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 bmr4978_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 -4.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.87 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 3.09 _LACS_plot.Y_axis_chem_shift_offset 0.79 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 GLN -2.40 1.25 0 143 LEU 0.04 2.40 0 82 TYR -9.02 -4.93 0 109 ARG 7.72 2.36 0 57 LEU 1.36 -3.31 0 37 ALA -4.57 -5.63 0 110 VAL -1.17 -4.54 0 10 ALA 0.12 -0.94 1 11 ALA 0.36 -0.70 1 13 ASP 0.73 -0.06 1 14 ALA 0.35 -0.71 1 15 GLU 0.26 -0.58 1 16 ALA -3.63 -2.11 1 17 ILE -1.90 -3.21 1 18 ALA -3.63 -2.34 1 19 PHE -1.46 -0.75 1 20 ASP -0.91 -1.70 1 22 ARG -0.72 -2.56 1 23 THR 0.26 0.07 1 24 TYR -3.86 -4.93 1 26 GLU -2.56 -2.70 1 27 TYR -3.87 -2.12 1 28 HIS 1.19 0.31 1 29 ASN 2.21 -0.13 1 30 ALA -2.93 -2.11 1 31 VAL -4.45 -1.73 1 32 THR -0.44 -3.21 1 38 LEU -4.97 -1.90 1 40 SER 1.98 -1.82 1 41 ASN 1.97 -0.37 1 43 PHE -4.74 -2.62 1 44 GLU -4.90 -1.99 1 45 LEU 0.42 0.21 1 46 SER -2.00 -1.35 1 47 ILE -6.13 -2.98 1 48 LYS -1.97 -1.83 1 49 THR 0.04 -0.86 1 50 GLU -2.56 -2.23 1 51 ALA 0.11 -0.24 1 52 THR -0.20 -1.10 1 53 GLN -3.80 -3.44 1 55 LEU 1.66 0.04 1 56 ILE -3.08 -1.10 1 58 TRP 2.57 1.09 1 59 SER -4.11 -2.29 1 63 LEU 0.89 -1.20 1 64 GLU -3.49 -1.05 1 65 ARG 5.14 1.42 1 66 SER -1.30 -0.88 1 67 ASP 0.26 -0.53 1 68 TYR -3.40 -1.65 1 69 ILE -3.22 -1.80 1 72 ALA -5.52 -2.82 1 73 ILE -0.03 -0.63 1 74 VAL -1.88 -1.50 1 75 ASP 3.31 1.11 1 77 PHE -3.33 -1.68 1 78 VAL 3.05 0.38 1 79 GLN -0.29 -0.39 1 80 MET 1.40 -1.50 1 81 MET 5.86 1.55 1 83 ASP 3.08 0.88 1 84 LEU -2.63 -2.37 1 87 LYS -1.68 -0.06 1 89 VAL -2.35 -2.20 1 90 VAL -2.35 -2.20 1 91 LEU -1.69 -2.37 1 92 ARG -1.20 -1.16 1 93 SER 0.11 -1.35 1 94 THR -0.20 -0.16 1 95 VAL -1.18 -0.74 1 97 ILE -6.84 -5.09 1 98 ASN 4.78 -0.37 1 99 THR -1.38 -1.57 1 100 ASN 0.09 -0.84 1 101 HIS -3.94 -2.00 1 102 TRP 2.10 0.86 1 103 THR -1.14 0.31 1 104 HIS -0.22 0.78 1 105 ILE -1.91 -0.63 1 106 LYS -0.60 0.75 1 107 ALA -5.50 -2.58 1 108 TYR 0.82 -2.59 1 111 GLN 0.65 0.78 1 112 ARG -4.95 -0.69 1 113 GLU -2.33 0.35 1 115 SER -2.24 -2.52 1 116 LEU -5.67 -2.37 1 117 GLN -2.16 -0.62 1 118 VAL 0.23 -1.73 1 120 ASN -0.61 -1.54 1 121 GLU -0.21 -1.52 1 122 ALA 1.36 -0.81 1 124 ILE -0.51 -2.51 1 125 THR -5.12 -3.44 1 127 SER -3.64 -2.52 1 128 SER 4.72 1.18 1 130 LEU 1.83 0.91 1 132 ALA -2.93 -1.64 1 133 THR 2.06 -0.16 1 134 GLN -4.73 -2.26 1 135 LEU 0.67 -0.36 1 136 ASP -0.68 -1.94 1 138 ASP -2.31 -2.87 1 140 ALA -1.29 -0.47 1 141 LEU -3.56 -1.20 1 142 TRP -3.53 -2.19 1 146 MET -3.75 -3.14 1 147 GLU -0.69 0.35 1 148 ARG -1.19 -1.39 1 149 LEU -2.15 -3.54 1 150 SER -4.11 -2.29 1 153 HIS 3.30 2.66 1 154 LYS 2.21 -1.36 1 155 LEU 0.09 0.34 1 157 LYS 4.79 2.16 1 158 ALA 0.35 2.34 1 159 TYR 5.04 2.57 1 160 SER -0.12 -1.58 1 161 THR -0.91 -1.10 1 163 PHE 0.63 0.19 1 164 ILE -0.97 -1.80 1 167 ILE -2.37 -0.16 1 168 ARG -4.24 -2.10 1 169 ASP 2.83 0.17 1 170 VAL 2.11 -0.79 1 171 ILE -1.44 -1.80 1 172 VAL -1.64 -2.20 1 173 ASP 4.48 1.82 1 174 ARG 5.84 1.42 1 175 GLN -2.86 -2.26 1 177 LEU 0.19 -1.43 1 178 HIS 1.90 -0.86 1 179 LEU 4.18 2.56 1 180 VAL 4.21 2.25 1 181 GLU 4.70 3.16 1 182 ASP 1.90 0.64 1 183 ALA 1.52 -0.47 1 184 LEU -0.28 -0.96 1 185 ASN -3.42 -0.60 1 186 ASN 2.87 1.67 1 188 THR 2.37 0.54 1 189 ILE -0.03 -2.74 1 190 LEU -2.86 -2.60 1 191 HIS 0.23 0.53 1 193 SER 0.58 -0.41 1 194 ALA 0.12 -0.70 1 195 LYS 1.51 0.75 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4978_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 4.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 -4.63 _LACS_plot.Y_axis_chem_shift_offset 0.79 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 39 GLN -2.40 3.65 0 143 LEU 0.04 2.36 0 82 TYR -9.02 4.09 0 109 ARG 7.72 -5.36 0 57 LEU 1.36 -4.67 0 37 ALA -4.57 -1.06 0 110 VAL -1.17 -3.37 0 10 ALA 0.12 -1.06 1 11 ALA 0.36 -1.06 1 13 ASP 0.73 -0.79 1 14 ALA 0.35 -1.06 1 15 GLU 0.26 -0.84 1 16 ALA -3.63 1.52 1 17 ILE -1.90 -1.31 1 18 ALA -3.63 1.29 1 19 PHE -1.46 0.71 1 20 ASP -0.91 -0.79 1 22 ARG -0.72 -1.84 1 23 THR 0.26 -0.19 1 24 TYR -3.86 -1.07 1 26 GLU -2.56 -0.14 1 27 TYR -3.87 1.75 1 28 HIS 1.19 -0.88 1 29 ASN 2.21 -2.34 1 30 ALA -2.93 0.82 1 31 VAL -4.45 2.72 1 32 THR -0.44 -2.77 1 38 LEU -4.97 3.07 1 40 SER 1.98 -3.80 1 41 ASN 1.97 -2.34 1 43 PHE -4.74 2.12 1 44 GLU -4.90 2.91 1 45 LEU 0.42 -0.21 1 46 SER -2.00 0.65 1 47 ILE -6.13 3.15 1 48 LYS -1.97 0.14 1 49 THR 0.04 -0.90 1 50 GLU -2.56 0.33 1 51 ALA 0.11 -0.35 1 52 THR -0.20 -0.90 