#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pq8 s TYR 178 N 0.00 3.47 0.11 5.64 2.02 -1.26 -3.93 117.35 123.40 2pq8 s TYR 178 Ca 0.00 0.93 -0.31 0.00 -0.37 0.00 0.00 57.07 57.32 2pq8 s TYR 178 Cb 0.00 -2.64 -0.09 0.00 -0.40 0.00 0.00 41.96 38.83 2pq8 s TYR 178 CO 0.00 -0.66 1.65 0.08 -1.57 0.00 0.00 175.55 175.05 2pq8 s VAL 179 N -3.01 2.81 0.00 0.71 1.01 -1.26 -4.80 120.40 115.85 2pq8 s VAL 179 Ca 0.53 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2pq8 s VAL 179 Cb -0.11 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.02 2pq8 s VAL 179 CO 0.48 0.01 0.06 -0.90 0.00 0.00 0.00 175.10 174.75 2pq8 n ASP 180 N 5.06 0.12 -3.71 3.32 5.68 -1.26 -4.80 116.55 120.96 2pq8 n ASP 180 Ca 0.15 -0.47 -0.12 0.00 -0.50 0.00 0.00 54.79 53.85 2pq8 n ASP 180 Cb 0.39 0.63 -0.10 0.00 -1.14 0.00 0.00 41.12 40.90 2pq8 n ASP 180 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2pq8 s LYS 181 N -0.63 0.50 0.17 0.11 2.20 -1.26 -0.89 119.74 119.94 2pq8 s LYS 181 Ca 0.00 0.70 0.11 0.00 -0.36 0.00 0.00 55.97 56.42 2pq8 s LYS 181 Cb 0.00 0.18 -0.04 0.00 -1.51 0.00 0.00 37.83 36.45 2pq8 s LYS 181 CO 0.00 -0.09 -0.23 0.96 -0.36 0.00 0.00 175.35 175.62 2pq8 s ILE 182 N 0.61 2.42 -0.17 5.43 -4.36 -0.46 -1.38 121.20 123.29 2pq8 s ILE 182 Ca -0.03 -1.90 -0.00 0.00 -0.26 0.00 0.00 60.65 58.46 2pq8 s ILE 182 Cb -0.05 -2.14 0.00 0.00 1.25 0.00 0.00 42.46 41.53 2pq8 s ILE 182 CO -0.04 -0.05 -0.15 -2.28 0.24 0.00 0.00 174.94 172.66 2pq8 s HIS 183 N -1.48 2.80 -0.08 1.37 5.65 -0.14 -1.22 115.29 122.19 2pq8 s HIS 183 Ca 0.19 -1.16 -0.03 0.00 0.25 0.00 0.00 55.06 54.31 2pq8 s HIS 183 Cb -0.09 -1.92 0.05 0.00 -1.18 0.00 0.00 32.58 29.44 2pq8 s HIS 183 CO 0.09 -0.55 0.17 -1.50 -0.65 0.00 0.00 174.74 172.30 2pq8 s ILE 184 N 0.99 -0.19 0.00 0.89 2.07 0.03 -0.72 121.20 124.28 2pq8 s ILE 184 Ca -0.02 0.28 0.00 0.00 -1.41 0.00 0.00 60.65 59.50 2pq8 s ILE 184 Cb -0.15 -0.29 0.00 0.00 0.13 0.00 0.00 42.46 42.15 2pq8 s ILE 184 CO -0.03 0.12 0.00 0.61 -1.91 0.00 0.00 174.94 173.73 2pq8 n GLY 185 N 4.89 2.97 1.24 1.50 0.00 -1.26 -1.56 105.19 112.98 2pq8 n GLY 185 Ca -0.13 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.67 2pq8 n GLY 185 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2pq8 n ASN 186 N 3.93 3.62 -4.37 1.61 5.03 -1.26 -4.94 115.26 118.87 2pq8 n ASN 186 Ca 0.00 -2.40 -0.30 0.00 0.87 0.00 0.00 54.58 52.76 2pq8 n ASN 186 Cb 0.00 -0.52 -0.14 