#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtk s PRO 173 N 0.00 0.90 -0.65 0.03 0.04 -1.26 -4.96 135.00 129.10 2jtk s PRO 173 Ca 0.00 0.70 -0.25 0.00 0.04 0.00 0.00 61.00 61.49 2jtk s PRO 173 Cb 0.00 -1.78 0.05 0.00 0.04 0.00 0.00 34.50 32.81 2jtk s PRO 173 CO 0.00 -2.45 1.08 -1.01 0.04 0.00 0.00 177.00 174.65 2jtk s HIS 174 N -2.94 2.58 -0.20 0.56 3.76 -1.26 -5.01 115.29 112.78 2jtk s HIS 174 Ca 0.64 -0.18 -0.11 0.00 -0.15 0.00 0.00 55.06 55.27 2jtk s HIS 174 Cb -0.18 -4.36 -0.05 0.00 1.11 0.00 0.00 32.58 29.10 2jtk s HIS 174 CO 0.57 -1.70 0.16 -1.50 -0.85 0.00 0.00 174.74 171.43 2jtk s ILE 175 N 4.62 5.38 0.66 0.60 2.07 -1.26 -5.09 121.20 128.19 2jtk s ILE 175 Ca 0.30 0.26 -0.03 0.00 -1.41 0.00 0.00 60.65 59.76 2jtk s ILE 175 Cb -0.12 -3.50 0.07 0.00 0.13 0.00 0.00 42.46 39.03 2jtk s ILE 175 CO 0.15 0.42 0.94 -1.59 -1.91 0.00 0.00 174.94 172.95 2jtk s LYS 176 N 0.47 2.17 0.00 3.50 -2.85 -1.26 -3.03 119.74 118.74 2jtk s LYS 176 Ca 0.10 -0.59 0.00 0.00 -1.00 0.00 0.00 55.97 54.48 2jtk s LYS 176 Cb -0.12 -2.29 0.00 0.00 -2.06 0.00 0.00 37.83 33.36 2jtk s LYS 176 CO -0.00 -1.14 0.00 0.41 0.10 0.00 0.00 175.35 174.72 2jtk n GLY 177 N -2.74 0.11 2.42 0.59 0.00 -1.26 -4.72 105.19 99.60 2jtk n GLY 177 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.07 2jtk n GLY 177 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jtk n HIS 178 N -1.34 0.00 -2.49 1.61 8.25 -1.26 -3.61 115.22 116.38 2jtk n HIS 178 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 2jtk n HIS 178 Cb 0.00 -1.39 0.00 0.00 1.12 0.00 0.00 29.99 29.73 2jtk n HIS 178 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2jtk n GLU 179 N -1.66 -2.36 0.00 -0.41 0.00 -1.25 -4.87 120.64 110.09 2jtk n GLU 179 Ca -0.04 2.07 0.00 0.00 0.00 0.00 0.00 57.16 59.19 2jtk n GLU 179 Cb 0.29 -4.56 0.00 0.00 0.00 0.00 0.00 31.44 27.17 2jtk n GLU 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jtk n GLY 180 N 0.17 1.26 3.06 8.31 0.00 -1.14 -5.02 105.19 111.83 2jtk n GLY 180 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 2jtk n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jtk s ASP 181 N -1.62 1.45 0.12 1.61 1.11 -1.24 -4.92 116.67 113.17 2jtk s ASP 181 Ca 0.00 -0.22 -0.31 0.00 0.18 0.00 0.00 52.55 52.20 2jtk s ASP 181 Cb 0.00 -0.24 -0.08 0.00 1.07 0.00 0.00 42.92 43.67 2jtk s ASP 181 CO 0.00 0.13 1.36 -2.16 1.18 0.00 0.00 175.17 175.68 2jtk s PRO 182 N -0.13 4.34 0.15 8.23 0.04 -1.26 0.01 135.00 146.38 2jtk s PRO 182 Ca 0.02 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.16 2jtk s PRO 182 Cb -0.06 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 