1 53 GLN -3.80 0.36 1 55 LEU 1.66 -1.62 1 56 ILE -3.08 1.98 1 58 TRP 2.57 -1.48 1 59 SER -4.11 1.82 1 63 LEU 0.89 -2.09 1 64 GLU -3.49 2.44 1 65 ARG 5.14 -3.72 1 66 SER -1.30 0.42 1 67 ASP 0.26 -0.79 1 68 TYR -3.40 1.75 1 69 ILE -3.22 1.42 1 72 ALA -5.52 2.70 1 73 ILE -0.03 -0.60 1 74 VAL -1.88 0.38 1 75 ASP 3.31 -2.20 1 77 PHE -3.33 1.65 1 78 VAL 3.05 -2.67 1 79 GLN -0.29 -0.10 1 80 MET 1.40 -2.90 1 81 MET 5.86 -4.31 1 83 ASP 3.08 -2.20 1 84 LEU -2.63 0.26 1 87 LYS -1.68 1.62 1 89 VAL -2.35 0.15 1 90 VAL -2.35 0.15 1 91 LEU -1.69 -0.68 1 92 ARG -1.20 0.04 1 93 SER 0.11 -1.46 1 94 THR -0.20 0.04 1 95 VAL -1.18 0.44 1 97 ILE -6.84 1.75 1 98 ASN 4.78 -5.15 1 99 THR -1.38 -0.19 1 100 ASN 0.09 -0.93 1 101 HIS -3.94 1.94 1 102 TRP 2.10 -1.24 1 103 THR -1.14 1.45 1 104 HIS -0.22 1.00 1 105 ILE -1.91 1.28 1 106 LYS -0.60 1.35 1 107 ALA -5.50 2.92 1 108 TYR 0.82 -3.41 1 111 GLN 0.65 0.13 1 112 ARG -4.95 4.26 1 113 GLU -2.33 2.68 1 115 SER -2.24 -0.28 1 116 LEU -5.67 3.30 1 117 GLN -2.16 1.54 1 118 VAL 0.23 -1.96 1 120 ASN -0.61 -0.93 1 121 GLU -0.21 -1.31 1 122 ALA 1.36 -2.17 1 124 ILE -0.51 -2.00 1 125 THR -5.12 1.68 1 127 SER -3.64 1.12 1 128 SER 4.72 -3.54 1 130 LEU 1.83 -0.92 1 132 ALA -2.93 1.29 1 133 THR 2.06 -2.22 1 134 GLN -4.73 2.47 1 135 LEU 0.67 -1.03 1 136 ASP -0.68 -1.26 1 138 ASP -2.31 -0.56 1 140 ALA -1.29 0.82 1 141 LEU -3.56 2.36 1 142 TRP -3.53 1.34 1 146 MET -3.75 0.61 1 147 GLU -0.69 1.04 1 148 ARG -1.19 -0.20 1 149 LEU -2.15 -1.39 1 150 SER -4.11 1.82 1 153 HIS 3.30 -0.64 1 154 LYS 2.21 -3.57 1 155 LEU 0.09 0.25 1 157 LYS 4.79 -2.63 1 158 ALA 0.35 1.99 1 159 TYR 5.04 -2.47 1 160 SER -0.12 -1.46 1 161 THR -0.91 -0.19 1 163 PHE 0.63 -0.44 1 164 ILE -0.97 -0.83 1 167 ILE -2.37 2.21 1 168 ARG -4.24 2.14 1 169 ASP 2.83 -2.66 1 170 VAL 2.11 -2.90 1 171 ILE -1.44 -0.36 1 172 VAL -1.64 -0.56 1 173 ASP 4.48 -2.66 1 174 ARG 5.84 -4.42 1 175 GLN -2.86 0.60 1 177 LEU 0.19 -1.62 1 178 HIS 1.90 -2.76 1 179 LEU 4.18 -1.62 1 180 VAL 4.21 -1.96 1 181 GLU 4.70 -1.54 1 182 ASP 1.90 -1.26 1 183 ALA 1.52 -1.99 1 184 LEU -0.28 -0.68 1 185 ASN -3.42 2.82 1 186 ASN 2.87 -1.20 1 188 THR 2.37 -1.83 1 189 ILE -0.03 -2.71 1 190 LEU -2.86 0.26 1 191 HIS 0.23 0.30 1 193 SER 0.58 -0.99 1 194 ALA 0.12 -0.82 1 195 LYS 1.51 -0.76 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4978_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.02 _LACS_plot.Line_1_terminator_val_y_1 0.