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 bmr17960_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.84 _LACS_plot.Line_1_terminator_val_y_1 -4.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 6.00 _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 129 LYS 5.19 0.87 0 65 ASP -4.84 -1.12 0 10 GLU 4.35 2.60 1 11 TYR 4.39 3.98 1 12 GLU 3.33 3.15 1 13 ILE 4.03 3.78 1 14 ARG 3.20 2.65 1 15 PHE 1.21 -0.15 1 16 TYR 2.97 2.72 1 17 THR -1.28 -1.22 1 19 ASN -1.67 -0.60 1 20 ASP -0.89 -0.09 1 22 LEU 3.45 2.60 1 23 ASP 1.56 3.58 1 24 VAL 5.07 3.15 1 25 TRP 3.39 3.51 1 26 ASP 1.56 3.90 1 27 ARG 4.30 4.78 1 28 TYR -1.05 -1.46 1 29 ILE 6.31 4.64 1 30 SER 4.40 4.37 1 31 TRP 5.09 4.85 1 32 THR 7.92 6.54 1 33 GLU 3.01 3.07 1 34 GLN 2.31 2.08 1 35 ASN 0.62 1.85 1 36 TYR 0.39 0.17 1 38 GLN 1.21 0.51 1 41 LYS 2.80 2.30 1 42 GLU 2.07 1.34 1 43 SER 0.29 0.82 1 44 ASN 1.17 1.06 1 45 MET 3.75 2.62 1 46 SER 5.54 3.74 1 47 THR 4.92 4.02 1 48 LEU 4.09 3.47 1 49 LEU 2.80 2.66 1 50 GLU 3.96 3.07 1 51 ARG 2.80 3.59 1 52 ALA 2.22 1.81 1 53 VAL 6.63 4.48 1 54 GLU 3.33 3.23 1 55 ALA 2.62 2.13 1 56 LEU -2.53 -0.39 1 57 GLN 5.67 3.74 1 59 GLU -0.61 -2.05 1 60 LYS 3.82 2.10 1 61 ARG 4.38 1.94 1 62 TYR -0.17 -1.60 1 63 TYR 6.12 2.48 1 64 SER -1.51 -1.54 1 67 ARG 2.81 2.18 1 68 PHE 0.90 1.58 1 69 LEU 5.49 3.55 1 70 ASN 3.61 3.42 1 71 LEU 4.56 3.47 1 72 TRP 3.39 2.80 1 73 LEU 5.20 3.08 1 74 LYS 4.01 3.71 1 75 LEU 3.85 3.00 1 77 ARG 2.64 1.62 1 78 LEU -0.56 -1.02 1 80 ASN 3.38 2.95 1 81 GLU -2.14 -2.01 1 83 LEU 5.66 3.63 1 84 ASP 3.69 3.35 1 85 MET 6.11 2.46 1 86 TYR 7.70 5.64 1 87 SER 4.24 3.50 1 88 TYR 3.76 4.06 1 89 LEU 6.71 3.57 1 90 HIS 3.63 4.67 1 91 ASN 2.82 2.79 1 92 GLN -0.37 -0.20 1 94 ILE 1.41 0.70 1 96 VAL 2.78 1.10 1 97 SER -0.33 -0.28 1 98 LEU -1.36 -1.35 1 99 ALA 3.80 3.47 1 100 GLN 2.95 2.48 1 101 PHE 4.44 4.26 1 102 TYR 4.08 3.75 1 103 ILE 4.81 4.80 1 104 SER 5.58 4.92 1 105 TRP -1.10 -0.58 1 106 ALA 3.97 3.16 1 107 GLU 3.80 3.15 1 108 GLU 3.80 2.52 1 109 TYR 6.60 5.48 1 110 GLU 4.51 4.18 1 111 ALA 3.96 2.60 1 112 ARG -0.27 -1.45 1 113 GLU 4.28 0.71 1 114 ASN -0.82 -2.90 1 115 PHE 3.49 