2jtk s PRO 182 CO 0.00 -0.40 -0.15 0.00 0.04 0.00 0.00 177.00 176.49 2jtk n LEU 184 N 0.26 0.00 -4.54 0.00 -0.00 -1.26 -4.75 117.00 106.71 2jtk n LEU 184 Ca -0.13 -0.86 -0.25 0.00 -0.00 0.00 0.00 56.01 54.77 2jtk n LEU 184 Cb 0.58 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.89 2jtk n LEU 184 CO 0.29 0.51 -0.27 -0.60 -0.00 0.00 0.00 177.39 177.32 2jtk s ARG 185 N 0.00 1.82 0.58 1.47 3.00 -1.26 -5.01 118.95 119.55 2jtk s ARG 185 Ca 0.00 -2.03 0.29 0.00 -1.00 0.00 0.00 55.73 52.99 2jtk s ARG 185 Cb 0.00 -1.18 1.44 0.00 0.00 0.00 0.00 34.95 35.21 2jtk s ARG 185 CO 0.00 -0.17 1.84 0.77 0.00 0.00 0.00 175.30 177.75 2jtk h SER 186 N 1.92 0.00 0.00 -2.12 0.02 -1.99 -3.40 113.55 107.97 2jtk h SER 186 Ca -0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2jtk h SER 186 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2jtk h SER 186 CO 0.73 0.00 0.00 -1.20 -1.14 0.00 0.00 176.83 175.22 2jtk n SER 187 N -3.76 0.00 -3.88 3.07 7.64 -1.26 -4.66 113.62 110.76 2jtk n SER 187 Ca 0.12 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.75 2jtk n SER 187 Cb 0.81 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 64.00 2jtk n SER 187 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jtk n ASP 188 N -1.09 -0.85 -3.94 6.43 9.92 -1.26 -3.64 116.55 122.12 2jtk n ASP 188 Ca 0.00 -0.97 -0.11 0.00 -0.53 0.00 0.00 54.79 53.17 2jtk n ASP 188 Cb 0.00 -3.26 -0.07 0.00 -0.64 0.00 0.00 41.12 37.15 2jtk n ASP 188 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jtk n ILE 190 N -0.38 0.90 -0.38 0.00 2.08 -1.26 -4.54 119.36 115.77 2jtk n ILE 190 Ca 0.00 -0.32 0.31 0.00 0.56 0.00 0.00 62.75 63.30 2jtk n ILE 190 Cb 0.63 -0.63 0.61 0.00 -0.75 0.00 0.00 39.64 39.50 2jtk n ILE 190 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 2jtk h ASP 191 N -0.90 0.29 -0.91 4.38 3.32 -2.01 0.22 116.42 120.80 2jtk h ASP 191 Ca -0.44 0.09 -0.59 0.00 0.02 0.00 0.00 57.03 56.10 2jtk h ASP 191 Cb 1.32 0.05 -0.39 0.00 0.22 0.00 0.00 39.33 40.53 2jtk h ASP 191 CO 0.38 -0.03 -0.38 0.61 -1.72 0.00 0.00 179.24 178.10 2jtk n GLY 192 N -1.56 6.23 3.12 2.75 0.00 -1.26 -5.01 105.19 109.46 2jtk n GLY 192 Ca 0.30 -2.59 -0.08 0.00 0.00 0.00 0.00 46.02 43.65 2jtk n GLY 192 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jtk s PHE 193 N -3.66 0.67 0.00 1.61 0.40 0.76 -3.82 117.98 113.94 2jtk s PHE 193 Ca 0.54 -1.04 0.01 0.00 -0.60 0.00 0.00 56.93 55.84 2jtk s PHE 193 Cb 0.43 -0.44 -0.01 0.00 0.51 0.00 0.00 43.02 43.51 2jtk s PHE 193 CO -0.00 -0.33 -0.05 0.00 0.70 0.00 0.00 175.22 175.54 2jtk s ALA 196 N 1.94 3.24 -0.21 0.00 0.00 -0.72 -4.90 121.76 