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 bmr11061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.38 _LACS_plot.Line_1_terminator_val_y_1 -3.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 5.55 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ILE 4.40 -0.40 0 140 ILE -0.17 -3.30 0 11 VAL 5.29 4.52 1 12 ASN 5.14 3.36 1 13 PHE 2.37 0.60 1 14 PHE 4.53 4.49 1 15 LYS 4.01 3.97 1 16 PHE 1.40 2.08 1 17 GLN 3.04 2.07 1 18 PHE 1.27 2.05 1 20 ASN 0.45 0.56 1 21 VAL -1.38 -1.01 1 22 GLU 0.98 1.01 1 23 TYR -1.75 -0.99 1 24 SER 0.39 0.61 1 25 SER 0.34 0.49 1 27 ARG 0.61 -0.04 1 28 ASN -0.69 0.24 1 29 LYS -2.61 -0.47 1 30 THR 2.76 1.37 1 31 PHE -4.01 -0.24 1 32 LEU -5.57 -0.49 1 34 TYR -7.34 -2.95 1 35 VAL -2.49 0.38 1 36 VAL -1.22 -0.11 1 37 GLU -4.15 -1.41 1 38 VAL -2.91 -1.55 1 39 GLN -3.71 -0.89 1 40 SER -3.13 -1.48 1 41 LYS 3.45 2.50 1 44 GLN 0.22 0.36 1 45 ALA -2.46 -0.57 1 46 GLN -3.03 -0.54 1 47 ALA -4.16 -1.25 1 48 THR -2.74 -0.72 1 49 GLN -5.48 -1.54 1 51 TYR -6.73 -1.87 1 52 LEU -6.68 -1.32 1 53 GLU -7.27 -3.14 1 54 ASP 0.14 1.11 1 55 GLU -1.79 -0.50 1 56 HIS 1.80 3.07 1 57 ALA 1.75 0.57 1 59 ALA -0.53 -0.30 1 60 HIS -4.11 -0.63 1 61 ALA 3.40 2.94 1 62 GLU 6.41 4.28 1 63 GLU 3.63 3.68 1 64 ALA 3.64 2.69 1 65 PHE 6.22 5.15 1 66 PHE 3.68 3.38 1 67 ASN 1.47 1.58 1 68 THR -0.33 1.33 1 70 LEU -3.17 -1.47 1 72 ALA -4.06 -1.41 1 73 PHE -2.66 -1.10 1 74 ASP -2.20 -0.47 1 76 ALA -0.24 0.26 1 77 LEU -3.09 -1.76 1 78 LYS -1.89 -0.30 1 79 TYR -3.09 -0.28 1 80 ASN -1.67 -0.33 1 81 VAL -2.08 -0.72 1 82 THR -1.10 0.18 1 83 TRP -9.38 -4.85 1 84 TYR -1.41 -1.28 1 85 VAL -6.61 -3.89 1 86 SER 4.86 2.93 1 87 SER -3.06 -1.68 1 88 SER 3.83 2.33 1 91 ALA 4.75 3.57 1 92 ALA 3.33 3.16 1 94 ALA 3.97 3.37 1 95 ASP 3.09 3.86 1 96 ARG 4.61 2.64 1 97 ILE 5.25 5.11 1 98 LEU 4.28 3.81 1 99 LYS 4.13 3.60 1 100 THR 7.16 5.69 1 101 LEU 3.95 3.03 1 102 SER 3.54 3.00 1 103 LYS -1.08 -0.11 1 104 THR 0.69 -0.85 1 105 LYS 2.62 1.42 1 106 ASN 2.52 -0.47 1 107 LEU -2.75 -0.94 1 108 ARG -2.91 -1.56 1 109 LEU -6.02 -1.48 1 110 LEU -3.54 -1.52 1 111 ILE -0.87 0.11 1 112 LEU -1.82 -1.40 1 113 VAL -5.20 -3.11 1 114 SER 3.61 2.48 1 115 ARG -5.34 -2.25 1 116 LEU -3.13 -1.59 1 117 PHE -3.14 -0.81 1 118 MET 4.06 1.28 1 119 TRP 1.65 1.16 1 120 GLU 1.27 