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 bmr18953_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 -2.34 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.45 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 4.28 _LACS_plot.Y_axis_chem_shift_offset -0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 140 TYR 2.24 -2.60 0 11 ASN 7.41 3.56 1 15 ARG 0.82 1.33 1 16 TYR -6.91 -3.29 1 17 HIS -4.04 0.56 1 18 GLU -3.72 -1.50 1 20 MET -0.61 -0.14 1 21 SER -2.69 -0.71 1 22 ASP 0.55 1.27 1 24 ALA 2.03 2.11 1 25 ASP 0.26 -0.28 1 26 LEU 1.09 1.05 1 27 HIS 3.75 2.79 1 28 SER 3.10 2.11 1 29 TYR 0.10 0.77 1 30 PHE -1.92 -1.78 1 31 ASN -0.71 0.45 1 32 ARG -3.03 -0.84 1 34 HIS -2.61 1.70 1 35 SER -0.30 1.65 1 36 ILE -7.58 -0.61 1 37 ARG -3.32 0.11 1 38 VAL 1.47 0.24 1 39 GLU -0.03 1.90 1 40 SER -1.42 -0.68 1 43 PHE -6.57 -1.21 1 44 MET -3.35 -2.41 1 45 VAL -3.95 -2.57 1 46 TYR -3.44 -1.22 1 47 ASP -0.34 -0.37 1 48 ARG -5.42 -1.66 1 49 THR -0.08 0.31 1 50 ASN 3.27 1.28 1 51 PHE 1.64 -2.03 1 52 MET -3.89 -1.45 1 54 ARG 0.89 1.20 1 55 GLN -4.66 -2.59 1 56 TYR -3.45 -0.69 1 57 PHE -0.72 0.67 1 58 LEU -3.74 -1.25 1 59 ARG -3.77 -2.27 1 60 ARG 1.96 1.95 1 62 GLU -3.73 -0.79 1 63 TYR -0.28 -0.53 1 65 ASP 0.67 -0.63 1 66 TYR 3.85 3.07 1 67 MET 5.44 4.60 1 68 ARG 2.44 2.60 1 69 THR 4.69 3.71 1 70 MET 0.52 0.63 1 72 MET -2.38 0.48 1 73 ASN -0.20 0.77 1 74 ASP -4.59 -1.65 1 76 VAL 1.82 1.62 1 77 ARG -3.90 -0.59 1 78 SER -0.87 1.21 1 80 ARG -5.10 -1.31 1 81 MET -1.15 0.19 1 82 ILE 0.66 0.15 1 84 LEU 0.27 -0.57 1 85 HIS -2.47 1.17 1 86 HIS -0.96 -0.29 1 88 SER -0.58 -0.02 1 89 PHE -2.69 -0.97 1 90 LYS -0.99 1.61 1 91 MET -4.89 -0.87 1 92 ARG -4.58 -1.00 1 93 LEU -3.89 -1.40 1 94 TYR -2.40 -0.84 1 95 GLU -1.26 2.36 1 96 HIS -6.21 -1.85 1 97 SER 0.94 0.88 1 98 ASP 4.26 2.67 1 99 MET 6.90 1.20 1 102 ARG 1.59 2.37 1 103 MET -3.37 -1.41 1 104 MET -3.73 -1.32 1 105 GLU -4.53 -0.91 1 106 LEU -4.60 -0.20 1 107 MET -2.18 0.03 1 108 ASP -4.49 -2.25 1 109 ASP 0.95 0.91 1 112 ASN 1.21 1.02 1 113 LEU 3.74 3.79 1 114 MET 4.73 2.95 1 115 ASP 3.02 2.54 1 116 ARG 0.64 1.84 1 117 PHE -2.94 -0.66 1 118 ASN 2.79 1.94 1 119 MET -3.78 0.55 1 120 SER -2.65 -0.86 1 121 ASP -2.98 -0.57 1 122 PHE -1.31 -0.04 1 123 HIS -1.68 2.60 1 124 SER -0.61 1.26 1 126 HIS -7.81 -1.69 1 127 VAL 3.18 1.28 1 128 MET 1.59 2.71 1 129 ASP -4.05 -0.02 1 131 HIS -3.71 1.32 1 132 TRP -4.80 -0.60 1 133 LEU -5.73 -1.56 1 134 VAL -2.44 -1.25 1 135 