121.12 2jtk s ALA 196 Ca 0.49 -2.20 -0.11 0.00 0.00 0.00 0.00 51.96 50.14 2jtk s ALA 196 Cb -0.18 0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 2jtk s ALA 196 CO 0.19 -0.12 0.16 1.03 0.00 0.00 0.00 175.76 177.02 2jtk s ARG 197 N -3.73 4.17 0.16 0.00 3.00 -1.15 -2.92 118.95 118.48 2jtk s ARG 197 Ca 0.34 -0.18 0.11 0.00 0.00 0.00 0.00 55.73 55.99 2jtk s ARG 197 Cb 0.09 -3.45 -0.04 0.00 0.00 0.00 0.00 34.95 31.55 2jtk s ARG 197 CO 0.17 0.22 -0.25 -1.01 0.00 0.00 0.00 175.30 174.44 2jtk s HIS 198 N 0.57 2.24 0.00 -0.53 3.76 -1.15 -3.33 115.29 116.86 2jtk s HIS 198 Ca 0.09 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.62 2jtk s HIS 198 Cb -0.12 -1.17 0.00 0.00 1.11 0.00 0.00 32.58 32.40 2jtk s HIS 198 CO 0.01 0.40 0.87 1.19 -0.85 0.00 0.00 174.74 176.35 2jtk n PHE 199 N 0.62 0.00 -0.14 1.40 3.01 -1.26 -2.82 117.46 118.27 2jtk n PHE 199 Ca -0.16 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.17 2jtk n PHE 199 Cb 0.54 -0.37 -0.09 0.00 -0.01 0.00 0.00 39.48 39.55 2jtk n PHE 199 CO 0.00 0.00 0.00 -1.49 1.01 0.00 0.00 176.76 176.28 2jtk h TRP 200 N 0.00 -1.62 -3.00 1.38 4.06 -2.05 -3.46 115.95 111.26 2jtk h TRP 200 Ca 0.00 0.08 0.06 0.00 2.06 0.00 0.00 58.89 61.09 2jtk h TRP 200 Cb 0.00 0.76 -0.04 0.00 -1.00 0.00 0.00 29.16 28.88 2jtk h TRP 200 CO -0.37 -0.46 0.24 -0.08 -3.56 0.00 0.00 178.44 174.21 2jtk s THR 201 N -5.48 0.00 -0.21 1.49 -1.32 -1.13 -5.13 115.64 103.87 2jtk s THR 201 Ca -0.13 -1.00 -0.29 0.00 -1.21 0.00 0.00 61.69 59.05 2jtk s THR 201 Cb 0.08 -2.12 -0.01 0.00 -1.51 0.00 0.00 72.50 68.94 2jtk s THR 201 CO 0.58 0.00 1.24 -0.75 -2.21 0.00 0.00 174.62 173.48 2jtk s LYS 202 N -3.70 4.16 0.39 7.08 2.20 -1.26 -2.91 119.74 125.70 2jtk s LYS 202 Ca 0.12 1.52 0.04 0.00 -0.36 0.00 0.00 55.97 57.29 2jtk s LYS 202 Cb -0.06 -3.77 -0.06 0.00 -1.51 0.00 0.00 37.83 32.43 2jtk s LYS 202 CO 0.08 -0.79 0.04 0.96 -0.36 0.00 0.00 175.35 175.28 2jtk s ILE 203 N 3.65 1.39 -0.15 5.43 -4.36 -1.15 -2.75 121.20 123.26 2jtk s ILE 203 Ca 0.53 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.81 2jtk s ILE 203 Cb -0.20 -2.71 -0.05 0.00 1.25 0.00 0.00 42.46 40.76 2jtk s ILE 203 CO 0.15 0.00 0.22 0.00 0.24 0.00 0.00 174.94 175.55 2jtk s LYS 205 N -0.05 1.20 1.17 0.00 1.02 0.11 -2.88 119.74 120.32 2jtk s LYS 205 Ca 0.14 -1.40 -0.18 0.00 0.02 0.00 0.00 55.97 54.55 2jtk s LYS 205 Cb -0.12 -1.12 0.27 0.00 -0.52 0.00 0.00 37.83 36.33 2jtk s LYS 205 CO 0.03 0.21 1.11 -1.25 -0.92 0.00 0.00 175.35 174.53 2jtk s PRO 206 N -2.99 -0.98 0.69 -1.68 0.04 -1.26 0.01 135.00 128.83 2jtk s PRO 206 Ca 0.15 0.02 -0.11 0.00 0.04 0.00 0.00 