0.71 1 121 GLU -0.93 -0.56 1 123 GLU 3.66 3.20 1 124 VAL 5.27 4.27 1 125 GLN 6.63 4.67 1 126 ALA 3.30 2.56 1 127 ALA 3.56 2.82 1 128 LEU 4.34 3.35 1 129 LYS 4.69 4.36 1 130 LYS 4.06 3.73 1 131 LEU 4.48 3.35 1 132 LYS 3.86 3.01 1 133 GLU 2.90 2.44 1 134 ALA -0.83 -0.27 1 137 LYS -1.19 -0.32 1 138 LEU -4.46 -1.02 1 139 ARG -5.36 -1.32 1 141 MET -0.12 2.71 1 142 LYS 0.18 -0.12 1 144 GLN 4.47 3.56 1 145 ASP 3.05 3.42 1 146 PHE 5.30 5.39 1 147 GLU 3.66 3.07 1 148 TYR 4.86 4.34 1 149 ILE 4.19 2.34 1 150 TRP 3.24 2.74 1 151 GLN 2.56 2.63 1 152 ASN -0.16 2.06 1 153 PHE -1.52 0.69 1 154 VAL 1.07 -0.09 1 155 GLU -1.46 -0.64 1 156 GLN -0.82 -0.38 1 157 GLU -0.62 0.07 1 158 GLU 1.63 1.28 1 160 GLU -2.11 -0.73 1 161 SER 0.15 -0.39 1 162 LYS -1.47 -0.24 1 163 ALA -1.27 -0.67 1 164 PHE -0.45 -0.67 1 165 GLU -3.77 -2.53 1 167 TRP 3.61 2.73 1 168 GLU 2.91 2.75 1 170 ILE 5.00 4.68 1 171 GLN 3.99 2.92 1 172 GLU 5.53 4.49 1 173 ASN 3.47 2.61 1 174 PHE 4.91 3.10 1 175 LEU 3.20 2.67 1 176 TYR 3.75 3.23 1 177 TYR 5.17 4.69 1 178 GLU 3.79 3.46 1 179 GLU 3.01 2.57 1 180 LYS 3.48 1.17 1 181 LEU 3.91 2.65 1 182 ALA 3.87 2.69 1 183 ASP 3.02 3.06 1 184 ILE 3.62 3.90 1 185 LEU 1.83 0.70 1 186 LYS 1.76 1.04 1 187 SER -0.30 0.32 1 190 SER 0.13 0.18 1 191 SER -0.14 0.13 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.38 _LACS_plot.Line_1_terminator_val_y_1 5.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -1.60 _LACS_plot.Y_axis_chem_shift_offset -0.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 ILE 4.40 -4.80 0 140 ILE -0.17 -3.13 0 11 VAL 5.29 -0.77 1 12 ASN 5.14 -1.78 1 13 PHE 2.37 -1.77 1 14 PHE 4.53 -0.04 1 15 LYS 4.01 -0.04 1 16 PHE 1.40 0.68 1 17 GLN 3.04 -0.97 1 18 PHE 1.27 0.78 1 20 ASN 0.45 0.11 1 21 VAL -1.38 0.37 1 22 GLU 0.98 0.03 1 23 TYR -1.75 0.76 1 24 SER 0.39 0.22 1 25 SER 0.34 0.15 1 27 ARG 0.61 -0.65 1 28 ASN -0.69 0.93 1 29 LYS -2.61 2.14 1 30 THR 2.76 -1.39 1 31 PHE -4.01 3.77 1 32 LEU -5.57 5.08 1 34 TYR -7.34 4.39 1 35 VAL -2.49 2.87 1 36 VAL -1.22 1.11 1 37 GLU -4.15 2.74 1 38 VAL -2.91 1.36 1 39 GLN -3.71 2.82 1 40 SER -3.13 1.65 1 41 LYS 3.45 -0.95 1 44 GLN 0.22 0.14 1 45 ALA -2.46 1.89 1 46 GLN -3.03 2.49 1 47 ALA -4.16 2.91 1 48 THR -2.74 2.02 1 49 GLN -5.48 3.94 1 51 TYR -6.73 4.86 1 52 LEU -6.68 5.36 1 53 GLU -7.27 