0.00 -1.02 0.00 0.00 39.78 38.10 2pq8 n ASN 186 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2pq8 s TYR 187 N -1.87 2.35 -0.05 3.10 2.02 -0.60 -5.12 117.35 117.19 2pq8 s TYR 187 Ca 0.35 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.71 2pq8 s TYR 187 Cb 0.24 -1.36 -0.02 0.00 -0.40 0.00 0.00 41.96 40.41 2pq8 s TYR 187 CO 0.15 0.20 -0.17 -1.21 -1.57 0.00 0.00 175.55 172.95 2pq8 s GLU 188 N -1.49 2.45 -0.02 -0.62 2.02 -1.26 -0.79 118.70 118.99 2pq8 s GLU 188 Ca 0.13 -0.75 0.00 0.00 0.02 0.00 0.00 54.97 54.37 2pq8 s GLU 188 Cb -0.10 -2.31 0.02 0.00 0.10 0.00 0.00 34.13 31.84 2pq8 s GLU 188 CO 0.04 0.59 -0.00 0.42 0.02 0.00 0.00 175.26 176.32 2pq8 s ILE 189 N -0.66 0.17 0.35 -1.63 1.01 -0.35 -4.99 121.20 115.10 2pq8 s ILE 189 Ca 0.10 0.06 -0.25 0.00 0.00 0.00 0.00 60.65 60.56 2pq8 s ILE 189 Cb -0.11 -0.25 -0.10 0.00 0.01 0.00 0.00 42.46 42.02 2pq8 s ILE 189 CO 0.00 0.13 0.96 -1.81 0.00 0.00 0.00 174.94 174.23 2pq8 s ASP 190 N 0.85 7.20 0.55 3.58 1.01 -1.26 -1.36 116.67 127.24 2pq8 s ASP 190 Ca -0.08 1.86 -0.18 0.00 0.71 0.00 0.00 52.55 54.85 2pq8 s ASP 190 Cb -0.12 -2.58 -0.06 0.00 1.01 0.00 0.00 42.92 41.18 2pq8 s ASP 190 CO -0.02 -0.17 1.07 0.00 0.21 0.00 0.00 175.17 176.27 2pq8 s ALA 191 N -1.68 2.76 -0.05 5.23 0.00 -0.07 -4.94 121.76 123.00 2pq8 s ALA 191 Ca 0.53 0.59 0.15 0.00 0.00 0.00 0.00 51.96 53.22 2pq8 s ALA 191 Cb -0.18 -3.28 -0.23 0.00 0.00 0.00 0.00 23.12 19.44 2pq8 s ALA 191 CO 0.23 -0.64 0.26 0.91 0.00 0.00 0.00 175.76 176.53 2pq8 n TRP 192 N -1.48 0.00 -3.83 0.00 7.02 0.07 -5.01 117.44 114.21 2pq8 n TRP 192 Ca 0.10 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.49 2pq8 n TRP 192 Cb 0.52 -0.45 -0.07 0.00 -2.42 0.00 0.00 31.31 28.89 2pq8 n TRP 192 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 2pq8 s TYR 193 N -2.89 0.11 0.27 -5.99 2.02 -0.49 -4.97 117.35 105.41 2pq8 s TYR 193 Ca -0.06 -0.52 -0.31 0.00 -0.37 0.00 0.00 57.07 55.82 2pq8 s TYR 193 Cb 0.08 -0.01 -0.12 0.00 -0.40 0.00 0.00 41.96 41.52 2pq8 s TYR 193 CO 0.63 -0.58 1.51 0.34 -1.57 0.00 0.00 175.55 175.88 2pq8 n PHE 194 N -0.10 2.54 -4.59 2.71 7.35 -1.26 -4.48 117.46 119.63 2pq8 n PHE 194 Ca -0.15 0.33 -0.22 0.00 -0.76 0.00 0.00 57.45 56.65 2pq8 n PHE 194 Cb 0.63 -2.54 -0.15 0.00 0.35 0.00 0.00 39.48 37.77 2pq8 n PHE 194 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2pq8 s SER 195 N 0.41 1.58 -0.00 -2.13 0.15 -1.26 -4.62 113.70 107.83 