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 bmr18389_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 -5.75 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.54 _LACS_plot.Line_2_terminator_val_x_2 8.63 _LACS_plot.Line_2_terminator_val_y_2 2.20 _LACS_plot.Y_axis_chem_shift_offset 2.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 HIS -6.85 -2.09 0 13 PHE 8.64 1.21 0 10 LEU 0.11 -1.89 1 11 ASP 0.26 -0.62 1 12 ASP -0.99 -3.89 1 14 GLU 0.29 -4.62 1 16 VAL -0.22 -2.92 1 17 LEU 0.96 -2.30 1 18 ASN -0.36 -2.12 1 19 TRP 0.08 -2.12 1 21 SER -2.66 -2.39 1 22 TYR -3.27 -4.25 1 23 SER -1.20 -2.64 1 25 GLU 1.84 -2.91 1 27 ALA -1.38 -2.94 1 28 LYS -5.22 -3.78 1 29 VAL -3.70 -5.12 1 30 SER -3.32 -3.86 1 31 THR -5.51 -5.59 1 32 LYS -4.22 -3.23 1 33 ILE 1.68 -3.66 1 34 VAL -6.55 -5.54 1 35 SER 3.22 0.04 1 37 LYS 3.04 -0.65 1 38 THR -2.59 -4.58 1 40 ASN -2.07 -2.78 1 42 MET -4.29 -3.90 1 43 GLU -5.42 -4.92 1 44 VAL 0.09 -3.86 1 45 SER -2.60 -4.75 1 46 TYR -4.34 -5.67 1 47 THR -2.55 -3.53 1 49 THR -4.23 -4.42 1 51 ASP 0.37 -1.96 1 53 TYR -6.02 -5.79 1 54 TRP -5.62 -5.24 1 56 THR -3.81 -4.56 1 57 VAL -6.60 -6.15 1 58 TYR -2.48 -6.32 1 59 SER 0.90 -2.85 1 60 LEU -0.71 -3.05 1 62 ASP -2.42 -3.49 1 64 ASP -0.17 -3.93 1 65 TRP -2.47 -5.46 1 66 SER 4.42 1.51 1 70 LYS -7.20 -5.34 1 71 ILE -6.62 -5.77 1 72 SER -6.16 -5.84 1 73 PHE -2.87 -3.90 1 74 ASP -3.69 -3.30 1 75 ILE -6.30 -3.58 1 76 LYS -2.42 -2.80 1 77 SER -0.95 -2.96 1 78 VAL 0.23 -2.40 1 79 ASP -1.06 -3.09 1 81 SER -0.86 -2.75 1 82 ALA -0.89 -3.42 1 83 ASN -2.23 -2.34 1 84 GLU -0.63 -1.83 1 85 ILE -4.52 -3.07 1 86 ARG -4.04 -2.88 1 87 PHE -4.39 -3.88 1 88 MET -8.60 -4.28 1 89 ILE -3.25 -3.13 1 90 ALA -4.91 -5.68 1 91 GLU -3.41 -3.46 1 92 LYS 0.60 -1.84 1 93 SER -2.37 -4.43 1 94 ILE 2.04 -0.76 1 95 ASN -1.48 -3.71 1 97 VAL -0.93 -3.06 1 99 ASP -1.72 -3.62 1 101 GLU -2.26 -1.15 1 103 TRP -2.26 -2.67 1 104 VAL -7.41 -4.87 1 105 TYR -3.35 -1.18 1 106 SER 1.03 -1.50 1 107 ILE -5.05 -4.09 1 108 THR -0.80 -3.11 1 110 ASP -3.73 -4.14 1 111 SER 2.78 0.03 1 112 SER -3.43 -4.28 1 113 TRP 1.62 -0.62 1 114 LYS -4.40 -3.25 1 115 THR 0.73 -2.13 1 116 ILE -0.27 -4.74 1 117 GLU -4.59 -4.80 1 118 ILE -1.79 -3.06 1 120 PHE 5.93 1.57 1 121 SER 2.22 -0.94 1 122 SER 1.30 -0.78 1 123 PHE 2.13 1.08 1 124 ARG -4.49 -4.67 1 125 ARG 2.59 -0.96 1 126 ARG 0.70 -0.46 1 127 LEU -0.87 -1.89 1 128 ASP 2.81 -1.71 1 129 TYR -1.21 -1.56 1 130 GLN -4.73 -3.91 1 134 GLN 2.63 -1.90 1 135 ASP 1.81 -2.39 1 136 MET 2.52 -0.94 1 137 