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.00 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.32 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 -0.44 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 TYR -9.02 -0.46 0 10 ALA 0.12 0.13 1 11 ALA 0.36 -0.01 1 13 ASP 0.73 0.08 1 14 ALA 0.35 -0.14 1 15 GLU 0.26 -0.09 1 16 ALA -3.63 0.67 1 17 ILE -1.90 0.46 1 18 ALA -3.63 0.85 1 19 PHE -1.46 -0.17 1 20 ASP -0.91 -0.11 1 22 ARG -0.72 0.11 1 23 THR 0.26 -0.35 1 24 TYR -3.86 1.07 1 26 GLU -2.56 0.38 1 27 TYR -3.87 -0.01 1 28 HIS 1.19 0.80 1 29 ASN 2.21 0.97 1 30 ALA -2.93 -0.05 1 37 ALA -4.57 0.76 1 38 LEU -4.97 1.07 1 39 GLN -2.40 0.83 1 40 SER 1.98 1.02 1 41 ASN 1.97 0.88 1 43 PHE -4.74 1.00 1 44 GLU -4.90 1.09 1 45 LEU 0.42 0.74 1 46 SER -2.00 1.42 1 47 ILE -6.13 1.56 1 48 LYS -1.97 -0.14 1 49 THR 0.04 0.28 1 50 GLU -2.56 -0.17 1 51 ALA 0.11 -0.23 1 52 THR -0.20 -0.44 1 53 GLN -3.80 0.92 1 55 LEU 1.66 1.05 1 56 ILE -3.08 1.01 1 63 LEU 0.89 0.74 1 64 GLU -3.49 0.46 1 65 ARG 5.14 0.38 1 66 SER -1.30 0.25 1 67 ASP 0.26 -0.10 1 68 TYR -3.40 -0.82 1 69 ILE -3.22 0.64 1 72 ALA -5.52 0.40 1 73 ILE -0.03 -0.17 1 74 VAL -1.88 0.33 1 75 ASP 3.31 -0.37 1 77 PHE -3.33 0.10 1 78 VAL 3.05 0.29 1 79 GLN -0.29 0.47 1 80 MET 1.40 -0.39 1 81 MET 5.86 0.08 1 83 ASP 3.08 0.08 1 84 LEU -2.63 -0.07 1 87 LYS -1.68 -0.43 1 89 VAL -2.35 0.60 1 90 VAL -2.35 0.51 1 91 LEU -1.69 0.29 1 92 ARG -1.20 0.29 1 93 SER 0.11 0.16 1 94 THR -0.20 -0.08 1 95 VAL -1.18 0.10 1 97 ILE -6.84 0.52 1 98 ASN 4.78 -0.05 1 99 THR -1.38 -0.35 1 100 ASN 0.09 -0.01 1 101 HIS -3.94 0.19 1 102 TRP 2.10 0.06 1 103 THR -1.14 0.28 1 104 HIS -0.22 0.44 1 105 ILE -1.91 0.46 1 106 LYS -0.60 0.58 1 107 ALA -5.50 1.03 1 108 TYR 0.82 0.72 1 109 ARG 7.72 0.02 1 110 VAL -1.17 0.33 1 111 GLN 0.65 0.20 1 112 ARG -4.95 0.38 1 115 SER -2.24 0.79 1 116 LEU -5.67 0.74 1 117 GLN -2.16 0.20 1 118 VAL 0.23 0.60 1 120 ASN -0.61 0.16 1 121 GLU -0.21 0.01 1 122 ALA 1.36 -0.53 1 124 ILE -0.51 0.10 1 125 THR -5.12 1.18 1 127 SER -3.64 1.24 1 128 SER 4.72 -0.51 1 130 LEU 1.83 0.11 1 132 ALA -2.93 -0.23 