4.13 1 54 ASP 0.14 0.97 1 55 GLU -1.79 1.29 1 56 HIS 1.80 1.27 1 57 ALA 1.75 -1.18 1 59 ALA -0.53 0.23 1 60 HIS -4.11 3.48 1 61 ALA 3.40 -0.46 1 62 GLU 6.41 -2.13 1 63 GLU 3.63 0.05 1 64 ALA 3.64 -0.95 1 65 PHE 6.22 -1.07 1 66 PHE 3.68 -0.30 1 67 ASN 1.47 0.11 1 68 THR -0.33 1.66 1 70 LEU -3.17 1.70 1 72 ALA -4.06 2.65 1 73 PHE -2.66 1.56 1 74 ASP -2.20 1.73 1 76 ALA -0.24 0.50 1 77 LEU -3.09 1.33 1 78 LYS -1.89 1.59 1 79 TYR -3.09 2.81 1 80 ASN -1.67 1.34 1 81 VAL -2.08 1.36 1 82 THR -1.10 1.28 1 83 TRP -9.38 4.53 1 84 TYR -1.41 0.13 1 85 VAL -6.61 2.72 1 86 SER 4.86 -1.93 1 87 SER -3.06 1.38 1 88 SER 3.83 -1.50 1 91 ALA 4.75 -1.18 1 92 ALA 3.33 -0.17 1 94 ALA 3.97 -0.60 1 95 ASP 3.09 0.77 1 96 ARG 4.61 -1.97 1 97 ILE 5.25 -0.14 1 98 LEU 4.28 -0.47 1 99 LYS 4.13 -0.53 1 100 THR 7.16 -1.47 1 101 LEU 3.95 -0.92 1 102 SER 3.54 -0.54 1 103 LYS -1.08 0.97 1 104 THR 0.69 -1.54 1 105 LYS 2.62 -1.20 1 106 ASN 2.52 -2.99 1 107 LEU -2.75 1.81 1 108 ARG -2.91 1.35 1 109 LEU -6.02 4.54 1 110 LEU -3.54 2.02 1 111 ILE -0.87 0.98 1 112 LEU -1.82 0.42 1 113 VAL -5.20 2.09 1 114 SER 3.61 -1.13 1 115 ARG -5.34 3.09 1 116 LEU -3.13 1.54 1 117 PHE -3.14 2.33 1 118 MET 4.06 -2.78 1 119 TRP 1.65 -0.49 1 120 GLU 1.27 -0.56 1 121 GLU -0.93 0.37 1 123 GLU 3.66 -0.46 1 124 VAL 5.27 -1.00 1 125 GLN 6.63 -1.96 1 126 ALA 3.30 -0.74 1 127 ALA 3.56 -0.74 1 128 LEU 4.34 -0.99 1 129 LYS 4.69 -0.33 1 130 LYS 4.06 -0.33 1 131 LEU 4.48 -1.13 1 132 LYS 3.86 -0.85 1 133 GLU 2.90 -0.46 1 134 ALA -0.83 0.56 1 137 LYS -1.19 0.87 1 138 LEU -4.46 3.44 1 139 ARG -5.36 4.04 1 141 MET -0.12 2.83 1 142 LYS 0.18 -0.30 1 144 GLN 4.47 -0.91 1 145 ASP 3.05 0.37 1 146 PHE 5.30 0.09 1 147 GLU 3.66 -0.59 1 148 TYR 4.86 -0.52 1 149 ILE 4.19 -1.85 1 150 TRP 3.24 -0.50 1 151 GLN 2.56 0.07 1 152 ASN -0.16 2.22 1 153 PHE -1.52 2.21 1 154 VAL 1.07 -1.16 1 155 GLU -1.46 0.82 1 156 GLN -0.82 0.44 1 157 GLU -0.62 0.69 1 158 GLU 1.63 -0.35 1 160 GLU -2.11 1.38 1 161 SER 0.15 -0.54 1 162 LYS -1.47 1.23 1 163 ALA -1.27 0.60 1 164 PHE -0.45 -0.22 1 165 GLU -3.77 1.24 1 167 TRP 3.61 -0.88 1 168 GLU 2.91 -0.16 1 170 ILE 5.00 -0.32 1 171 GLN 3.99 -1.07 1 172 GLU 5.53 -1.04 1 173 ASN 3.47 -0.86 1 174 PHE 4.91 -1.81 1 175 LEU 3.20 -0.53 1 176 TYR 3.75 -0.52 1 177 TYR 5.17 -0.48 1 178 GLU 3.79 -0.33 1 179 GLU 3.01 -0.44 1 180 LYS 3.48 -2.31 1 181 LEU 3.91 -1.26 1 182 ALA 3.87 -1.18 1 183 ASP 3.02 0.04 1 184 ILE 3.62 0.28 1 185 LEU 1.83 -1.13 1 186 LYS 1.76 -0.72 1 187 SER -0.30 0.62 1 190 SER 0.13 0.05 1 191 SER -0.14 0.27 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.38 _LACS_plot.Line_1_terminator_val_y_1 1.