2.13 1 116 ARG 5.09 3.83 1 117 LYS 3.61 1.42 1 118 ALA 3.64 3.39 1 119 ASP 2.26 4.13 1 120 ALA 4.04 2.68 1 121 ILE 4.90 2.44 1 122 PHE 6.10 6.23 1 123 GLN 5.23 3.82 1 124 GLU 4.12 2.76 1 126 ILE 4.66 4.25 1 127 GLN 4.83 3.50 1 128 GLN 1.44 0.11 1 130 ALA 0.89 0.79 1 131 GLU -3.36 -0.08 1 133 LEU 3.38 3.16 1 134 GLU 4.43 3.15 1 135 ARG 3.28 2.73 1 136 LEU 3.62 3.79 1 137 GLN 4.67 3.97 1 138 SER 4.63 3.58 1 139 GLN 5.07 3.19 1 140 HIS 0.72 3.33 1 141 ARG 4.61 3.59 1 142 GLN 4.52 3.66 1 143 PHE 4.28 3.31 1 144 GLN 4.60 3.50 1 145 ALA 2.93 1.81 1 146 ARG 3.59 3.44 1 147 VAL 3.65 1.97 1 148 SER 2.35 1.93 1 149 ARG 2.88 1.94 1 150 GLN 2.16 1.85 1 151 THR 2.14 1.66 1 152 LEU 1.56 1.18 1 153 LEU 1.09 0.79 1 154 ALA 0.73 0.48 1 155 LEU 0.62 0.71 1 156 GLU 0.25 0.55 1 157 LYS 0.31 0.32 1 158 GLU 0.17 0.39 1 159 GLU -0.29 0.16 1 160 GLU -0.85 -0.16 1 161 GLU -0.61 0.00 1 162 GLU -0.69 0.00 1 163 VAL 0.02 0.00 1 164 PHE -0.36 -0.15 1 165 GLU -0.85 -0.08 1 166 SER -0.50 0.03 1 167 SER 0.77 1.85 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17960_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.84 _LACS_plot.Line_1_terminator_val_y_1 0.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.76 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _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 129 LYS 5.19 -4.32 0 65 ASP -4.84 3.72 0 10 GLU 4.35 -1.75 1 11 TYR 4.39 -0.41 1 12 GLU 3.33 -0.18 1 13 ILE 4.03 -0.25 1 14 ARG 3.20 -0.55 1 15 PHE 1.21 -1.36 1 16 TYR 2.97 -0.25 1 17 THR -1.28 0.06 1 19 ASN -1.67 1.07 1 20 ASP -0.89 0.80 1 22 LEU 3.45 -0.85 1 23 ASP 1.56 2.02 1 24 VAL 5.07 -1.92 1 25 TRP 3.39 0.12 1 26 ASP 1.56 2.34 1 27 ARG 4.30 0.48 1 28 TYR -1.05 -0.41 1 29 ILE 6.31 -1.67 1 30 SER 4.40 -0.03 1 31 TRP 5.09 -0.24 1 32 THR 7.92 -1.38 1 33 GLU 3.01 0.06 1 34 GLN 2.31 -0.23 1 35 ASN 0.62 1.23 1 36 TYR 0.39 -0.22 1 38 GLN 1.21 -0.70 1 41 LYS 2.80 -0.50 1 42 GLU 2.07 -0.73 1 43 SER 0.29 0.53 1 44 ASN 1.17 -0.11 1 45 MET 3.75 -1.13 1 46 SER 5.54 -1.80 1 47 THR 4.92 -0.90 1 48 LEU 4.09 -0.62 1 49 LEU 2.80 -0.14 1 50 GLU 3.96 -0.89 1 51 ARG 2.80 0.79 1 52 ALA 2.22 -0.41 1 53 VAL 6.63 -2.15 1 54 GLU 3.33 -0.10 1 55 ALA 2.62 -0.49 1 56 LEU -2.53 2.14 1 57 GLN 5.67 -1.93 1 59 GLU -0.61 -1.44 1 60 LYS 3.82 -1.72 1 61 ARG 4.38 -2.44 1 62 TYR -0.17 -1.43 1 63 TYR 6.12 -3.64 1 64 SER -1.51 -0.03 1 67 ARG 2.81 -0.63 1 68 PHE 0.90 0.68 1 69 LEU 5.49 -1.94 1 70 ASN 3.61 -0.19 1 71 LEU 4.56 -1.09 1 72 TRP 3.39 -0.59 1 73 LEU 5.20 -2.12 1 74 LYS 4.01 -0.30 1 75 LEU 3.85 -0.85 1 77 ARG 2.64 -1.02 1 78 LEU -0.56 -0.46 1 80 ASN 3.38 -0.43 1 81 GLU -2.14 0.13 1 83 LEU 5.66 -2.03 1 84 ASP 3.69 -0.34 1 85 MET 6.11 -3.65 1 86 TYR 7.70 -2.06 1 87 SER 4.24 -0.74 1 88 TYR 3.76 0.30 1 89 LEU 6.71 -3.14 1 90 HIS 3.63 1.04 1 91 ASN 2.82 -0.03 1 92 GLN -0.37 0.17 1 94 ILE 1.41 -0.71 1 96 VAL 2.78 -1.68 1 97 SER -0.33 0.05 1 98 LEU -1.36 0.01 1 99 ALA 3.80 -0.33 1 100 GLN 2.95 -0.47 1 101 PHE 4.44 -0.18 1 102 TYR 4.08 -0.33 1 103 ILE 4.81 -0.01 1 104 SER 5.58 -0.66 1 105 TRP -1.10 0.52 1 106 ALA 3.97 -0.81 1 107 GLU 3.80 -0.65 1 108 GLU 3.80 -1.28 1 109 TYR 6.60 -1.12 1 110 GLU 4.51 -0.33 1 111 ALA 3.96 -1.36 1 112 ARG -0.27 -1.18 1 113 GLU 4.28 -3.57 1 114 ASN -0.82 -2.08 1 115 PHE 3.49 -1.36 1 116 ARG 5.09 -1.26 1 117 LYS 3.61 -2.19 1 118 ALA 3.64 -0.25 1 119 ASP 2.26 1.87 1 120 ALA 4.04 -1.36 1 121 ILE 4.90 -2.46 1 122 PHE 6.10 0.13 1 123 GLN 5.23 -1.41 1 124 GLU 4.12 -1.36 1 126 ILE 4.66 -0.41 1 127 GLN 4.83 -1.33 1 128 GLN 1.44 -1.33 1 130 ALA 0.89 -0.10 1 131 GLU -3.36 3.28 1 133 LEU 3.38 -0.22 1 134 GLU 4.43 -1.28 1 135 ARG 3.28 -0.55 1 136 LEU 3.62 0.17 1 137 GLN 4.67 -0.70 1 138 SER 4.63 -1.05 1 139 GLN 5.07 -1.88 1 140 HIS 0.72 2.61 1 141 ARG 4.61 -1.02 1 142 GLN 4.52 -0.86 1 143 PHE 4.28 -0.97 1 144 GLN 4.60 -1.10 1 145 ALA 2.93 -1.12 1 146 ARG 3.59 -0.15 1 147 VAL 3.65 -1.68 1 148 SER 2.35 -0.42 1 149 ARG 2.88 -0.94 1 150 GLN 2.16 -0.31 1 151 THR 2.14 -0.48 1 152 LEU 1.56 -0.38 1 153 LEU 1.09 -0.30 1 154 ALA 0.73 -0.25 1 155 LEU 0.62 0.09 1 156 GLU 0.25 0.30 1 157 LYS 0.31 0.01 1 158 GLU 0.17 0.22 1 159 GLU -0.29 0.45 1 160 GLU -0.85 0.69 1 161 GLU -0.61 0.61 1 162 GLU -0.69 0.69 1 163 VAL 0.02 -0.02 1 164 PHE -0.36 0.21 1 165 GLU -0.85 0.77 1 166 SER -0.50 0.53 1 167 SER 0.77 1.