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 bmr19735_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _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 6.93 _LACS_plot.Line_2_terminator_val_y_2 5.60 _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 17 ILE 2.21 -1.63 0 121 VAL 2.73 -1.47 0 10 VAL -2.41 -2.66 1 12 ASP 3.53 1.20 1 13 LEU -2.53 -2.10 1 14 SER 0.82 0.40 1 16 GLU 0.93 0.02 1 18 THR -5.04 -1.62 1 19 THR 5.92 5.13 1 20 GLU 5.38 3.97 1 21 ASP 2.90 3.25 1 22 ILE 4.91 3.05 1 23 LYS 5.74 4.71 1 24 ALA 3.40 2.35 1 25 ALA 1.51 1.32 1 26 PHE 0.92 1.57 1 27 ALA 6.56 5.14 1 29 PHE 2.46 1.79 1 31 ARG 1.62 1.65 1 32 ILE -2.73 -0.75 1 33 SER 0.75 -0.06 1 34 ASP -3.32 -0.60 1 35 ALA -4.35 -0.95 1 36 ARG -2.32 -0.41 1 37 VAL 0.62 0.72 1 38 VAL 4.38 1.88 1 39 LYS -4.69 -2.30 1 40 ASP -2.05 -0.52 1 41 MET 3.13 1.86 1 42 ALA 1.76 1.84 1 43 THR -1.80 -0.36 1 45 LYS -1.11 -0.65 1 46 SER -0.11 0.02 1 47 LYS 1.32 0.44 1 49 TYR -4.39 -2.72 1 51 PHE -6.96 -1.96 1 52 VAL -2.79 -0.92 1 53 SER -1.20 -0.88 1 54 PHE -4.07 -0.80 1 55 PHE 3.20 3.61 1 56 ASN -3.12 -1.35 1 57 LYS 4.85 3.84 1 58 TRP 3.29 1.65 1 59 ASP 3.26 2.77 1 60 ALA 1.92 1.92 1 61 GLU 2.93 2.96 1 62 ASN 3.51 2.71 1 63 ALA 2.63 2.45 1 64 ILE 5.71 5.09 1 65 GLN 3.38 2.75 1 66 GLN 2.63 2.28 1 67 MET 0.98 -1.44 1 70 GLN 0.34 -0.65 1 71 TRP 0.73 0.11 1 72 LEU -1.89 -0.37 1 75 ARG -4.11 -1.11 1 76 GLN -0.88 -0.62 1 77 ILE -1.00 -0.08 1 78 ARG -4.70 -2.31 1 79 THR -5.02 -3.52 1 80 ASN -3.69 -0.59 1 81 TRP 0.87 1.39 1 82 ALA -0.34 0.12 1 83 THR 0.27 0.19 1 84 ARG -0.75 -0.64 1 85 LYS -0.08 -0.30 1 88 ALA -0.08 -0.13 1 90 LYS 0.25 0.18 1 91 SER -0.30 -0.18 1 92 THR 0.35 0.21 1 93 TYR 0.16 0.09 1 94 GLU -0.76 -0.19 1 95 SER 0.02 0.05 1 96 ASN 0.43 0.28 1 97 THR 0.30 0.22 1 98 LYS 0.24 0.10 1 99 GLN -0.29 -0.07 1 100 LEU -1.43 -0.29 1 101 SER -3.06 -1.68 1 102 TYR 5.46 4.90 1 103 ASP 3.50 2.93 1 104 GLU 1.61 1.93 1 105 VAL 4.57 4.05 1 106 VAL 4.84 3.22 1 107 ASN -0.50 0.41 1 108 GLN 0.55 0.88 1 109 SER -3.75 -2.72 1 110 SER -0.11 -0.21 1 112 SER 0.59 0.13 1 113 ASN 1.86 0.66 1 115 THR 1.88 1.78 1 116 VAL -2.92 -1.54 1 117 TYR -2.35 -1.27 1 122 THR 3.61 1.84 1 123 SER -1.78 -0.36 1 125 LEU 3.28 1.82 1 126 THR -6.57 -3.12 1 127 GLU 4.70 3.78 1 128 GLN 5.32 3.50 1 129 LEU 2.29 2.46 1 130 MET -1.71 1.88 1 131 ARG 6.19 4.73 1 132 GLN 3.76 3.04 1 133 THR 4.80 4.67 1 134 PHE 3.12 3.73 1 135 SER 6.93 6.51 1 137 PHE 1.62 1.36 1 139 GLN 0.76 0.20 1 140 ILE 0.89 0.68 1 141 MET -0.41 -1.34 1 142 GLU -3.62 -0.39 1 143 ILE -3.02 -0.48 1 144 ARG -4.13 -1.82 1 145 VAL -3.73 -2.14 1 146 PHE 0.76 -1.00 1 148 ASP 3.36 1.44 1 149 LYS -3.10 -1.29 1 151 TYR -7.02 -3.56 1 152 SER -7.09 -3.16 1 153 PHE -4.75 -1.88 1 154 VAL -2.06 -0.95 1 155 ARG -3.70 -1.08 1 156 PHE -2.61 0.48 1 157 ASN 0.36 0.40 1 158 SER -4.47 -1.66 1 159 HIS 3.73 3.87 1 160 GLU 5.15 4.22 1 161 SER 5.68 4.57 1 162 ALA 2.10 1.88 1 163 ALA 2.37 2.21 1 164 HIS 5.25 4.75 1 165 ALA 2.03 2.06 1 166 ILE 5.95 5.04 1 167 VAL 4.48 3.29 1 168 SER 2.39 3.11 1 169 VAL 2.07 1.10 1 170 ASN 3.57 4.42 1 172 THR -1.59 -0.28 1 173 THR -0.31 -0.53 1 174 ILE -1.40 -0.29 1 175 GLU 2.60 0.19 1 177 HIS -2.50 -0.83 1 178 VAL 2.87 1.11 1 179 VAL -2.91 -1.97 1 180 LYS -4.20 -2.04 1 182 TYR -1.94 -1.89 1 183 TRP 0.49 1.14 1 185 LYS 0.75 1.58 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19735_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 4.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _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 6.93 _LACS_plot.Line_2_terminator_val_y_2 -1.33 _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 17 ILE 2.21 -3.84 0 121 VAL 2.73 -4.20 0 10 VAL -2.41 -0.25 1 12 ASP 3.53 -2.33 1 13 LEU -2.53 0.43 1 14 SER 0.82 -0.42 1 16 GLU 0.93 -0.91 1 18 THR -5.04 3.42 1 19 THR 5.92 -0.79 1 20 GLU 5.38 -1.41 1 21 ASP 2.90 0.35 1 22 ILE 4.91 -1.86 1 23 LYS 5.74 -1.03 1 24 ALA 3.40 -1.05 1 25 ALA 1.51 -0.19 1 26 PHE 0.92 0.65 1 27 ALA 6.56 -1.42 1 29 PHE 2.46 -0.67 1 31 ARG 1.62 0.03 1 32 ILE -2.73 1.98 1 33 SER 0.75 -0.81 1 34 ASP -3.32 2.72 1 35 ALA -4.35 3.40 1 36 ARG -2.32 1.91 1 37 VAL 0.62 0.10 1 38 VAL 4.38 -2.50 1 39 LYS -4.69 2.39 1 40 ASP -2.05 1.53 1 41 MET 3.13 -1.27 1 42 ALA 1.76 0.08 1 43 THR -1.80 1.44 1 45 LYS -1.11 0.46 1 46 SER -0.11 0.13 1 47 LYS 1.32 -0.88 1 49 TYR -4.39 1.67 1 51 PHE -6.96 5.00 1 52 VAL -2.79 1.87 1 53 SER -1.20 0.32 1 54 PHE -4.07 3.27 1 55 PHE 3.20 0.41 1 56 ASN -3.12 1.77 1 57 LYS 4.85 -1.01 1 58 TRP 3.29 -1.64 1 59 ASP 3.26 -0.49 1 60 ALA 1.92 0.00 1 61 GLU 2.93 0.03 1 62 ASN 3.51 -0.80 1 63 ALA 2.63 -0.18 1 64 ILE 5.71 -0.62 1 65 GLN 3.38 -0.63 1 66 GLN 2.63 -0.35 1 67 MET 0.98 -2.42 1 70 GLN 0.34 -0.99 1 71 TRP 0.73 -0.62 1 72 LEU -1.89 1.52 1 75 ARG -4.11 3.00 1 76 GLN -0.88 0.26 1 77 ILE -1.00 0.92 1 78 ARG -4.70 2.39 1 79 THR -5.02 1.50 1 80 ASN -3.69 3.10 1 81 TRP 0.87 0.52 1 82 ALA -0.34 0.46 1 83 THR 0.27 -0.08 1 84 ARG -0.75 0.11 1 85 LYS -0.08 -0.22 1 88 ALA -0.08 -0.05 1 90 LYS 0.25 -0.07 1 91 SER -0.30 0.12 1 92 THR 0.35 -0.14 1 93 TYR 0.16 -0.07 1 94 GLU -0.76 0.57 1 95 SER 0.02 0.03 1 96 ASN 0.43 -0.15 1 97 THR 0.30 -0.08 1 98 LYS 0.24 -0.14 1 99 GLN -0.29 0.22 1 100 LEU -1.43 1.14 1 101 SER -3.06 1.38 1 102 TYR 5.46 -0.56 1 103 ASP 3.50 -0.57 1 104 GLU 1.61 0.32 1 105 VAL 4.57 -0.52 1 106 VAL 4.84 -1.62 1 107 ASN -0.50 0.91 1 108 GLN 0.55 0.33 1 109 SER -3.75 1.03 1 110 SER -0.11 -0.10 1 112 SER 0.59 -0.46 1 113 ASN 1.86 -1.20 1 115 THR 1.88 -0.10 1 116 VAL -2.92 1.38 1 117 TYR -2.35 1.08 1 122 THR 3.61 -1.77 1 123 SER -1.78 1.42 1 125 LEU 3.28 -1.46 1 126 THR -6.57 3.45 1 127 GLU 4.70 -0.92 1 128 GLN 5.32 -1.82 1 129 LEU 2.29 0.17 1 130 MET -1.71 3.59 1 131 ARG 6.19 -1.46 1 132 GLN 3.76 -0.72 1 133 THR 4.80 -0.13 1 134 PHE 3.12 0.61 1 135 SER 6.93 -0.42 1 137 PHE 1.62 -0.26 1 139 GLN 0.76 -0.56 1 140 ILE 0.89 -0.21 1 141 MET -0.41 -0.93 1 142 GLU -3.62 3.23 1 143 ILE -3.02 2.54 1 144 ARG -4.13 2.31 1 145 VAL -3.73 1.59 1 146 PHE 0.76 -1.76 1 148 ASP 3.36 -1.92 1 149 LYS -3.10 1.81 1 151 TYR -7.02 3.46 1 152 SER -7.09 3.93 1 153 PHE -4.75 2.87 1 154 VAL -2.06 1.11 1 155 ARG -3.70 2.62 1 156 PHE -2.61 3.09 1 157 ASN 0.36 0.04 1 158 SER -4.47 2.81 1 159 HIS 3.73 0.14 1 160 GLU 5.15 -0.93 1 161 SER 5.68 -1.11 1 162 ALA 2.10 -0.22 1 163 ALA 2.37 -0.16 1 164 HIS 5.25 -0.50 1 165 ALA 2.03 0.03 1 166 ILE 5.95 -0.91 1 167 VAL 4.48 -1.19 1 168 SER 2.39 0.72 1 169 VAL 2.07 -0.97 1 170 ASN 3.57 0.85 1 172 THR -1.59 1.31 1 173 THR -0.31 -0.22 1 174 ILE -1.40 1.11 1 175 GLU 2.60 -2.41 1 177 HIS -2.50 1.67 1 178 VAL 2.87 -1.76 1 179 VAL -2.91 0.94 1 180 LYS -4.20 2.16 1 182 TYR -1.94 0.05 1 183 TRP 0.49 0.65 1 185 LYS 0.75 0.83 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19735_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 0.