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 -0.73 _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 164 PHE -0.45 -2.00 0 11 VAL 5.29 -0.50 1 12 ASN 5.14 -0.22 1 13 PHE 2.37 0.13 1 14 PHE 4.53 -0.42 1 15 LYS 4.01 -0.64 1 16 PHE 1.40 -0.06 1 17 GLN 3.04 -0.21 1 18 PHE 1.27 -0.36 1 20 ASN 0.45 0.31 1 21 VAL -1.38 -0.04 1 22 GLU 0.98 -0.31 1 23 TYR -1.75 0.26 1 24 SER 0.39 -0.08 1 25 SER 0.34 -0.02 1 27 ARG 0.61 0.08 1 28 ASN -0.69 -0.02 1 29 LYS -2.61 0.00 1 30 THR 2.76 -0.54 1 31 PHE -4.01 0.21 1 32 LEU -5.57 0.69 1 34 TYR -7.34 1.77 1 35 VAL -2.49 0.86 1 36 VAL -1.22 0.59 1 37 GLU -4.15 0.89 1 38 VAL -2.91 0.77 1 39 GLN -3.71 0.60 1 40 SER -3.13 0.29 1 41 LYS 3.45 -0.19 1 44 GLN 0.22 0.04 1 45 ALA -2.46 0.65 1 46 GLN -3.03 0.33 1 47 ALA -4.16 1.51 1 48 THR -2.74 0.40 1 49 GLN -5.48 1.28 1 51 TYR -6.73 1.43 1 52 LEU -6.68 0.30 1 53 GLU -7.27 0.73 1 54 ASP 0.14 -0.22 1 55 GLU -1.79 -0.05 1 56 HIS 1.80 -0.42 1 57 ALA 1.75 -0.17 1 59 ALA -0.53 -0.08 1 60 HIS -4.11 0.10 1 61 ALA 3.40 -0.57 1 62 GLU 6.41 -1.14 1 63 GLU 3.63 -0.19 1 64 ALA 3.64 -0.24 1 65 PHE 6.22 -1.15 1 66 PHE 3.68 -0.40 1 67 ASN 1.47 -0.07 1 68 THR -0.33 0.04 1 69 ILE 4.40 -0.27 1 70 LEU -3.17 -0.23 1 72 ALA -4.06 -0.02 1 73 PHE -2.66 -0.28 1 74 ASP -2.20 0.03 1 76 ALA -0.24 0.08 1 77 LEU -3.09 0.40 1 78 LYS -1.89 0.54 1 79 TYR -3.09 0.52 1 80 ASN -1.67 0.69 1 81 VAL -2.08 1.01 1 82 THR -1.10 0.85 1 83 TRP -9.38 1.08 1 84 TYR -1.41 0.78 1 85 VAL -6.61 1.62 1 86 SER 4.86 -0.91 1 87 SER -3.06 0.73 1 88 SER 3.83 -0.48 1 91 ALA 4.75 -0.37 1 92 ALA 3.33 -0.03 1 94 ALA 3.97 -0.33 1 95 ASP 3.09 -0.21 1 96 ARG 4.61 -0.29 1 97 ILE 5.25 -0.98 1 98 LEU 4.28 -0.60 1 99 LYS 4.13 -0.44 1 100 THR 7.16 -0.67 1 101 LEU 3.95 -0.47 1 102 SER 3.54 -0.29 1 103 LYS -1.08 0.21 1 104 THR 0.69 -0.02 1 105 LYS 2.62 -0.01 1 106 ASN 2.52 0.08 1 107 LEU -2.75 0.91 1 108 ARG -2.91 0.38 1 109 LEU -6.02 0.74 1 110 LEU -3.54 0.61 1 111 ILE -0.87 0.31 1 112 LEU -1.82 0.83 1 113 VAL -5.20 0.75 1 114 SER 3.61 0.31 1 115 ARG -5.34 -0.78 1 116 LEU -3.13 0.22 1 117 PHE -3.14 0.20 1 118 MET 4.06 -0.77 1 119 TRP 1.65 -0.66 1 120 GLU 1.27 -0.67 1 121 GLU -0.93 -0.08 1 123 GLU 3.66 -0.18 1 124 VAL 5.27 -0.44 1 125 GLN 6.63 -0.53 1 126 ALA 3.30 -0.25 1 127 ALA 3.56 -0.25 1 128 LEU 4.34 -0.32 1 129 LYS 4.69 -0.45 1 130 LYS 4.06 -0.31 1 131 LEU 4.48 -0.42 1 132 LYS 3.86 0.06 1 133 GLU 2.90 -0.30 1 134 ALA -0.83 0.06 1 137 LYS -1.19 0.20 1 138 LEU -4.46 1.07 1 139 ARG -5.36 0.31 1 140 ILE -0.17 0.45 1 141 MET -0.12 -0.37 1 142 LYS 0.18 -0.52 1 144 GLN 4.47 -0.17 1 145 ASP 3.05 0.06 1 146 PHE 5.30 -0.69 1 147 GLU 3.66 -1.28 1 148 TYR 4.86 -0.52 1 149 ILE 4.19 -0.55 1 150 TRP 3.24 -1.25 1 151 GLN 2.56 -0.56 1 152 ASN -0.16 -0.30 1 153 PHE -1.52 -0.06 1 154 VAL 1.07 0.26 1 155 GLU -1.46 -0.36 1 156 GLN -0.82 -0.19 1 157 GLU -0.62 -0.14 1 158 GLU 1.63 -0.31 1 160 GLU -2.11 0.06 1 161 SER 0.15 -0.08 1 162 LYS -1.47 0.21 1 163 ALA -1.27 0.09 1 165 GLU -3.77 -0.34 1 167 TRP 3.61 0.01 1 168 GLU 2.91 -0.31 1 170 ILE 5.00 0.14 1 171 GLN 3.99 0.18 1 172 GLU 5.53 -0.39 1 173 ASN 3.47 -0.13 1 174 PHE 4.91 0.38 1 175 LEU 3.20 -0.92 1 176 TYR 3.75 -0.47 1 177 TYR 5.17 -0.63 1 178 GLU 3.79 -0.46 1 179 GLU 3.01 -0.39 1 180 LYS 3.48 -0.53 1 181 LEU 3.91 -0.38 1 182 ALA 3.87 -0.30 1 183 ASP 3.02 -0.24 1 184 ILE 3.62 -0.38 1 185 LEU 1.83 -0.13 1 186 LYS 1.76 -0.04 1 187 SER -0.30 0.04 1 190 SER 0.13 0.04 1 191 SER -0.14 0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.38 _LACS_plot.Line_1_terminator_val_y_1 -3.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.93 _LACS_plot.Line_2_terminator_val_x_2 7.15 _LACS_plot.Line_2_terminator_val_y_2 2.72 _LACS_plot.Y_axis_chem_shift_offset 0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 60 HIS -4.11 2.84 0 11 VAL 5.29 1.21 1 12 ASN 5.14 2.98 1 13 PHE 2.37 2.11 1 14 PHE 4.53 0.42 1 24 SER 0.39 -0.04 1 25 SER 0.34 0.41 1 27 ARG 0.61 -0.51 1 28 ASN -0.69 -1.16 1 29 LYS -2.61 -2.00 1 31 PHE -4.01 -2.81 1 32 LEU -5.57 -2.24 1 34 TYR -7.34 -2.45 1 35 VAL -2.49 -0.13 1 36 VAL -1.22 -1.67 1 37 GLU -4.15 -1.55 1 38 VAL -2.91 -0.43 1 39 GLN -3.71 -0.84 1 40 SER -3.13 0.61 1 41 LYS 3.45 1.30 1 44 GLN 0.22 -0.42 1 45 ALA -2.46 -0.75 1 46 GLN -3.03 -1.48 1 47 ALA -4.16 -0.46 