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17960_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.84 _LACS_plot.Line_1_terminator_val_y_1 0.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _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 7.92 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 ALA 2.22 -2.49 0 10 GLU 4.35 -0.56 1 11 TYR 4.39 -0.39 1 12 GLU 3.33 -0.38 1 13 ILE 4.03 -0.80 1 14 ARG 3.20 -0.44 1 15 PHE 1.21 0.11 1 16 TYR 2.97 -0.06 1 17 THR -1.28 0.16 1 19 ASN -1.67 0.41 1 20 ASP -0.89 0.58 1 22 LEU 3.45 -0.24 1 23 ASP 1.56 -0.20 1 24 VAL 5.07 -0.52 1 25 TRP 3.39 -0.39 1 26 ASP 1.56 -0.27 1 27 ARG 4.30 -0.24 1 28 TYR -1.05 -1.29 1 29 ILE 6.31 -0.68 1 31 TRP 5.09 -0.47 1 32 THR 7.92 -0.80 1 33 GLU 3.01 -0.44 1 34 GLN 2.31 -0.25 1 35 ASN 0.62 -0.46 1 36 TYR 0.39 0.00 1 38 GLN 1.21 0.07 1 41 LYS 2.80 -0.19 1 42 GLU 2.07 -0.17 1 43 SER 0.29 -0.76 1 44 ASN 1.17 -0.08 1 45 MET 3.75 -0.32 1 46 SER 5.54 -0.65 1 47 THR 4.92 -0.46 1 48 LEU 4.09 -0.31 1 49 LEU 2.80 -0.67 1 50 GLU 3.96 -0.88 1 51 ARG 2.80 -0.48 1 53 VAL 6.63 -0.98 1 54 GLU 3.33 -0.55 1 55 ALA 2.62 -0.05 1 56 LEU -2.53 0.35 1 57 GLN 5.67 0.14 1 59 GLU -0.61 0.12 1 60 LYS 3.82 -1.75 1 61 ARG 4.38 -0.16 1 62 TYR -0.17 0.50 1 63 TYR 6.12 -0.02 1 64 SER -1.51 0.48 1 65 ASP -4.84 0.41 1 67 ARG 2.81 -0.05 1 68 PHE 0.90 -0.22 1 69 LEU 5.49 -0.29 1 70 ASN 3.61 -0.38 1 71 LEU 4.56 -0.60 1 72 TRP 3.39 -0.72 1 73 LEU 5.20 -0.44 1 74 LYS 4.01 -0.41 1 75 LEU 3.85 -0.54 1 77 ARG 2.64 -0.13 1 78 LEU -0.56 0.07 1 80 ASN 3.38 -0.42 1 81 GLU -2.14 0.25 1 83 LEU 5.66 -0.17 1 84 ASP 3.69 -0.22 1 85 MET 6.11 -1.51 1 86 TYR 7.70 -1.21 1 87 SER 4.24 -0.42 1 88 TYR 3.76 -0.32 1 89 LEU 6.71 -1.25 1 90 HIS 3.63 -0.98 1 91 ASN 2.82 -0.43 1 92 GLN -0.37 -0.31 1 94 ILE 1.41 -0.61 1 96 VAL 2.78 -0.35 1 97 SER -0.33 0.55 1 98 LEU -1.36 0.97 1 99 ALA 3.80 -0.34 1 100 GLN 2.95 -0.40 1 101 PHE 4.44 -0.55 1 102 TYR 4.08 -1.00 1 103 ILE 4.81 -0.96 1 104 SER 5.58 -0.55 1 105 TRP -1.10 -1.77 1 106 ALA 3.97 -0.77 1 107 GLU 3.80 -0.26 1 108 GLU 3.80 -0.24 1 109 TYR 6.60 -0.28 1 110 GLU 4.51 -0.65 1 111 ALA 3.96 -0.05 1 112 ARG -0.27 0.20 