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 6.93 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 ALA 2.63 -1.90 0 165 ALA 2.03 -2.00 0 10 VAL -2.41 0.40 1 12 ASP 3.53 -0.43 1 13 LEU -2.53 -0.04 1 14 SER 0.82 -0.33 1 16 GLU 0.93 -0.01 1 17 ILE 2.21 0.14 1 18 THR -5.04 0.40 1 19 THR 5.92 -0.17 1 20 GLU 5.38 -0.47 1 21 ASP 2.90 -0.18 1 22 ILE 4.91 -0.12 1 23 LYS 5.74 -0.58 1 24 ALA 3.40 -0.14 1 25 ALA 1.51 -0.11 1 26 PHE 0.92 0.24 1 27 ALA 6.56 -0.06 1 29 PHE 2.46 -0.36 1 31 ARG 1.62 -0.02 1 32 ILE -2.73 0.08 1 33 SER 0.75 -0.29 1 34 ASP -3.32 0.01 1 35 ALA -4.35 0.66 1 36 ARG -2.32 0.35 1 37 VAL 0.62 -0.24 1 38 VAL 4.38 -0.47 1 39 LYS -4.69 0.44 1 40 ASP -2.05 -0.10 1 41 MET 3.13 -0.23 1 42 ALA 1.76 0.05 1 43 THR -1.80 0.11 1 45 LYS -1.11 0.01 1 46 SER -0.11 -0.28 1 47 LYS 1.32 0.09 1 49 TYR -4.39 0.52 1 51 PHE -6.96 1.18 1 52 VAL -2.79 0.16 1 53 SER -1.20 1.07 1 54 PHE -4.07 0.41 1 55 PHE 3.20 -0.48 1 56 ASN -3.12 0.27 1 57 LYS 4.85 -1.46 1 58 TRP 3.29 -0.18 1 59 ASP 3.26 -0.25 1 60 ALA 1.92 -1.32 1 61 GLU 2.93 -0.85 1 62 ASN 3.51 -0.43 1 64 ILE 5.71 -1.15 1 65 GLN 3.38 -0.41 1 66 GLN 2.63 -0.20 1 67 MET 0.98 0.28 1 70 GLN 0.34 -0.01 1 71 TRP 0.73 -0.15 1 72 LEU -1.89 0.37 1 75 ARG -4.11 0.36 1 76 GLN -0.88 -0.38 1 77 ILE -1.00 0.48 1 78 ARG -4.70 0.62 1 79 THR -5.02 1.31 1 80 ASN -3.69 -0.04 1 81 TRP 0.87 0.23 1 82 ALA -0.34 0.36 1 83 THR 0.27 0.01 1 84 ARG -0.75 -0.06 1 85 LYS -0.08 -0.31 1 88 ALA -0.08 -0.08 1 90 LYS 0.25 -0.03 1 91 SER -0.30 0.03 1 92 THR 0.35 -0.05 1 93 TYR 0.16 0.02 1 94 GLU -0.76 -0.08 1 95 SER 0.02 -0.05 1 96 ASN 0.43 0.06 1 97 THR 0.30 -0.02 1 98 LYS 0.24 0.00 1 99 GLN -0.29 0.02 1 100 LEU -1.43 0.13 1 101 SER -3.06 0.27 1 102 TYR 5.46 -0.77 1 103 ASP 3.50 -0.52 1 104 GLU 1.61 -0.17 1 105 VAL 4.57 -0.27 1 106 VAL 4.84 -0.36 1 107 ASN -0.50 0.35 1 108 GLN 0.55 -0.06 1 109 SER -3.75 -0.28 1 110 SER -0.11 -0.28 1 112 SER 0.59 -0.18 1 113 ASN 1.86 -0.05 