2pq8 s SER 195 Ca 0.66 -0.25 -0.05 0.00 0.70 0.00 0.00 55.95 57.01 2pq8 s SER 195 Cb -0.57 -0.33 -0.21 0.00 -1.71 0.00 0.00 66.02 63.21 2pq8 s SER 195 CO 0.49 0.13 2.94 -0.81 1.20 0.00 0.00 173.24 177.19 2pq8 n PRO 196 N 3.04 1.56 -1.87 5.44 -0.04 -1.26 -4.79 135.00 137.07 2pq8 n PRO 196 Ca -0.16 -0.78 -0.38 0.00 -0.04 0.00 0.00 63.50 62.13 2pq8 n PRO 196 Cb 0.54 -1.89 0.03 0.00 -0.04 0.00 0.00 33.50 32.14 2pq8 n PRO 196 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2pq8 s PHE 197 N 1.44 2.40 0.45 0.54 0.08 -1.26 -4.94 117.98 116.69 2pq8 s PHE 197 Ca 0.52 1.40 -0.22 0.00 0.12 0.00 0.00 56.93 58.76 2pq8 s PHE 197 Cb 0.25 -3.72 -0.11 0.00 -0.57 0.00 0.00 43.02 38.87 2pq8 s PHE 197 CO -0.00 -2.63 0.71 -2.30 -0.10 0.00 0.00 175.22 170.89 2pq8 n PRO 198 N -0.91 0.81 -0.22 0.24 -0.02 -1.26 -4.80 135.00 128.83 2pq8 n PRO 198 Ca 0.10 0.30 0.06 0.00 -2.02 0.00 0.00 63.50 61.94 2pq8 n PRO 198 Cb 0.46 -1.73 0.33 0.00 -0.02 0.00 0.00 33.50 32.53 2pq8 n PRO 198 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2pq8 h GLU 199 N 0.92 0.79 0.00 -0.52 9.09 -1.96 -0.43 114.58 122.47 2pq8 h GLU 199 Ca -0.43 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 58.93 2pq8 h GLU 199 Cb 1.38 -0.18 -0.00 0.00 -1.65 0.00 0.00 28.75 28.30 2pq8 h GLU 199 CO 0.52 0.52 -0.04 0.22 0.05 0.00 0.00 179.01 180.29 2pq8 h ASP 200 N 0.82 0.00 0.25 3.06 3.58 -1.95 -1.69 116.42 120.48 2pq8 h ASP 200 Ca 0.34 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.64 2pq8 h ASP 200 Cb 0.29 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 2pq8 h ASP 200 CO -0.12 0.04 -0.60 1.88 -2.88 0.00 0.00 179.24 177.56 2pq8 h TYR 201 N 0.00 0.45 0.00 0.28 0.05 -1.40 -3.09 116.97 113.26 2pq8 h TYR 201 Ca -0.00 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.57 2pq8 h TYR 201 Cb 0.40 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 2pq8 h TYR 201 CO 0.00 0.86 -0.17 0.78 -1.05 0.00 0.00 178.16 178.57 2pq8 h GLY 202 N 1.32 0.00 1.96 3.88 0.00 -1.33 -3.26 103.07 105.64 2pq8 h GLY 202 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 2pq8 h GLY 202 CO 0.10 0.00 -0.28 0.07 0.00 0.00 0.00 176.54 176.42 2pq8 h LYS 203 N 0.00 0.04 -7.19 4.80 5.09 -1.44 -3.39 116.57 114.48 2pq8 h LYS 203 Ca -0.00 -0.01 -0.50 0.00 0.09 0.00 0.00 60.65 60.22 2pq8 h LYS 203 Cb 0.63 -0.00 0.05 0.00 0.10 0.00 0.00 32.23 33.00 2pq8 h LYS 203 CO 0.02 0.33 0.29 -0.65 -2.09 0.00 0.00 179.45 