1 113 GLU 4.28 -1.27 1 114 ASN -0.82 0.26 1 115 PHE 3.49 -0.17 1 116 ARG 5.09 -0.09 1 117 LYS 3.61 -0.56 1 118 ALA 3.64 -0.72 1 119 ASP 2.26 -0.17 1 120 ALA 4.04 -0.38 1 121 ILE 4.90 -0.68 1 122 PHE 6.10 -0.83 1 123 GLN 5.23 -0.55 1 124 GLU 4.12 -0.27 1 126 ILE 4.66 -0.59 1 127 GLN 4.83 -0.30 1 128 GLN 1.44 -0.14 1 129 LYS 5.19 -0.60 1 130 ALA 0.89 -0.20 1 131 GLU -3.36 0.51 1 133 LEU 3.38 0.10 1 134 GLU 4.43 -0.08 1 135 ARG 3.28 -0.02 1 136 LEU 3.62 -0.23 1 137 GLN 4.67 -0.25 1 138 SER 4.63 -0.22 1 139 GLN 5.07 -0.19 1 140 HIS 0.72 -1.75 1 141 ARG 4.61 -0.43 1 142 GLN 4.52 -0.28 1 143 PHE 4.28 -0.41 1 144 GLN 4.60 -1.01 1 145 ALA 2.93 -0.25 1 146 ARG 3.59 -0.29 1 147 VAL 3.65 -0.64 1 148 SER 2.35 -0.26 1 149 ARG 2.88 -0.18 1 150 GLN 2.16 -0.10 1 151 THR 2.14 -0.12 1 152 LEU 1.56 -0.06 1 153 LEU 1.09 -0.05 1 154 ALA 0.73 0.00 1 155 LEU 0.62 -0.01 1 157 LYS 0.31 0.04 1 158 GLU 0.17 -0.03 1 159 GLU -0.29 -0.01 1 160 GLU -0.85 -0.01 1 161 GLU -0.61 -0.04 1 162 GLU -0.69 -0.05 1 163 VAL 0.02 -0.03 1 164 PHE -0.36 0.11 1 165 GLU -0.85 0.03 1 166 SER -0.50 0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17960_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.84 _LACS_plot.Line_1_terminator_val_y_1 -2.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.54 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 2.86 _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 131 GLU -3.36 2.56 0 28 TYR -1.05 4.20 0 65 ASP -4.84 1.57 0 10 GLU 4.35 3.15 1 11 TYR 4.39 0.78 1 12 GLU 3.33 1.87 1 13 ILE 4.03 2.01 1 14 ARG 3.20 1.32 1 15 PHE 1.21 -0.70 1 16 TYR 2.97 1.59 1 17 THR -1.28 -0.22 1 19 ASN -1.67 0.29 1 20 ASP -0.89 -2.44 1 22 LEU 3.45 -1.26 1 23 ASP 1.56 0.89 1 24 VAL 5.07 1.52 1 25 TRP 3.39 1.57 1 26 ASP 1.56 2.72 1 27 ARG 4.30 2.63 1 29 ILE 6.31 1.29 1 30 SER 4.40 2.23 1 31 TRP 5.09 3.00 1 32 THR 7.92 1.14 1 33 GLU 3.01 1.65 1 34 GLN 2.31 1.19 1 35 ASN 0.62 -1.44 1 36 TYR 0.39 -1.04 1 38 GLN 1.21 1.01 1 42 GLU 2.07 0.01 1 43 SER 0.29 -0.15 1 44 ASN 1.17 0.71 1 45 MET 3.75 1.14 1 46 SER 5.54 1.25 1 47 THR 4.92 1.35 1 48 LEU 4.09 0.54 1 49 LEU 2.80 0.65 1 50 GLU 3.96 1.96 1 51 ARG 2.80 