61.00 61.10 2jtk s PRO 206 Cb -0.04 -1.62 0.01 0.00 0.04 0.00 0.00 34.50 32.89 2jtk s PRO 206 CO 0.05 -3.57 1.07 0.14 0.04 0.00 0.00 177.00 174.73 2jtk s VAL 207 N -3.00 3.94 0.45 -0.36 -7.23 -1.25 -4.45 120.40 108.50 2jtk s VAL 207 Ca 0.70 0.63 0.08 0.00 -1.81 0.00 0.00 61.98 61.58 2jtk s VAL 207 Cb -0.11 -3.50 0.03 0.00 0.56 0.00 0.00 36.38 33.35 2jtk s VAL 207 CO 0.56 -0.82 0.61 -0.76 -0.31 0.00 0.00 175.10 174.38 2jtk s LEU 208 N -5.44 3.53 0.22 1.32 1.43 -0.96 -4.88 118.68 113.91 2jtk s LEU 208 Ca 0.58 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2jtk s LEU 208 Cb -0.13 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2jtk s LEU 208 CO 0.54 -0.88 0.16 -2.28 0.23 0.00 0.00 176.35 174.12 2jtk s HIS 209 N -2.42 1.26 -0.04 0.29 2.46 -1.26 0.22 115.29 115.80 2jtk s HIS 209 Ca 0.56 -1.42 -0.39 0.00 0.47 0.00 0.00 55.06 54.27 2jtk s HIS 209 Cb -0.09 -0.58 -0.18 0.00 -0.13 0.00 0.00 32.58 31.60 2jtk s HIS 209 CO 0.34 -0.68 1.29 0.94 -2.47 0.00 0.00 174.74 174.15 2jtk n GLN 210 N -0.33 0.56 0.00 2.88 0.00 -1.26 -0.52 117.38 118.70 2jtk n GLN 210 Ca 0.03 0.20 0.00 0.00 -0.00 0.00 0.00 57.00 57.23 2jtk n GLN 210 Cb 0.65 -1.78 0.00 0.00 0.00 0.00 0.00 30.24 29.12 2jtk n GLN 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jtk n GLY 211 N 2.38 3.06 3.90 1.69 0.00 0.99 -4.93 105.19 112.29 2jtk n GLY 211 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 2jtk n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jtk s GLU 212 N -0.89 3.14 0.35 1.61 8.01 0.32 -4.69 118.70 126.55 2jtk s GLU 212 Ca 0.00 0.26 -0.28 0.00 0.01 0.00 0.00 54.97 54.96 2jtk s GLU 212 Cb 0.00 -2.21 -0.10 0.00 -4.31 0.00 0.00 34.13 27.51 2jtk s GLU 212 CO 0.00 -0.65 1.35 0.08 0.01 0.00 0.00 175.26 176.05 2jtk s VAL 213 N -3.05 2.53 0.21 2.63 1.01 -1.26 -0.04 120.40 122.43 2jtk s VAL 213 Ca 0.54 0.53 0.12 0.00 0.00 0.00 0.00 61.98 63.16 2jtk s VAL 213 Cb -0.11 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2jtk s VAL 213 CO 0.48 0.12 -0.23 0.00 0.00 0.00 0.00 175.10 175.47 2jtk s THR 215 N -1.81 0.45 -0.28 0.00 -4.23 -1.26 -3.27 115.64 105.24 2jtk s THR 215 Ca 0.22 -0.52 0.03 0.00 -1.18 0.00 0.00 61.69 60.24 2jtk s THR 215 Cb -0.07 -0.98 0.01 0.00 1.34 0.00 0.00 72.50 72.80 2jtk s THR 215 CO 0.11 -0.23 0.48 2.29 -0.54 0.00 0.00 174.62 176.73 2jtk n LYS 216 N 5.08 0.78 -3.38 3.99 2.85 -1.26 -4.95 118.16 121.27 2jtk n LYS 216 Ca -0.09 -0.52 -0.11 0.00 -1.05 0.00 0.00 58.31 56.55 2jtk n LYS 216 Cb 0.47 -0.96 -0.09 0.00 -0.65 0.00 0.00 35.03 33.81 2jtk n LYS 216 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 2jtk s GLN 217 N -0.42 0.32 -0.04 -1.58 -0.44 -1.26 -5.13 119.66 111.11 2jtk s GLN 217 Ca 0.03 0.46 -0.02 0.00 -2.50 0.00 0.00 55.36 53.33 2jtk s GLN 217 Cb 0.02 -0.62 0.03 0.00 -1.64 0.00 0.00 33.01 30.80 2jtk s GLN 217 CO 0.04 -0.66 0.05 1.03 0.50 0.00 0.00 175.29 176.26 2jtk s ARG 218 N 2.50 -0.07 -0.20 1.67 0.52 -1.26 -4.83 118.95 117.28 2jtk s ARG 218 Ca 0.12 0.34 -0.02 0.00 -0.52 0.00 0.00 55.73 55.64 2jtk s ARG 218 Cb -0.15 -0.45 -0.00 0.00 0.52 0.00 0.00 34.95 34.87 2jtk s ARG 218 CO -0.16 -0.29 -0.09 -1.59 0.02 0.00 0.00 175.30 173.19 2jtk s LYS 219 N 1.92 3.27 -0.04 3.54 -2.85 -1.26 -5.09 119.74 119.24 2jtk s LYS 219 Ca 0.02 -0.68 -0.00 0.00 -1.00 0.00 0.00 55.97 54.30 2jtk s LYS 219 Cb -0.12 -2.87 0.03 0.00 -2.06 0.00 0.00 37.83 32.81 2jtk s LYS 219 CO -0.03 -0.17 0.01 0.21 0.10 0.00 0.00 175.35 175.47 2jtk s LYS 220 N 1.35 0.28 0.00 1.78 2.36 -1.26 -4.89 119.74 119.35 2jtk s LYS 220 Ca 0.04 0.13 0.00 0.00 -2.55 0.00 0.00 55.97 53.60 2jtk s LYS 220 Cb -0.14 -0.56 0.00 0.00 -1.05 0.00 0.00 37.83 36.08 2jtk s LYS 220 CO -0.05 -0.19 0.00 0.41 1.55 0.00 0.00 175.35 177.06 2jtk n GLY 221 N 4.49 1.42 3.68 5.54 0.00 -1.26 -5.15 105.19 113.91 2jtk n GLY 221 Ca -0.20 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 2jtk n GLY 221 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jtk s SER 222 N 0.00 2.58 0.25 1.61 0.15 -1.26 -4.97 113.70 112.05 2jtk s SER 222 Ca 0.00 1.15 -0.30 0.00 0.70 0.00 0.00 55.95 57.50 2jtk s SER 222 Cb 0.00 -1.81 -0.09 0.00 -1.71 0.00 0.00 66.02 62.41 2jtk s SER 222 CO 0.00 -3.15 1.26 -1.00 1.20 0.00 0.00 173.24 171.55 2jtk s HIS 223 N -2.99 3.27 -0.08 3.44 0.09 -1.26 -4.25 115.29 113.51 2jtk s HIS 223 Ca 0.65 1.38 -0.01 0.00 -0.00 0.00 0.00 55.06 57.08 2jtk s HIS 223 Cb -0.18 -3.55 0.00 0.00 -0.00 0.00 0.00 32.58 28.84 2jtk s HIS 223 CO 0.57 -1.58 0.08 0.41 -0.00 0.00 0.00 174.74 174.22 2jtk n GLY 224 N 1.71 -0.55 3.73 -2.22 0.00 -1.26 -5.09 105.19 101.50 2jtk n GLY 224 Ca 0.03 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2jtk n GLY 224 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2jtk s LEU 225 N -1.86 3.17 0.01 0.99 0.05 -1.26 -5.08 118.68 114.70 2jtk s LEU 225 Ca 0.01 -0.92 0.08 0.00 0.05 0.00 0.00 54.13 53.35 2jtk s LEU 225 Cb -0.00 -1.58 -0.03 0.00 -2.05 0.00 0.00 46.19 42.53 2jtk s LEU 225 CO 0.10 -0.40 -0.24 -1.61 -0.55 0.00 0.00 176.35 173.64 2jtk s GLU 226 N -3.86 1.99 0.37 1.48 2.02 -1.26 -5.12 118.70 114.32 2jtk s GLU 226 Ca 0.39 -1.00 -0.26 0.00 0.02 0.00 0.00 54.97 54.12 2jtk s GLU 226 Cb 0.00 -2.05 -0.09 0.00 0.10 0.00 0.00 34.13 32.09 2jtk s GLU 226 CO 0.22 0.54 1.12 0.42 0.02 0.00 0.00 