SER 0.97 -0.46 1 139 THR -3.72 -4.67 1 140 LEU 2.77 -3.76 1 141 ASP 0.03 -2.51 1 142 LEU 1.15 -1.35 1 143 ASP 0.70 -3.10 1 144 ASN -2.91 -3.63 1 145 ILE 2.15 -3.24 1 146 ASP -3.66 -0.85 1 147 SER -2.44 -3.72 1 148 ILE -4.39 -4.48 1 149 HIS -8.06 -3.10 1 150 PHE -0.88 -1.20 1 151 MET -5.30 -3.25 1 152 TYR -0.66 -2.56 1 153 ALA -4.17 -3.31 1 154 ASN -1.00 -3.19 1 156 LYS 0.34 -2.33 1 157 SER -2.06 -2.68 1 159 LYS -4.66 -3.06 1 160 PHE -3.84 -4.39 1 161 VAL -4.58 -5.54 1 162 VAL -7.45 -6.51 1 163 ASP -6.08 -4.72 1 164 ASN 3.07 -0.43 1 165 ILE 1.67 -1.94 1 166 LYS -5.83 -3.68 1 167 LEU -2.83 -4.52 1 168 ILE -3.86 -3.72 1 170 ALA -1.15 -3.16 1 171 LEU -0.18 -2.47 1 172 GLU -1.16 -2.87 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18389_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 2.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 8.63 _LACS_plot.Line_2_terminator_val_y_2 -6.43 _LACS_plot.Y_axis_chem_shift_offset 2.48 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 HIS -6.85 4.76 0 13 PHE 8.64 -7.43 0 10 LEU 0.11 -2.00 1 11 ASP 0.26 -0.88 1 12 ASP -0.99 -2.90 1 14 GLU 0.29 -4.91 1 16 VAL -0.22 -2.70 1 17 LEU 0.96 -3.26 1 18 ASN -0.36 -1.76 1 19 TRP 0.08 -2.20 1 21 SER -2.66 0.27 1 22 TYR -3.27 -0.98 1 23 SER -1.20 -1.44 1 25 GLU 1.84 -4.75 1 27 ALA -1.38 -1.56 1 28 LYS -5.22 1.44 1 29 VAL -3.70 -1.42 1 30 SER -3.32 -0.54 1 31 THR -5.51 -0.08 1 32 LYS -4.22 0.99 1 33 ILE 1.68 -5.34 1 34 VAL -6.55 1.01 1 35 SER 3.22 -3.18 1 37 LYS 3.04 -3.69 1 38 THR -2.59 -1.99 1 40 ASN -2.07 -0.71 1 42 MET -4.29 0.39 1 43 GLU -5.42 0.50 1 44 VAL 0.09 -3.95 1 45 SER -2.60 -2.15 1 46 TYR -4.34 -1.33 1 47 THR -2.55 -0.98 1 49 THR -4.23 -0.19 1 51 ASP 0.37 -2.33 1 53 TYR -6.02 0.23 1 54 TRP -5.62 0.38 1 56 THR -3.81 -0.75 1 57 VAL -6.60 0.45 1 58 TYR -2.48 -3.84 1 59 SER 0.90 -3.75 1 60 LEU -0.71 -2.34 1 62 ASP -2.42 -1.07 1 64 ASP -0.17 -3.76 1 65 TRP -2.47 -2.99 1 66 SER 4.42 -2.91 1 70 LYS -7.20 1.86 1 71 ILE -6.62 0.85 1 72 SER -6.16 0.32 1 73 PHE -2.87 -1.03 1 74 ASP -3.69 0.39 1 75 ILE -6.30 2.72 1 76 LYS -2.42 -0.38 1 77 SER -0.95 -2.01 1 78 VAL 0.23 -2.63 1 79 ASP -1.06 -2.03 1 81 SER -0.86 -1.89 1 82 ALA -0.89 -2.53 1 83 ASN -2.23 -0.11 1 84 GLU -0.63 -1.20 1 85 ILE -4.52 1.45 1 86 ARG -4.04 1.16 1 87 PHE -4.39 0.51 1 88 MET -8.60 4.32 1 89 ILE -3.25 0.12 1 90 ALA -4.91 -0.77 1 91 GLU -3.41 -0.05 1 92 LYS 0.60 -2.44 1 93 SER -2.37 -2.06 1 94 ILE 2.04 -2.80 1 95 ASN -1.48 -2.23 1 97 VAL -0.93 -2.13 1 99 ASP -1.72 -1.90 1 101 GLU -2.26 1.11 1 