TYR -2.84 -1.90 1 136 GLU 0.27 3.30 1 137 GLN -1.21 -0.87 1 139 ASN 3.42 1.15 1 141 THR -4.72 -1.67 1 143 ARG 1.86 2.12 1 144 GLN -5.63 -2.38 1 145 PHE -4.46 -1.79 1 146 TYR -1.59 -2.16 1 147 LEU -1.88 -0.13 1 148 ARG -0.07 -1.01 1 151 GLU -2.03 -0.05 1 152 TYR -0.90 -0.93 1 153 ARG 4.76 4.20 1 154 SER -3.96 -1.41 1 155 TYR -0.13 -0.53 1 156 ASN 2.78 2.50 1 157 ASP 2.65 3.18 1 158 TRP 1.05 -0.43 1 161 VAL 1.16 1.10 1 162 THR -4.51 -2.37 1 163 SER 0.38 -0.33 1 164 ARG 1.59 1.14 1 165 MET -3.58 0.79 1 167 SER -0.59 0.43 1 168 ILE -5.35 0.06 1 169 ARG -5.90 -1.81 1 170 ARG -0.08 -0.83 1 171 ILE 3.93 1.46 1 172 THR -1.95 -1.71 1 173 ASP 0.39 0.81 1 174 LEU -0.31 1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18953_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 5.47 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.55 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -3.12 _LACS_plot.Y_axis_chem_shift_offset -0.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 140 TYR 2.24 -4.84 0 11 ASN 7.41 -3.85 1 15 ARG 0.82 0.51 1 16 TYR -6.91 3.62 1 17 HIS -4.04 4.60 1 18 GLU -3.72 2.22 1 20 MET -0.61 0.47 1 21 SER -2.69 1.98 1 22 ASP 0.55 0.72 1 24 ALA 2.03 0.08 1 25 ASP 0.26 -0.54 1 26 LEU 1.09 -0.04 1 27 HIS 3.75 -0.96 1 28 SER 3.10 -0.99 1 29 TYR 0.10 0.67 1 30 PHE -1.92 0.14 1 31 ASN -0.71 1.16 1 32 ARG -3.03 2.19 1 34 HIS -2.61 4.31 1 35 SER -0.30 1.95 1 36 ILE -7.58 6.97 1 37 ARG -3.32 3.43 1 38 VAL 1.47 -1.23 1 39 GLU -0.03 1.93 1 40 SER -1.42 0.74 1 43 PHE -6.57 5.36 1 44 MET -3.35 0.94 1 45 VAL -3.95 1.38 1 46 TYR -3.44 2.22 1 47 ASP -0.34 -0.03 1 48 ARG -5.42 3.76 1 49 THR -0.08 0.39 1 50 ASN 3.27 -1.99 1 51 PHE 1.64 -3.67 1 52 MET -3.89 2.44 1 54 ARG 0.89 0.31 1 55 GLN -4.66 2.07 1 56 TYR -3.45 2.76 1 57 PHE -0.72 1.39 1 58 LEU -3.74 2.49 1 59 ARG -3.77 1.50 1 60 ARG 1.96 -0.01 1 62 GLU -3.73 2.94 1 63 TYR -0.28 -0.25 1 65 ASP 0.67 -1.30 1 66 TYR 3.85 -0.78 1 67 MET 5.44 -0.84 1 68 ARG 2.44 0.16 1 69 THR 4.69 -0.98 1 70 MET 0.52 0.11 1 72 MET -2.38 2.86 1 73 ASN -0.20 0.97 1 74 ASP -4.59 2.94 1 76 VAL 1.82 -0.20 1 77 ARG -3.90 3.31 1 78 SER -0.87 2.08 1 80 ARG -5.10 3.79 1 81 MET -1.15 1.34 1 82 ILE 0.66 -0.51 1 84 LEU 0.27 -0.84 1 85 HIS -2.47 3.64 1 86 HIS -0.96 0.67 1 88 SER -0.58 0.56 1 89 PHE -2.69 1.72 1 90 LYS -0.99 2.60 1 91 MET -4.89 4.02 1 92 ARG -4.58 3.58 1 93 LEU -3.89 2.49 1 94 TYR -2.40 1.56 1 95 GLU -1.26 3.62 1 96 HIS -6.21 4.36 1 97 SER 0.94 -0.06 1 98 ASP 4.26 -1.59 1 99 MET 6.90 -5.70 1 102 ARG 1.59 0.78 1 103 MET -3.37 1.96 1 104 MET -3.73 2.41 1 105 GLU -4.53 3.62 1 106 LEU -4.60 4.40 1 107 MET -2.18 2.21 1 108 ASP -4.49 2.24 1 109 ASP 0.95 -0.04 1 112 ASN 1.21 -0.19 1 113 LEU 3.74 0.05 1 114 MET 4.73 -1.78 1 115 ASP 3.02 -0.48 1 116 ARG 0.64 1.20 1 117 PHE -2.94 2.28 1 118 ASN 2.79 -0.85 1 119 MET -3.78 4.33 1 120 SER -2.65 1.79 1 121 ASP -2.98 2.41 1 122 PHE -1.31 1.27 1 123 HIS -1.68 4.28 1 124 SER -0.61 1.87 1 126 HIS -7.81 6.12 1 127 VAL 3.18 -1.90 1 128 MET 1.59 1.12 1 129 ASP -4.05 4.03 1 131 HIS -3.71 5.03 1 132 TRP -4.80 4.20 1 133 LEU -5.73 4.17 1 134 VAL -2.44 1.19 1 135 TYR -2.84 0.94 1 136 GLU 0.27 3.03 1 137 GLN -1.21 0.34 1 139 ASN 3.42 -2.27 1 141 THR -4.72 3.05 1 143 ARG 1.86 0.26 1 144 GLN -5.63 3.25 1 145 PHE -4.46 2.67 1 146 TYR -1.59 -0.57 1 147 LEU -1.88 1.75 1 148 ARG -0.07 -0.94 1 151 GLU -2.03 1.98 1 152 TYR -0.90 -0.03 1 153 ARG 4.76 -0.56 1 154 SER -3.96 2.55 1 155 TYR -0.13 -0.40 1 156 ASN 2.78 -0.28 1 157 ASP 2.65 0.53 1 158 TRP 1.05 -1.48 1 161 VAL 1.16 -0.06 1 162 THR -4.51 2.14 1 163 SER 0.38 -0.71 1 164 ARG 1.59 -0.45 1 165 MET -3.58 4.37 1 167 SER -0.59 1.02 1 168 ILE -5.35 5.41 1 169 ARG -5.90 4.09 1 170 ARG -0.08 -0.75 1 171 ILE 3.93 -2.47 1 172 THR -1.95 0.24 1 173 ASP 0.39 0.42 1 174 LEU -0.31 1.81 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18953_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 0.77 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -0.81 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 155 TYR -0.13 -3.39 0 11 ASN 7.41 -1.62 1 15 ARG 0.82 -0.13 1 16 TYR -6.91 1.31 1 17 HIS -4.04 0.08 1 18 GLU -3.72 0.49 1 20 MET -0.61 0.81 1 21 SER -2.69 0.19 1 22 ASP 0.55 0.31 1 24 ALA 2.03 -0.80 1 25 ASP 0.26 0.25 1 26 LEU 1.09 -0.34 1 27 HIS 3.75 -0.19 1 28 SER 3.10 -0.68 1 29 TYR 0.10 -0.25 1 30 PHE -1.92 0.06 1 31 ASN -0.71 -0.03 1 32 ARG -3.03 0.29 1 34 HIS -2.61 0.29 1 35 SER -0.30 0.79 1 36 ILE -7.58 1.20 1 37 ARG -3.32 0.62 1 38 VAL 1.47 0.20 1 39 GLU -0.03 -0.27 1 40 SER -1.42 -0.13 1 43 PHE -6.57 0.50 1 44 MET -3.35 0.96 1 45 VAL -3.95 1.27 1 46 TYR -3.44 1.45 1 47 ASP -0.34 0.24 1 48 ARG -5.42 0.40 1 49 THR -0.08 -0.56 1 50 ASN 3.27 -1.49 1 51 PHE 1.64 -1.97 1 52 MET -3.89 0.38 1 54 ARG 0.89 -0.18 1 55 GLN -4.66 0.68 1 56 TYR -3.45 -0.10 1 57 PHE -0.72 0.60 1 58 LEU -3.74 0.02 1 59 ARG -3.77 0.22 1 60 ARG 1.96 -0.38 1 62 GLU -3.73 0.20 1 63 TYR -0.28 0.34 1 65 ASP 0.67 0.41 1 66 