175.26 177.58 2jtk s ILE 227 N -0.74 3.39 -0.26 -1.63 1.01 -1.26 -5.03 121.20 116.67 2jtk s ILE 227 Ca 0.11 1.19 0.03 0.00 0.00 0.00 0.00 60.65 61.98 2jtk s ILE 227 Cb -0.10 -3.67 0.07 0.00 0.01 0.00 0.00 42.46 38.76 2jtk s ILE 227 CO 0.01 0.13 -0.08 0.72 0.00 0.00 0.00 174.94 175.72 2jtk s PHE 228 N -1.43 3.12 -1.09 3.97 -0.71 -1.26 -5.05 117.98 115.54 2jtk s PHE 228 Ca 0.54 -2.28 -0.08 0.00 -1.04 0.00 0.00 56.93 54.08 2jtk s PHE 228 Cb -0.28 -1.97 0.27 0.00 -1.21 0.00 0.00 43.02 39.83 2jtk s PHE 228 CO 0.36 -0.87 1.10 0.94 -1.34 0.00 0.00 175.22 175.42 2jtk n GLN 229 N 4.47 3.50 -3.67 1.99 7.27 -1.21 -2.93 117.38 126.79 2jtk n GLN 229 Ca -0.11 -4.47 -0.09 0.00 0.07 0.00 0.00 57.00 52.40 2jtk n GLN 229 Cb 0.42 -2.53 -0.02 0.00 2.41 0.00 0.00 30.24 30.53 2jtk n GLN 229 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2jtk s ARG 230 N -1.43 1.52 0.27 3.69 3.00 -1.26 -4.92 118.95 119.82 2jtk s ARG 230 Ca 0.31 -0.74 0.02 0.00 0.00 0.00 0.00 55.73 55.31 2jtk s ARG 230 Cb -0.08 0.58 -0.05 0.00 0.00 0.00 0.00 34.95 35.40 2jtk s ARG 230 CO -0.07 -0.68 0.12 0.00 0.00 0.00 0.00 175.30 174.66 2jtk s ASP 232 N -3.32 4.47 0.80 0.00 -1.08 -1.26 -4.67 116.67 111.60 2jtk s ASP 232 Ca 0.37 1.81 -0.12 0.00 -0.52 0.00 0.00 52.55 54.09 2jtk s ASP 232 Cb 0.07 -2.51 0.07 0.00 -1.46 0.00 0.00 42.92 39.09 2jtk s ASP 232 CO 0.15 -2.06 1.14 0.00 0.52 0.00 0.00 175.17 174.92 2jtk s ALA 234 N -3.41 2.01 0.19 0.00 0.00 0.13 -4.65 121.76 116.04 2jtk s ALA 234 Ca 0.61 0.26 -0.32 0.00 0.00 0.00 0.00 51.96 52.51 2jtk s ALA 234 Cb -0.12 -3.29 -0.12 0.00 0.00 0.00 0.00 23.12 19.59 2jtk s ALA 234 CO 0.51 -2.01 1.71 1.17 0.00 0.00 0.00 175.76 177.14 2jtk n LYS 235 N -3.69 2.68 -0.13 0.00 4.81 -1.26 -2.44 118.16 118.12 2jtk n LYS 235 Ca 0.09 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.50 2jtk n LYS 235 Cb 0.53 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.78 2jtk n LYS 235 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jtk n GLY 236 N 3.91 0.93 3.46 3.14 0.00 -1.26 -5.02 105.19 110.34 2jtk n GLY 236 Ca 0.16 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 2jtk n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jtk s LEU 237 N 0.00 2.58 0.11 0.99 1.43 -1.02 -0.21 118.68 122.56 2jtk s LEU 237 Ca 0.00 -0.72 0.07 0.00 -1.03 0.00 0.00 54.13 52.45 2jtk s LEU 237 Cb 0.00 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2jtk s LEU 237 CO 0.00 0.14 -0.09 -0.55 0.23 0.00 0.00 176.35 176.08 2jtk s SER 238 N -2.49 4.43 -0.42 2.29 0.15 0.87 -4.85 113.70 113.67 2jtk s SER 238 Ca 0.20 -0.38 -0.17 0.00 0.70 0.00 0.00 55.95 56.30 2jtk s