0.00 1 52 ALA 2.22 0.88 1 53 VAL 6.63 1.84 1 54 GLU 3.33 2.14 1 55 ALA 2.62 2.54 1 56 LEU -2.53 0.18 1 57 GLN 5.67 0.34 1 59 GLU -0.61 -1.63 1 60 LYS 3.82 2.24 1 61 ARG 4.38 0.90 1 62 TYR -0.17 1.30 1 63 TYR 6.12 1.00 1 64 SER -1.51 -2.15 1 67 ARG 2.81 3.01 1 68 PHE 0.90 1.44 1 69 LEU 5.49 0.76 1 70 ASN 3.61 1.48 1 71 LEU 4.56 0.22 1 72 TRP 3.39 2.51 1 73 LEU 5.20 3.12 1 74 LYS 4.01 2.55 1 75 LEU 3.85 2.41 1 77 ARG 2.64 0.92 1 78 LEU -0.56 -1.08 1 80 ASN 3.38 0.29 1 81 GLU -2.14 -1.21 1 83 LEU 5.66 1.87 1 84 ASP 3.69 2.02 1 85 MET 6.11 0.99 1 86 TYR 7.70 1.50 1 87 SER 4.24 1.56 1 88 TYR 3.76 1.16 1 89 LEU 6.71 1.59 1 90 HIS 3.63 3.32 1 91 ASN 2.82 1.88 1 92 GLN -0.37 -0.24 1 94 ILE 1.41 -2.69 1 96 VAL 2.78 0.78 1 97 SER -0.33 -0.51 1 98 LEU -1.36 -0.79 1 99 ALA 3.80 1.17 1 100 GLN 2.95 0.99 1 101 PHE 4.44 -1.23 1 102 TYR 4.08 1.00 1 103 ILE 4.81 0.95 1 104 SER 5.58 1.18 1 105 TRP -1.10 1.50 1 106 ALA 3.97 2.83 1 107 GLU 3.80 2.64 1 108 GLU 3.80 2.37 1 109 TYR 6.60 3.57 1 110 GLU 4.51 3.40 1 111 ALA 3.96 0.81 1 112 ARG -0.27 -0.99 1 113 GLU 4.28 -2.33 1 114 ASN -0.82 0.38 1 115 PHE 3.49 2.38 1 116 ARG 5.09 3.07 1 117 LYS 3.61 0.96 1 118 ALA 3.64 0.29 1 119 ASP 2.26 1.25 1 120 ALA 4.04 2.83 1 121 ILE 4.90 2.16 1 122 PHE 6.10 2.58 1 123 GLN 5.23 2.65 1 124 GLU 4.12 1.50 1 126 ILE 4.66 3.99 1 127 GLN 4.83 2.38 1 128 GLN 1.44 -1.03 1 129 LYS 5.19 -1.27 1 130 ALA 0.89 -2.18 1 133 LEU 3.38 1.50 1 134 GLU 4.43 2.89 1 135 ARG 3.28 2.04 1 136 LEU 3.62 1.08 1 137 GLN 4.67 2.84 1 138 SER 4.63 3.31 1 139 GLN 5.07 2.52 1 140 HIS 0.72 3.10 1 141 ARG 4.61 3.54 1 142 GLN 4.52 2.57 1 143 PHE 4.28 0.32 1 144 GLN 4.60 2.61 1 145 ALA 2.93 1.95 1 146 ARG 3.59 2.62 1 147 VAL 3.65 1.26 1 148 SER 2.35 0.89 1 149 ARG 2.88 1.07 1 150 GLN 2.16 1.28 1 151 THR 2.14 0.20 1 152 LEU 1.56 0.27 1 153 LEU 1.09 -0.09 1 154 ALA 0.73 0.21 1 155 LEU 0.62 0.13 1 156 GLU 0.25 -0.15 1 157 LYS 0.31 -0.13 1 158 GLU 0.17 -0.04 1 159 GLU -0.29 -0.22 1 160 GLU -0.85 -0.28 1 161 GLU -0.61 -0.37 1 162 GLU -0.69 -0.71 1 163 VAL 0.02 -0.66 1 164 PHE -0.36 -0.24 1 165 GLU -0.85 -0.67 1 166 SER -0.50 -0.86 1 167 SER 0.77 4.10 1 stop_ save_