 138 ASP 0.57 -0.49 1 139 LEU -0.20 -1.22 1 141 THR -1.86 -0.28 1 142 ILE 0.81 2.39 1 145 ASP -0.21 -0.20 1 148 ALA -0.35 -0.14 1 150 TYR -0.98 -0.78 1 151 VAL -7.68 -1.24 1 152 HIS -3.51 -2.59 1 153 LYS -0.24 -0.73 1 154 ARG -2.64 -0.86 1 156 ASN -0.28 -0.81 1 157 ASP -3.56 -2.34 1 158 TRP -2.48 -1.33 1 159 VAL -3.25 -1.63 1 160 VAL -4.99 -2.20 1 163 VAL -6.78 -0.20 1 164 HIS 2.59 2.38 1 165 ALA -2.15 -2.19 1 166 ALA -3.51 -4.23 1 167 ALA -5.26 -1.18 1 168 THR -1.16 0.81 1 169 LYS 3.64 1.30 1 170 SER 0.73 0.53 1 172 ASN 1.21 -0.87 1 173 THR -0.32 -0.76 1 174 VAL -5.27 -2.48 1 175 VAL -4.16 -2.18 1 179 GLN -0.17 -2.73 1 180 ALA -1.83 -0.26 1 182 GLU -0.65 0.34 1 184 GLU -0.63 0.07 1 185 THR 0.03 -0.75 1 186 ALA -0.72 -0.56 1 187 LEU 0.00 -1.28 1 188 GLU -0.26 4.21 1 stop_ save_