SER 238 Cb -0.09 -0.85 0.02 0.00 -1.71 0.00 0.00 66.02 63.39 2jtk s SER 238 CO 0.10 0.17 0.42 0.00 1.20 0.00 0.00 173.24 175.14 2jtk s LYS 240 N 2.09 2.38 0.41 0.00 -0.14 -0.66 -4.99 119.74 118.84 2jtk s LYS 240 Ca 0.11 -0.83 -0.27 0.00 -1.36 0.00 0.00 55.97 53.62 2jtk s LYS 240 Cb -0.17 -2.21 -0.10 0.00 -1.68 0.00 0.00 37.83 33.67 2jtk s LYS 240 CO 0.13 0.54 1.46 0.28 -0.76 0.00 0.00 175.35 177.00 2jtk n VAL 241 N 2.53 2.37 -3.81 3.17 0.31 -1.26 -0.15 118.33 121.49 2jtk n VAL 241 Ca -0.17 -0.50 -0.27 0.00 -0.01 0.00 0.00 64.34 63.39 2jtk n VAL 241 Cb 0.52 -1.92 -0.17 0.00 -0.91 0.00 0.00 33.84 31.36 2jtk n VAL 241 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 2jtk s TRP 242 N -1.15 1.25 -0.53 3.52 -0.00 -0.42 -4.65 118.94 116.96 2jtk s TRP 242 Ca 0.57 -0.83 -0.28 0.00 -0.00 0.00 0.00 56.10 55.56 2jtk s TRP 242 Cb -0.46 -1.11 0.02 0.00 -0.00 0.00 0.00 33.47 31.92 2jtk s TRP 242 CO 0.61 -0.56 1.26 0.21 -0.00 0.00 0.00 176.95 178.47 2jtk s LYS 243 N 1.78 3.53 0.01 5.86 2.20 -1.26 -4.27 119.74 127.60 2jtk s LYS 243 Ca 0.01 0.47 -0.04 0.00 -0.36 0.00 0.00 55.97 56.05 2jtk s LYS 243 Cb -0.15 -4.01 -0.01 0.00 -1.51 0.00 0.00 37.83 32.14 2jtk s LYS 243 CO -0.07 -1.65 0.05 0.34 -0.36 0.00 0.00 175.35 173.66 2jtk s ASP 244 N 3.27 0.14 -1.09 1.43 -1.08 -1.26 -5.06 116.67 113.03 2jtk s ASP 244 Ca 0.49 -0.38 -0.25 0.00 -0.52 0.00 0.00 52.55 51.89 2jtk s ASP 244 Cb -0.09 0.15 -0.17 0.00 -1.46 0.00 0.00 42.92 41.36 2jtk s ASP 244 CO 0.28 -0.35 2.00 0.00 0.52 0.00 0.00 175.17 177.63 2jtk n ALA 245 N 1.47 1.09 0.00 3.66 0.00 -1.26 -3.13 120.51 122.34 2jtk n ALA 245 Ca -0.23 -2.66 0.00 0.00 0.00 0.00 0.00 53.44 50.55 2jtk n ALA 245 Cb 0.55 -3.44 0.00 0.00 0.00 0.00 0.00 19.45 16.57 2jtk n ALA 245 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2jtk n THR 246 N 8.31 0.00 0.27 0.00 -1.04 -1.26 -4.91 114.28 115.66 2jtk n THR 246 Ca 0.43 0.00 0.18 0.00 -2.04 0.00 0.00 64.05 62.62 2jtk n THR 246 Cb 0.46 0.00 0.97 0.00 -1.82 0.00 0.00 70.33 69.94 2jtk n THR 246 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 2jtk h TYR 247 N 0.00 0.00 -0.58 -1.42 -0.00 -1.73 -2.23 116.97 111.01 2jtk h TYR 247 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 58.73 58.90 2jtk h TYR 247 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.71 2jtk h TYR 247 CO 0.00 0.00 0.59 1.03 -0.00 0.00 0.00 178.16 179.78 2jtk h SER 248 N 0.00 0.00 -0.09 0.10 0.87 -1.84 -0.91 113.55 111.69 2jtk h SER 248 Ca 0.00 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.60 2jtk h SER 248 Cb 0.04 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.96 2jtk h