103 TRP -2.26 -0.41 1 104 VAL -7.41 2.54 1 105 TYR -3.35 2.17 1 106 SER 1.03 -2.53 1 107 ILE -5.05 0.96 1 108 THR -0.80 -2.31 1 110 ASP -3.73 -0.41 1 111 SER 2.78 -2.75 1 112 SER -3.43 -0.85 1 113 TRP 1.62 -2.24 1 114 LYS -4.40 1.15 1 115 THR 0.73 -2.86 1 116 ILE -0.27 -4.47 1 117 GLU -4.59 -0.21 1 118 ILE -1.79 -1.27 1 120 PHE 5.93 -4.36 1 121 SER 2.22 -3.16 1 122 SER 1.30 -2.08 1 123 PHE 2.13 -1.05 1 124 ARG -4.49 -0.18 1 125 ARG 2.59 -3.55 1 126 ARG 0.70 -1.16 1 127 LEU -0.87 -1.02 1 128 ASP 2.81 -4.52 1 129 TYR -1.21 -0.35 1 130 GLN -4.73 0.82 1 134 GLN 2.63 -4.53 1 135 ASP 1.81 -4.20 1 136 MET 2.52 -3.46 1 137 SER 0.97 -1.43 1 139 THR -3.72 -0.95 1 140 LEU 2.77 -6.53 1 141 ASP 0.03 -2.54 1 142 LEU 1.15 -2.50 1 143 ASP 0.70 -3.80 1 144 ASN -2.91 -0.72 1 145 ILE 2.15 -5.39 1 146 ASP -3.66 2.81 1 147 SER -2.44 -1.28 1 148 ILE -4.39 -0.09 1 149 HIS -8.06 4.96 1 150 PHE -0.88 -0.32 1 151 MET -5.30 2.05 1 152 TYR -0.66 -1.90 1 153 ALA -4.17 0.86 1 154 ASN -1.00 -2.19 1 156 LYS 0.34 -2.67 1 157 SER -2.06 -0.62 1 159 LYS -4.66 1.60 1 160 PHE -3.84 -0.55 1 161 VAL -4.58 -0.96 1 162 VAL -7.45 0.94 1 163 ASP -6.08 1.36 1 164 ASN 3.07 -3.50 1 165 ILE 1.67 -3.61 1 166 LYS -5.83 2.15 1 167 LEU -2.83 -1.69 1 168 ILE -3.86 0.14 1 170 ALA -1.15 -2.01 1 171 LEU -0.18 -2.29 1 172 GLU -1.16 -1.71 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18389_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 1.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.06 _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 8.63 _LACS_plot.Line_2_terminator_val_y_2 -0.64 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 TYR -6.02 -0.93 0 10 LEU 0.11 0.32 1 11 ASP 0.26 0.08 1 12 ASP -0.99 0.21 1 13 PHE 8.64 -0.35 1 14 GLU 0.29 0.70 1 16 VAL -0.22 0.15 1 17 LEU 0.96 0.56 1 18 ASN -0.36 0.41 1 19 TRP 0.08 0.40 1 21 SER -2.66 1.22 1 22 TYR -3.27 0.75 1 23 SER -1.20 0.44 1 25 GLU 1.84 -0.24 1 27 ALA -1.38 0.33 1 28 LYS -5.22 0.57 1 29 VAL -3.70 1.12 1 30 SER -3.32 0.52 1 31 THR -5.51 1.27 1 32 LYS -4.22 0.41 1 33 ILE 1.68 0.80 1 34 VAL -6.55 0.75 1 35 SER 3.22 0.12 1 37 LYS 3.04 -0.97 1 38 THR -2.59 0.05 1 40 ASN -2.07 0.78 1 42 MET -4.29 0.37 1 43 GLU -5.42 0.52 1 44 VAL 0.09 0.24 1 45 SER -2.60 0.50 1 46 TYR -4.34 0.73 1 47 THR -2.55 0.44 1 49 THR -4.23 0.56 1 51 ASP 0.37 0.36 1 54 TRP -5.62 0.72 1 56 THR -3.81 1.52 1 57 VAL -6.60 1.33 1 58 TYR -2.48 0.03 1 59 SER 0.90 -0.17 1 60 LEU -0.71 -0.43 1 62 ASP -2.42 0.20 1 64 ASP -0.17 0.65 1 65 TRP -2.47 0.77 1 66 SER 4.42 -0.43 1 70 LYS -7.20 0.08 1 71 ILE -6.62 1.04 1 72 SER -6.16 1.38 1 73 PHE -2.87 0.75 1 74 ASP -3.69 1.51 1 75 ILE -6.30 2.08 1 76 LYS -2.42 0.51 1 77 SER -0.95 0.35 1 78 VAL 0.23 0.21 1 79 ASP -1.06 0.10 1 81 SER -0.86 0.12 1 82 ALA -0.89 0.64 1 83 ASN -2.23 0.32 1 84 GLU -0.63 0.36 1 85 ILE -4.52 0.46 1 86 ARG -4.04 1.06 1 87 PHE -4.39 0.87 1 88 MET -8.60 1.36 1 89 ILE -3.25 0.37 1 90 ALA -4.91 1.35 1 91 GLU -3.41 0.37 1 92 LYS 0.60 0.05 1 93 SER -2.37 -0.26 1 94 ILE 2.04 0.22 1 95 ASN -1.48 0.31 1 97 VAL -0.93 0.23 1 99 ASP -1.72 0.03 1 101 GLU -2.26 0.38 1 102 HIS -6.85 0.68 1 103 TRP -2.26 0.37 1 104 VAL -7.41 2.01 1 105 TYR -3.35 0.11 1 106 SER 1.03 0.76 1 107 ILE -5.05 0.59 1 108 THR -0.80 0.41 1 110 ASP -3.73 0.51 1 111 SER 2.78 -0.04 1 112 SER -3.43 0.39 1 113 TRP 1.62 -0.11 1 114 LYS -4.40 0.57 1 115 THR 0.73 0.88 1 116 ILE -0.27 0.01 1 117 GLU -4.59 0.52 1 118 ILE -1.79 -0.03 1 120 PHE 5.93 0.37 1 121 SER 2.22 0.18 1 122 SER 1.30 0.48 1 123 PHE 2.13 0.03 1 124 ARG -4.49 1.00 1 125 ARG 2.59 -1.38 1 126 ARG 0.70 -0.38 1 127 LEU -0.87 0.31 1 128 ASP 2.81 -0.09 1 129 TYR -1.21 -0.20 1 130 GLN -4.73 -0.74 1 134 GLN 2.63 0.03 1 135 ASP 1.81 -0.28 1 136 MET 2.52 -0.44 1 137 SER 0.97 -0.08 1 139 THR -3.72 0.19 1 140 LEU 2.77 -0.57 1 141 ASP 0.03 0.06 1 142 LEU 1.15 -0.60 1 143 ASP 0.70 0.28 1 144 ASN -2.91 0.34 1 145 ILE 2.15 -0.33 1 146 ASP -3.66 0.01 1 147 SER -2.44 0.58 1 148 ILE -4.39 1.48 1 149 HIS -8.06 1.76 1 150 PHE -0.88 0.91 1 151 MET -5.30 0.18 1 152 TYR -0.66 -0.47 1 153 ALA -4.17 -0.16 1 154 ASN -1.00 0.44 1 156 LYS 0.34 0.42 1 157 SER -2.06 0.58 1 159 LYS -4.66 1.20 1 160 PHE -3.84 0.91 1 161 VAL -4.58 1.26 1 162 VAL -7.45 1.85 1 163 ASP -6.08 0.94 1 164 ASN 3.07 -0.09 1 165 ILE 1.67 1.27 1 166 LYS -5.83 0.86 1 167 LEU -2.83 0.50 1 168 ILE -3.86 0.82 1 170 ALA -1.15 0.10 1 171 LEU -0.18 0.07 1 172 GLU -1.16 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18389_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.60 _LACS_plot.Line_1_terminator_val_y_1 -5.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.57 _LACS_plot.Line_2_terminator_val_x_2 8.63 _LACS_plot.Line_2_terminator_val_y_2 -1.05 _LACS_plot.Y_axis_chem_shift_offset 3.