TYR 3.85 -0.15 1 67 MET 5.44 -0.85 1 68 ARG 2.44 -0.18 1 69 THR 4.69 -0.25 1 70 MET 0.52 0.02 1 72 MET -2.38 -0.10 1 73 ASN -0.20 -0.02 1 74 ASP -4.59 0.24 1 76 VAL 1.82 -0.21 1 77 ARG -3.90 0.04 1 78 SER -0.87 0.06 1 80 ARG -5.10 0.69 1 81 MET -1.15 -0.99 1 82 ILE 0.66 -0.42 1 84 LEU 0.27 -0.10 1 85 HIS -2.47 -0.15 1 86 HIS -0.96 0.03 1 88 SER -0.58 0.06 1 89 PHE -2.69 -0.05 1 90 LYS -0.99 0.84 1 91 MET -4.89 0.35 1 92 ARG -4.58 0.53 1 93 LEU -3.89 -0.06 1 94 TYR -2.40 0.87 1 95 GLU -1.26 -0.32 1 96 HIS -6.21 0.58 1 97 SER 0.94 -0.27 1 98 ASP 4.26 -0.68 1 99 MET 6.90 -1.79 1 102 ARG 1.59 -0.34 1 103 MET -3.37 0.27 1 104 MET -3.73 -0.16 1 105 GLU -4.53 0.50 1 106 LEU -4.60 0.55 1 107 MET -2.18 0.67 1 108 ASP -4.49 -0.19 1 109 ASP 0.95 0.20 1 112 ASN 1.21 0.04 1 113 LEU 3.74 -0.18 1 114 MET 4.73 -0.28 1 115 ASP 3.02 -0.37 1 116 ARG 0.64 -0.28 1 117 PHE -2.94 0.50 1 118 ASN 2.79 0.11 1 119 MET -3.78 -0.09 1 120 SER -2.65 0.21 1 121 ASP -2.98 0.44 1 122 PHE -1.31 0.08 1 123 HIS -1.68 0.03 1 124 SER -0.61 0.23 1 126 HIS -7.81 0.75 1 127 VAL 3.18 -0.25 1 128 MET 1.59 -0.55 1 129 ASP -4.05 0.19 1 131 HIS -3.71 0.27 1 132 TRP -4.80 0.47 1 133 LEU -5.73 0.78 1 134 VAL -2.44 0.44 1 135 TYR -2.84 0.99 1 136 GLU 0.27 -0.25 1 137 GLN -1.21 0.32 1 139 ASN 3.42 -1.38 1 140 TYR 2.24 -1.79 1 141 THR -4.72 0.35 1 143 ARG 1.86 -0.40 1 144 GLN -5.63 0.55 1 145 PHE -4.46 0.04 1 146 TYR -1.59 0.72 1 147 LEU -1.88 0.05 1 148 ARG -0.07 -0.07 1 151 GLU -2.03 -0.03 1 152 TYR -0.90 0.19 1 153 ARG 4.76 -0.32 1 154 SER -3.96 0.72 1 156 ASN 2.78 -0.62 1 157 ASP 2.65 -0.06 1 158 TRP 1.05 0.67 1 161 VAL 1.16 0.13 1 162 THR -4.51 -0.69 1 163 SER 0.38 -0.45 1 164 ARG 1.59 0.08 1 165 MET -3.58 0.14 1 167 SER -0.59 0.09 1 168 ILE -5.35 1.34 1 169 ARG -5.90 0.70 1 170 ARG -0.08 -1.07 1 171 ILE 3.93 -0.37 1 172 THR -1.95 0.21 1 173 ASP 0.39 -0.19 1 174 LEU -0.31 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18953_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.81 _LACS_plot.Line_1_terminator_val_y_1 1.62 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.63 _LACS_plot.Line_2_terminator_val_x_2 6.90 _LACS_plot.Line_2_terminator_val_y_2 -0.89 _LACS_plot.Y_axis_chem_shift_offset -0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ARG 2.44 -4.32 0 67 MET 5.44 -3.56 0 99 MET 6.90 -0.17 0 114 MET 4.73 -4.36 0 15 ARG 0.82 0.27 1 16 TYR -6.91 0.61 1 17 HIS -4.04 3.87 1 18 GLU -3.72 -0.10 1 20 MET -0.61 0.48 1 21 SER -2.69 