SER 248 CO 0.00 0.00 -0.15 0.28 -0.53 0.00 0.00 176.83 176.43 2jtk h SER 249 N 0.00 -0.45 0.00 6.23 0.02 -1.82 -3.47 113.55 114.06 2jtk h SER 249 Ca 0.28 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 2jtk h SER 249 Cb 1.45 0.21 0.00 0.00 0.14 0.00 0.00 62.40 64.20 2jtk h SER 249 CO -0.00 -0.20 0.00 0.29 -1.14 0.00 0.00 176.83 175.78 2jtk n LYS 250 N -5.29 0.00 -1.85 3.45 5.02 -0.35 -5.12 118.16 114.02 2jtk n LYS 250 Ca -0.04 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.96 2jtk n LYS 250 Cb 0.21 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.28 2jtk n LYS 250 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jtk s ALA 251 N -1.21 2.74 0.26 7.82 0.00 -1.25 -5.04 121.76 125.07 2jtk s ALA 251 Ca 0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 51.96 51.42 2jtk s ALA 251 Cb 0.00 -3.01 -0.07 0.00 0.00 0.00 0.00 23.12 20.04 2jtk s ALA 251 CO 0.00 -1.39 0.59 0.50 0.00 0.00 0.00 175.76 175.46 2jtk s ARG 252 N -5.41 3.82 -0.12 0.00 6.06 -1.26 -4.30 118.95 117.74 2jtk s ARG 252 Ca 0.60 0.33 -0.08 0.00 -2.50 0.00 0.00 55.73 54.08 2jtk s ARG 252 Cb -0.11 -2.60 -0.04 0.00 0.06 0.00 0.00 34.95 32.25 2jtk s ARG 252 CO 0.51 0.27 0.16 -1.17 -2.50 0.00 0.00 175.30 172.57 2jtk s LEU 253 N -2.94 4.37 0.33 -0.88 0.20 -1.26 -4.97 118.68 113.54 2jtk s LEU 253 Ca 0.48 0.48 0.04 0.00 0.69 0.00 0.00 54.13 55.82 2jtk s LEU 253 Cb -0.11 -2.12 -0.06 0.00 -0.43 0.00 0.00 46.19 43.47 2jtk s LEU 253 CO 0.21 0.37 0.06 -1.00 -0.29 0.00 0.00 176.35 175.71 2jtk s HIS 254 N -0.84 1.94 0.15 5.38 3.76 -1.20 -1.30 115.29 123.17 2jtk s HIS 254 Ca 0.15 -0.98 0.04 0.00 -0.15 0.00 0.00 55.06 54.12 2jtk s HIS 254 Cb -0.12 -1.26 -0.04 0.00 1.11 0.00 0.00 32.58 32.26 2jtk s HIS 254 CO 0.04 -0.02 -0.09 0.54 -0.85 0.00 0.00 174.74 174.36 2jtk s VAL 255 N -3.32 1.10 0.07 -0.90 0.11 0.79 -0.06 120.40 118.18 2jtk s VAL 255 Ca 0.36 -2.05 -0.03 0.00 -2.93 0.00 0.00 61.98 57.33 2jtk s VAL 255 Cb 0.08 -1.88 -0.05 0.00 -1.53 0.00 0.00 36.38 33.01 2jtk s VAL 255 CO 0.15 -0.72 0.26 0.00 -3.33 0.00 0.00 175.10 171.47 2jtk s GLN 257 N -2.35 0.14 -0.24 0.00 -0.21 -0.62 -0.01 119.66 116.38 2jtk s GLN 257 Ca 0.34 0.14 -0.29 0.00 0.02 0.00 0.00 55.36 55.57 2jtk s GLN 257 Cb -0.13 -0.38 -0.03 0.00 1.00 0.00 0.00 33.01 33.47 2jtk s GLN 257 CO 0.24 -0.16 1.68 0.21 -2.12 0.00 0.00 175.29 175.14 2jtk s LYS 258 N 1.10 3.68 0.00 2.91 2.47 -1.26 -0.09 119.74 128.55 2jtk s LYS 258 Ca -0.09 1.64 0.12 0.00 -1.56 0.00 0.00 55.97 56.08 2jtk s LYS 258 Cb -0.13 -4.08 0.70 0.00 -1.46 0.00 0.00 37.83 32.85 2jtk s LYS 258 CO -0.02 -1.44 1.13 -0.89 0.16 0.00 0.00 175.35 174.29