1 48 THR -2.74 -2.19 1 49 GLN -5.48 -1.53 1 51 TYR -6.73 -2.47 1 52 LEU -6.68 -3.74 1 53 GLU -7.27 -0.89 1 56 HIS 1.80 2.04 1 57 ALA 1.75 -0.65 1 59 ALA -0.53 -0.03 1 61 ALA 3.40 0.11 1 62 GLU 6.41 1.96 1 63 GLU 3.63 2.03 1 64 ALA 3.64 2.99 1 65 PHE 6.22 0.96 1 66 PHE 3.68 -0.72 1 67 ASN 1.47 2.11 1 68 THR -0.33 -0.89 1 69 ILE 4.40 -0.36 1 70 LEU -3.17 0.35 1 72 ALA -4.06 -3.05 1 73 PHE -2.66 -0.99 1 74 ASP -2.20 1.68 1 76 ALA -0.24 -0.08 1 77 LEU -3.09 -1.64 1 78 LYS -1.89 -1.58 1 79 TYR -3.09 -1.45 1 80 ASN -1.67 -0.73 1 81 VAL -2.08 -1.99 1 82 THR -1.10 -1.48 1 83 TRP -9.38 -2.00 1 84 TYR -1.41 0.06 1 85 VAL -6.61 -0.39 1 86 SER 4.86 -0.21 1 91 ALA 4.75 1.88 1 92 ALA 3.33 4.00 1 94 ALA 3.97 1.31 1 95 ASP 3.09 1.25 1 96 ARG 4.61 3.65 1 97 ILE 5.25 0.74 1 98 LEU 4.28 1.95 1 99 LYS 4.13 2.93 1 100 THR 7.16 2.02 1 101 LEU 3.95 1.56 1 102 SER 3.54 0.48 1 103 LYS -1.08 -0.40 1 104 THR 0.69 -0.78 1 105 LYS 2.62 0.28 1 106 ASN 2.52 -2.81 1 107 LEU -2.75 -3.50 1 108 ARG -2.91 -2.77 1 109 LEU -6.02 -4.62 1 110 LEU -3.54 -4.18 1 111 ILE -0.87 -3.39 1 112 LEU -1.82 -1.15 1 113 VAL -5.20 0.15 1 117 PHE -3.14 -1.79 1 118 MET 4.06 -0.77 1 119 TRP 1.65 -0.48 1 120 GLU 1.27 0.62 1 121 GLU -0.93 1.14 1 123 GLU 3.66 3.07 1 124 VAL 5.27 1.41 1 125 GLN 6.63 2.32 1 126 ALA 3.30 2.23 1 127 ALA 3.56 2.33 1 128 LEU 4.34 1.44 1 129 LYS 4.69 2.77 1 130 LYS 4.06 3.37 1 131 LEU 4.48 0.66 1 132 LYS 3.86 4.73 1 133 GLU 2.90 0.81 1 134 ALA -0.83 -0.51 1 137 LYS -1.19 -2.37 1 138 LEU -4.46 -1.98 1 139 ARG -5.36 -2.34 1 140 ILE -0.17 0.48 1 144 GLN 4.47 2.63 1 145 ASP 3.05 1.66 1 146 PHE 5.30 1.49 1 147 GLU 3.66 0.62 1 148 TYR 4.86 3.02 1 149 ILE 4.19 1.63 1 150 TRP 3.24 0.70 1 151 GLN 2.56 2.03 1 152 ASN -0.16 -0.51 1 153 PHE -1.52 -1.54 1 154 VAL 1.07 -0.86 1 155 GLU -1.46 -2.09 1 156 GLN -0.82 -0.19 1 157 GLU -0.62 0.02 1 158 GLU 1.63 0.61 1 160 GLU -2.11 -0.68 1 161 SER 0.15 0.05 1 162 LYS -1.47 0.45 1 163 ALA -1.27 -1.17 1 174 PHE 4.91 0.58 1 175 LEU 3.20 2.43 1 176 TYR 3.75 1.74 1 177 TYR 5.17 1.62 1 178 GLU 3.79 2.59 1 179 GLU 3.01 1.93 1 180 LYS 3.48 2.60 1 181 LEU 3.91 0.14 1 182 ALA 3.87 2.82 1 183 ASP 3.02 2.49 1 184 ILE 3.62 1.39 1 185 LEU 1.83 0.00 1 186 LYS 1.76 -0.06 1 187 SER -0.30 0.04 1 190 SER 0.13 0.04 1 191 SER -0.14 -0.66 1 stop_ save_