1 133 THR 2.06 0.28 1 134 GLN -4.73 -0.25 1 135 LEU 0.67 -0.06 1 136 ASP -0.68 0.08 1 138 ASP -2.31 0.08 1 140 ALA -1.29 0.76 1 141 LEU -3.56 0.66 1 142 TRP -3.53 1.23 1 143 LEU 0.04 1.19 1 146 MET -3.75 -0.84 1 147 GLU -0.69 -0.44 1 148 ARG -1.19 -0.16 1 149 LEU -2.15 0.20 1 150 SER -4.11 0.25 1 153 HIS 3.30 0.00 1 154 LYS 2.21 -0.32 1 155 LEU 0.09 -0.59 1 157 LYS 4.79 0.40 1 158 ALA 0.35 0.40 1 159 TYR 5.04 -0.73 1 160 SER -0.12 -0.02 1 161 THR -0.91 0.01 1 163 PHE 0.63 -0.53 1 164 ILE -0.97 -0.08 1 167 ILE -2.37 1.18 1 168 ARG -4.24 0.56 1 169 ASP 2.83 -0.46 1 170 VAL 2.11 0.58 1 171 ILE -1.44 0.36 1 172 VAL -1.64 0.51 1 173 ASP 4.48 -0.37 1 174 ARG 5.84 -0.97 1 175 GLN -2.86 0.20 1 177 LEU 0.19 0.83 1 178 HIS 1.90 0.71 1 179 LEU 4.18 -0.34 1 180 VAL 4.21 -0.21 1 181 GLU 4.70 -0.35 1 182 ASP 1.90 0.35 1 183 ALA 1.52 -0.33 1 184 LEU -0.28 -0.07 1 185 ASN -3.42 -0.02 1 186 ASN 2.87 -0.60 1 188 THR 2.37 -0.26 1 189 ILE -0.03 -0.17 1 190 LEU -2.86 0.20 1 191 HIS 0.23 0.08 1 193 SER 0.58 -0.47 1 194 ALA 0.12 -0.05 1 195 LYS 1.51 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4978_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.84 _LACS_plot.Line_1_terminator_val_y_1 -2.14 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.37 _LACS_plot.Line_2_terminator_val_x_2 7.72 _LACS_plot.Line_2_terminator_val_y_2 0.01 _LACS_plot.Y_axis_chem_shift_offset 1.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 ARG 7.72 -0.72 0 107 ALA -5.50 -6.72 0 195 LYS 1.51 5.24 0 10 ALA 0.12 -0.25 1 11 ALA 0.36 0.59 1 13 ASP 0.73 -0.02 1 14 ALA 0.35 -0.11 1 15 GLU 0.26 -1.02 1 16 ALA -3.63 -1.24 1 17 ILE -1.90 -1.80 1 18 ALA -3.63 -2.64 1 19 PHE -1.46 0.91 1 20 ASP -0.91 0.12 1 22 ARG -0.72 -1.28 1 23 THR 0.26 -3.48 1 24 TYR -3.86 -2.71 1 26 GLU -2.56 -3.55 1 27 TYR -3.87 1.51 1 28 HIS 1.19 -0.91 1 29 ASN 2.21 -0.89 1 30 ALA -2.93 -5.18 1 31 VAL -4.45 -0.30 1 32 THR -0.44 -3.90 1 37 ALA -4.57 -1.24 1 38 LEU -4.97 -3.43 1 39 GLN -2.40 -1.26 1 40 SER 1.98 -0.99 1 41 ASN 1.97 -1.87 1 43 PHE -4.74 -1.34 1 44 GLU -4.90 -2.28 1 45 LEU 0.42 -3.28 1 46 SER -2.00 -1.41 1 47 ILE -6.13 -3.21 1 48 LYS -1.97 -1.30 1 49 THR 0.04 -3.90 1 50 GLU -2.56 -1.30 1 51 ALA 0.11 -2.22 1 52 THR -0.20 0.18 1 53 GLN -3.80 0.99 1 55 LEU 1.66 -3.14 1 56 ILE -3.08 -0.68 1 57 LEU 1.36 -4.41 1 58 TRP 2.57 -1.78 1 59 SER -4.11 -2.40 1 63 LEU 0.89 -4.69 1 64 GLU -3.49 0.11 1 65 ARG 5.14 -0.72 1 66 SER -1.30 -0.71 1 67 ASP 0.26 1.11 1 68 TYR -3.40 -2.85 1 69 ILE -3.22 -0.82 1 72 ALA -5.52 -3.77 1 73 ILE -0.03 -2.08 1 74 VAL -1.88 -0.30 1 75 ASP 3.31 -0.58 1 77 PHE -3.33 -0.22 1 78 VAL 3.05 -2.13 1 79 GLN -0.29 -4.08 1 80 MET 1.40 -2.13 1 81 MET 5.86 -1.42 1 83 ASP 3.08 -4.24 1 84 LEU -2.63 -2.58 1 89 VAL -2.35 -5.64 1 90 VAL -2.35 -1.56 1 91 LEU -1.69 -2.86 1 92 ARG -1.20 -1.99 1 93 SER 0.11 -0.57 1 94 THR -0.20 1.02 1 95 VAL -1.18 -2.13 1 97 ILE -6.84 -1.52 1 98 ASN 4.78 0.66 1 99 THR -1.38 0.04 1 100 ASN 0.09 -1.59 1 101 HIS -3.94 2.32 1 102 TRP 2.10 1.59 1 103 THR -1.14 -2.49 1 104 HIS -0.22 -0.48 1 105 ILE -1.91 -2.51 1 106 LYS -0.60 -2.28 1 108 TYR 0.82 0.10 1 110 VAL -1.17 2.94 1 111 GLN 0.65 2.11 1 112 ARG -4.95 -0.72 1 113 GLU -2.33 -1.58 1 115 SER -2.24 -2.68 1 116 LEU -5.67 -4.13 1 117 GLN -2.16 -2.81 1 118 VAL 0.23 -0.30 1 120 ASN -0.61 0.38 1 121 GLU -0.21 -1.72 1 122 ALA 1.36 0.38 1 124 ILE -0.51 -0.40 1 125 THR -5.12 0.04 1 127 SER -3.64 -0.43 1 128 SER 4.72 -1.18 1 130 LEU 1.83 -0.89 1 132 ALA -2.93 -0.67 1 133 THR 2.06 0.31 1 134 GLN -4.73 1.85 1 135 LEU 0.67 -2.86 1 136 ASP -0.68 -2.27 1 138 ASP -2.31 1.25 1 140 ALA -1.29 -5.59 1 141 LEU -3.56 -4.97 1 142 TRP -3.53 0.75 1 143 LEU 0.04 -0.05 1 146 MET -3.75 -1.43 1 147 GLU -0.69 -0.88 1 148 ARG -1.19 -0.86 1 149 LEU -2.15 -3.57 1 150 SER -4.11 0.84 1 153 HIS 3.30 2.18 1 154 LYS 2.21 -2.43 1 155 LEU 0.09 1.99 1 157 LYS 4.79 2.07 1 158 ALA 0.35 0.45 1 159 TYR 5.04 -1.02 1 160 SER -0.12 -1.41 1 161 THR -0.91 -1.51 1 163 PHE 0.63 -2.05 1 164 ILE -0.97 -1.38 1 167 ILE -2.37 -3.07 1 168 ARG -4.24 -3.81 1 169 ASP 2.83 -2.41 1 170 VAL 2.11 -0.58 1 171 ILE -1.44 -0.54 1 172 VAL -1.64 -0.30 1 173 ASP 4.48 -1.28 1 174 ARG 5.84 -1.42 1 175 GLN -2.86 -1.83 1 177 LEU 0.19 -3.71 1 178 HIS 1.90 1.06 1 179 LEU 4.18 0.65 1 180 VAL 4.21 2.80 1 181 GLU 4.70 1.79 1 182 ASP 1.90 -0.58 1 183 ALA 1.52 2.28 1 184 LEU -0.28 0.51 1 185 ASN -3.42 -1.31 1 186 ASN 2.87 1.14 1 188 THR 2.37 -0.95 1 189 ILE -0.03 -1.38 1 190 LEU -2.86 -1.46 1 191 HIS 0.23 1.06 1 193 SER 0.58 -4.36 1 194 ALA 0.12 -1.25 1 stop_ save_