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 HIS -6.85 0.38 0 13 PHE 8.64 -3.84 0 149 HIS -8.06 0.19 0 10 LEU 0.11 -2.71 1 11 ASP 0.26 -5.46 1 12 ASP -0.99 -1.24 1 14 GLU 0.29 -1.30 1 16 VAL -0.22 -3.10 1 17 LEU 0.96 -2.91 1 18 ASN -0.36 -3.62 1 19 TRP 0.08 -1.18 1 21 SER -2.66 -4.29 1 22 TYR -3.27 -5.14 1 23 SER -1.20 -4.68 1 25 GLU 1.84 -2.92 1 27 ALA -1.38 -3.57 1 28 LYS -5.22 -5.23 1 29 VAL -3.70 -6.49 1 30 SER -3.32 -4.25 1 31 THR -5.51 -2.84 1 32 LYS -4.22 -4.87 1 33 ILE 1.68 -2.82 1 34 VAL -6.55 -3.60 1 37 LYS 3.04 -1.69 1 38 THR -2.59 -2.88 1 40 ASN -2.07 -1.48 1 42 MET -4.29 -5.15 1 43 GLU -5.42 -3.99 1 44 VAL 0.09 -4.55 1 45 SER -2.60 -4.10 1 46 TYR -4.34 -4.26 1 47 THR -2.55 -3.09 1 49 THR -4.23 -2.17 1 51 ASP 0.37 -3.39 1 53 TYR -6.02 -6.68 1 54 TRP -5.62 -5.01 1 56 THR -3.81 -4.32 1 57 VAL -6.60 -7.22 1 58 TYR -2.48 -3.85 1 59 SER 0.90 -3.71 1 60 LEU -0.71 -1.71 1 62 ASP -2.42 -3.35 1 64 ASP -0.17 -1.95 1 65 TRP -2.47 -2.17 1 70 LYS -7.20 -6.57 1 71 ILE -6.62 -7.00 1 72 SER -6.16 -4.39 1 73 PHE -2.87 -5.42 1 74 ASP -3.69 -2.65 1 75 ILE -6.30 -5.17 1 76 LYS -2.42 -4.32 1 77 SER -0.95 -1.86 1 78 VAL 0.23 -3.36 1 79 ASP -1.06 -2.10 1 81 SER -0.86 -3.01 1 82 ALA -0.89 -4.47 1 83 ASN -2.23 -4.35 1 84 GLU -0.63 -4.95 1 85 ILE -4.52 -4.50 1 86 ARG -4.04 -4.51 1 88 MET -8.60 -5.53 1 89 ILE -3.25 -5.35 1 90 ALA -4.91 -1.76 1 91 GLU -3.41 -2.38 1 92 LYS 0.60 -1.86 1 93 SER -2.37 0.36 1 94 ILE 2.04 -2.38 1 95 ASN -1.48 -1.54 1 97 VAL -0.93 -2.68 1 99 ASP -1.72 -3.80 1 101 GLU -2.26 -2.95 1 103 TRP -2.26 -2.86 1 104 VAL -7.41 -3.11 1 105 TYR -3.35 -3.87 1 106 SER 1.03 -4.31 1 107 ILE -5.05 -4.93 1 108 THR -0.80 -2.84 1 110 ASP -3.73 -2.19 1 112 SER -3.43 -4.08 1 113 TRP 1.62 -1.50 1 114 LYS -4.40 -3.83 1 115 THR 0.73 -2.92 1 116 ILE -0.27 -5.39 1 117 GLU -4.59 -3.27 1 118 ILE -1.79 -3.24 1 120 PHE 5.93 -0.40 1 121 SER 2.22 -1.41 1 122 SER 1.30 -2.30 1 123 PHE 2.13 -2.27 1 124 ARG -4.49 -3.67 1 125 ARG 2.59 -1.98 1 126 ARG 0.70 -2.28 1 127 LEU -0.87 -1.82 1 128 ASP 2.81 -3.81 1 129 TYR -1.21 -5.91 1 130 GLN -4.73 -4.18 1 134 GLN 2.63 -3.19 1 135 ASP 1.81 -2.00 1 136 MET 2.52 -2.05 1 137 SER 0.97 0.21 1 139 THR -3.72 -6.61 1 140 LEU 2.77 -5.42 1 141 ASP 0.03 -4.16 1 143 ASP 0.70 -2.75 1 144 ASN -2.91 -3.92 1 145 ILE 2.15 -3.98 1 146 ASP -3.66 -3.37 1 147 SER -2.44 -4.64 1 148 ILE -4.39 -4.47 1 150 PHE -0.88 -2.99 1 151 MET -5.30 -6.02 1 152 TYR -0.66 -4.35 1 153 ALA -4.17 -4.02 1 154 ASN -1.00 -1.93 1 156 LYS 0.34 -2.63 1 157 SER -2.06 -4.67 1 159 LYS -4.66 -3.63 1 160 PHE -3.84 -7.68 1 161 VAL -4.58 -5.56 1 162 VAL -7.45 -5.37 1 163 ASP -6.08 -3.74 1 164 ASN 3.07 -4.26 1 165 ILE 1.67 -3.06 1 166 LYS -5.83 -6.15 1 167 LEU -2.83 -3.90 1 168 ILE -3.86 -2.48 1 170 ALA -1.15 -2.81 1 171 LEU -0.18 -3.12 1 172 GLU -1.16 -3.44 1 stop_ save_