4.44 1 22 ASP 0.55 -2.74 1 24 ALA 2.03 -2.34 1 25 ASP 0.26 -1.33 1 26 LEU 1.09 -3.87 1 27 HIS 3.75 1.57 1 28 SER 3.10 2.95 1 29 TYR 0.10 0.38 1 30 PHE -1.92 1.98 1 31 ASN -0.71 1.34 1 32 ARG -3.03 1.88 1 34 HIS -2.61 2.12 1 35 SER -0.30 4.49 1 36 ILE -7.58 -0.09 1 37 ARG -3.32 0.48 1 38 VAL 1.47 -1.10 1 39 GLU -0.03 -1.40 1 40 SER -1.42 3.40 1 43 PHE -6.57 2.24 1 44 MET -3.35 -1.96 1 45 VAL -3.95 1.54 1 46 TYR -3.44 -2.75 1 47 ASP -0.34 -0.26 1 48 ARG -5.42 -0.80 1 49 THR -0.08 2.25 1 50 ASN 3.27 2.97 1 51 PHE 1.64 0.49 1 52 MET -3.89 1.10 1 54 ARG 0.89 0.94 1 55 GLN -4.66 0.17 1 56 TYR -3.45 1.38 1 57 PHE -0.72 0.61 1 58 LEU -3.74 -0.24 1 59 ARG -3.77 -0.96 1 60 ARG 1.96 -0.77 1 62 GLU -3.73 -0.35 1 65 ASP 0.67 -2.12 1 66 TYR 3.85 -0.47 1 69 THR 4.69 -0.12 1 70 MET 0.52 -1.29 1 72 MET -2.38 -0.27 1 73 ASN -0.20 2.11 1 74 ASP -4.59 1.29 1 76 VAL 1.82 -0.39 1 77 ARG -3.90 -0.78 1 78 SER -0.87 3.00 1 80 ARG -5.10 0.59 1 81 MET -1.15 0.07 1 84 LEU 0.27 -2.70 1 86 HIS -0.96 3.15 1 88 SER -0.58 3.93 1 89 PHE -2.69 0.75 1 90 LYS -0.99 0.90 1 91 MET -4.89 2.98 1 92 ARG -4.58 1.13 1 93 LEU -3.89 -0.94 1 94 TYR -2.40 -0.67 1 95 GLU -1.26 -2.01 1 96 HIS -6.21 1.73 1 97 SER 0.94 2.99 1 98 ASP 4.26 0.69 1 102 ARG 1.59 1.50 1 103 MET -3.37 -0.81 1 104 MET -3.73 1.57 1 105 GLU -4.53 0.27 1 106 LEU -4.60 -1.93 1 107 MET -2.18 1.57 1 108 ASP -4.49 2.70 1 109 ASP 0.95 -1.53 1 112 ASN 1.21 0.75 1 113 LEU 3.74 -3.89 1 115 ASP 3.02 -2.07 1 116 ARG 0.64 -2.22 1 117 PHE -2.94 -0.12 1 118 ASN 2.79 2.35 1 119 MET -3.78 2.02 1 120 SER -2.65 4.45 1 121 ASP -2.98 1.23 1 122 PHE -1.31 1.52 1 123 HIS -1.68 2.33 1 124 SER -0.61 3.58 1 126 HIS -7.81 2.47 1 127 VAL 3.18 0.36 1 128 MET 1.59 -0.21 1 129 ASP -4.05 -1.34 1 131 HIS -3.71 2.37 1 132 TRP -4.80 1.46 1 133 LEU -5.73 -1.14 1 134 VAL -2.44 1.48 1 135 TYR -2.84 -3.44 1 136 GLU 0.27 -0.58 1 139 ASN 3.42 2.80 1 140 TYR 2.24 0.59 1 141 THR -4.72 3.88 1 143 ARG 1.86 1.28 1 144 GLN -5.63 0.99 1 145 PHE -4.46 1.17 1 146 TYR -1.59 0.31 1 147 LEU -1.88 0.60 1 151 GLU -2.03 -0.52 1 152 TYR -0.90 0.51 1 153 ARG 4.76 0.43 1 154 SER -3.96 1.78 1 155 TYR -0.13 -1.26 1 156 ASN 2.78 -2.31 1 157 ASP 2.65 -2.39 1 158 TRP 1.05 -0.39 1 161 VAL 1.16 -1.18 1 162 THR -4.51 4.49 1 163 SER 0.38 3.71 1 164 ARG 1.59 -1.30 1 165 MET -3.58 0.94 1 167 SER -0.59 4.50 1 168 ILE -5.35 1.38 1 169 ARG -5.90 1.05 1 170 ARG -0.08 -1.93 1 171 ILE 3.93 0.69 1 172 THR -1.95 2.95 1 173 ASP 0.39 0.74 1 stop_ save_