1 115 THR 1.88 0.78 1 116 VAL -2.92 0.15 1 117 TYR -2.35 0.39 1 121 VAL 2.73 -0.40 1 122 THR 3.61 -0.57 1 123 SER -1.78 0.15 1 125 LEU 3.28 -0.37 1 126 THR -6.57 0.28 1 127 GLU 4.70 -0.71 1 128 GLN 5.32 -0.34 1 129 LEU 2.29 -0.11 1 130 MET -1.71 0.11 1 131 ARG 6.19 -0.55 1 132 GLN 3.76 -0.26 1 133 THR 4.80 -0.59 1 134 PHE 3.12 0.52 1 135 SER 6.93 -0.16 1 137 PHE 1.62 -0.33 1 139 GLN 0.76 -0.01 1 140 ILE 0.89 -0.51 1 141 MET -0.41 0.23 1 142 GLU -3.62 0.04 1 143 ILE -3.02 0.51 1 144 ARG -4.13 0.36 1 145 VAL -3.73 0.29 1 146 PHE 0.76 -0.04 1 148 ASP 3.36 -0.22 1 149 LYS -3.10 0.25 1 151 TYR -7.02 1.27 1 152 SER -7.09 0.72 1 153 PHE -4.75 1.20 1 154 VAL -2.06 0.15 1 155 ARG -3.70 0.83 1 156 PHE -2.61 0.75 1 157 ASN 0.36 0.09 1 158 SER -4.47 0.62 1 159 HIS 3.73 -0.06 1 160 GLU 5.15 -0.25 1 161 SER 5.68 -0.19 1 162 ALA 2.10 -1.02 1 163 ALA 2.37 -0.91 1 164 HIS 5.25 -0.46 1 166 ILE 5.95 -1.01 1 167 VAL 4.48 -0.49 1 168 SER 2.39 -0.09 1 169 VAL 2.07 -0.22 1 170 ASN 3.57 -0.57 1 172 THR -1.59 0.20 1 173 THR -0.31 0.73 1 174 ILE -1.40 0.02 1 175 GLU 2.60 -0.62 1 177 HIS -2.50 0.19 1 178 VAL 2.87 0.21 1 179 VAL -2.91 0.98 1 180 LYS -4.20 0.79 1 182 TYR -1.94 0.00 1 183 TRP 0.49 -0.02 1 185 LYS 0.75 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19735_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.45 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.67 _LACS_plot.Line_2_terminator_val_x_2 6.18 _LACS_plot.Line_2_terminator_val_y_2 1.67 _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 12 ASP 3.53 -2.35 0 151 TYR -7.02 -3.95 0 18 THR -5.04 1.56 0 38 VAL 4.38 -2.37 0 10 VAL -2.41 -2.80 1 13 LEU -2.53 0.72 1 16 GLU 0.93 0.16 1 17 ILE 2.21 0.66 1 19 THR 5.92 0.66 1 20 GLU 5.38 2.58 1 21 ASP 2.90 3.48 1 22 ILE 4.91 1.06 1 23 LYS 5.74 1.19 1 24 ALA 3.40 2.46 1 25 ALA 1.51 -0.02 1 26 PHE 0.92 -0.40 1 29 PHE 2.46 -1.24 1 31 ARG 1.62 0.70 1 32 ILE -2.73 0.28 1 33 SER 0.75 -0.06 1 34 ASP -3.32 -3.57 1 35 ALA -4.35 -1.24 1 36 ARG -2.32 -1.94 1 37 VAL 0.62 -0.42 1 39 LYS -4.69 -0.70 1 40 ASP -2.05 1.08 1 41 MET 3.13 1.03 1 42 ALA 1.76 1.79 1 43 THR -1.80 1.82 1 46 SER -0.11 2.51 1 47 LYS 1.32 0.73 1 49 TYR -4.39 -3.66 1 51 PHE -6.96 -1.20 1 52 VAL -2.79 -2.62 1 53 SER -1.20 -1.82 1 54 PHE -4.07 0.06 1 55 PHE 3.20 -0.01 1 56 ASN -3.12 -0.45 1 57 LYS 4.85 0.49 1 58 TRP 3.29 1.72 1 59 ASP 3.26 0.22 1 60 ALA 1.92 0.15 1 61 GLU 2.93 2.33 1 62 ASN 3.51 1.11 1 63 ALA 2.63 1.56 1 64 ILE 5.71 2.67 1 65 GLN 3.38 2.47 1 66 GLN 2.63 2.18 1 67 MET 0.98 1.15 1 70 GLN 0.34 -1.02 1 71 TRP 0.73 0.39 1 75 ARG -4.11 -2.58 1 76 GLN -0.88 0.15 1 77 ILE -1.00 -0.37 1 78 ARG -4.70 -1.09 1 79 THR -5.02 -0.54 1 80 ASN -3.69 -0.93 1 81 TRP 0.87 1.30 1 82 ALA -0.34 -0.28 1 83 THR 0.27 -0.14 1 84 ARG -0.75 -1.02 1 90 LYS 0.25 0.06 1 92 THR 0.35 -0.45 1 93 TYR 0.16 -0.19 1 94 GLU -0.76 -0.45 1 95 SER 0.02 -0.18 1 96 ASN 0.43 0.19 1 97 THR 0.30 -0.36 1 98 LYS 0.24 -0.42 1 99 GLN -0.29 -0.09 1 100 LEU -1.43 -1.03 1 101 SER -3.06 0.55 1 102 TYR 5.46 -0.56 1 103 ASP 3.50 1.43 1 104 GLU 1.61 2.21 1 105 VAL 4.57 3.86 1 106 VAL 4.84 -0.25 1 107 ASN -0.50 0.11 1 108 GLN 0.55 -1.19 1 109 SER -3.75 -1.84 1 112 SER 0.59 0.29 1 113 ASN 1.86 1.31 1 115 THR 1.88 -2.01 1 116 VAL -2.92 -1.88 1 117 TYR -2.35 -2.23 1 121 VAL 2.73 -1.21 1 122 THR 3.61 -0.94 1 123 SER -1.78 -1.16 1 125 LEU 3.28 -2.27 1 126 THR -6.57 -0.33 1 127 GLU 4.70 1.42 1 128 GLN 5.32 1.84 1 129 LEU 2.29 3.60 1 130 MET -1.71 1.58 1 131 ARG 6.19 2.87 1 132 GLN 3.76 2.00 1 133 THR 4.80 0.08 1 134 PHE 3.12 0.22 1 137 PHE 1.62 -0.37 1 139 GLN 0.76 -0.83 1 140 ILE 0.89 0.07 1 141 MET -0.41 0.42 1 142 GLU -3.62 -3.52 1 143 ILE -3.02 -1.87 1 144 ARG -4.13 -0.81 1 145 VAL -3.73 -2.67 1 148 ASP 3.36 0.42 1 149 LYS -3.10 0.81 1 152 SER -7.09 -2.05 1 153 PHE -4.75 -0.64 1 154 VAL -2.06 -3.22 1 155 ARG -3.70 -0.46 1 156 PHE -2.61 -1.18 1 157 ASN 0.36 -0.37 1 158 SER -4.47 -0.59 1 159 HIS 3.73 2.53 1 160 GLU 5.15 2.19 1 161 SER 5.68 -0.19 1 162 ALA 2.10 -0.57 1 163 ALA 2.37 1.28 1 164 HIS 5.25 2.90 1 165 ALA 2.03 0.58 1 166 ILE 5.95 1.32 1 167 VAL 4.48 1.71 1 168 SER 2.39 0.57 1 169 VAL 2.07 1.35 1 170 ASN 3.57 0.55 1 172 THR -1.59 -2.59 1 173 THR -0.31 0.14 1 174 ILE -1.40 -1.25 1 175 GLU 2.60 -0.81 1 177 HIS -2.50 -0.62 1 178 VAL 2.87 0.99 1 179 VAL -2.91 -0.02 1 180 LYS -4.20 -0.71 1 182 TYR -1.94 -1.92 1 183 TRP 0.49 1.39 1 stop_ save_