177.35 2pq8 s GLN 204 N -4.40 3.58 0.29 0.07 1.11 -1.23 -4.96 119.66 114.11 2pq8 s GLN 204 Ca -0.04 0.53 0.00 0.00 0.01 0.00 0.00 55.36 55.86 2pq8 s GLN 204 Cb 0.15 -2.20 0.50 0.00 -1.01 0.00 0.00 33.01 30.45 2pq8 s GLN 204 CO 0.72 -0.42 1.88 -1.35 0.01 0.00 0.00 175.29 176.13 2pq8 h PRO 205 N -0.10 1.04 -4.73 2.91 0.11 -1.91 -3.44 132.00 125.88 2pq8 h PRO 205 Ca -0.45 -0.06 -0.31 0.00 0.11 0.00 0.00 66.00 65.29 2pq8 h PRO 205 Cb 1.20 -0.23 -0.21 0.00 0.11 0.00 0.00 31.00 31.86 2pq8 h PRO 205 CO 0.62 0.69 -0.74 0.15 -0.21 0.00 0.00 178.00 178.50 2pq8 s LYS 206 N -5.96 0.59 -0.13 1.05 1.02 -1.26 -4.42 119.74 110.64 2pq8 s LYS 206 Ca -0.12 -0.78 -0.05 0.00 0.02 0.00 0.00 55.97 55.04 2pq8 s LYS 206 Cb 0.21 -0.41 -0.04 0.00 -0.52 0.00 0.00 37.83 37.07 2pq8 s LYS 206 CO 0.81 0.08 0.05 -1.17 -0.92 0.00 0.00 175.35 174.20 2pq8 s LEU 207 N -1.57 3.82 -0.19 3.17 2.96 -0.48 -4.75 118.68 121.63 2pq8 s LEU 207 Ca -0.08 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.99 2pq8 s LEU 207 Cb -0.10 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 2pq8 s LEU 207 CO 0.01 0.31 -0.10 0.26 -1.32 0.00 0.00 176.35 175.52 2pq8 s TRP 208 N -0.47 2.89 -0.11 5.38 0.52 -0.31 -0.97 118.94 125.87 2pq8 s TRP 208 Ca 0.10 -1.03 0.01 0.00 0.02 0.00 0.00 56.10 55.19 2pq8 s TRP 208 Cb -0.12 -2.01 -0.02 0.00 -1.15 0.00 0.00 33.47 30.17 2pq8 s TRP 208 CO 0.02 -0.54 -0.13 -0.51 0.02 0.00 0.00 176.95 175.81 2pq8 s LEU 209 N 1.21 2.73 0.10 2.99 1.02 0.10 0.22 118.68 127.06 2pq8 s LEU 209 Ca 0.02 -0.28 -0.31 0.00 0.02 0.00 0.00 54.13 53.58 2pq8 s LEU 209 Cb -0.14 -1.60 -0.08 0.00 0.02 0.00 0.00 46.19 44.39 2pq8 s LEU 209 CO -0.04 0.22 1.57 0.00 0.02 0.00 0.00 176.35 178.13 2pq8 n GLU 211 N 4.90 0.14 -0.10 0.00 0.28 -1.26 -1.05 120.64 123.55 2pq8 n GLU 211 Ca 0.14 0.35 -0.20 0.00 -0.16 0.00 0.00 57.16 57.29 2pq8 n GLU 211 Cb 0.40 -1.75 -0.08 0.00 1.43 0.00 0.00 31.44 31.44 2pq8 n GLU 211 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2pq8 n TYR 212 N -2.02 0.00 0.96 -1.84 4.01 -1.26 -4.43 117.16 112.59 2pq8 n TYR 212 Ca 0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.87 2pq8 n TYR 212 Cb 0.23 -0.73 -0.08 0.00 -0.31 0.00 0.00 39.34 38.45 2pq8 n TYR 212 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2pq8 n LEU 214 N -1.01 -0.30 -4.68 0.00 4.77 -0.21 -4.76 117.00 110.80 2pq8 n LEU 214 Ca 0.05 0.20 -0.44 0.00 -0.03 0.00 0.00 56.01 55.80 2pq8 n LEU 214 Cb 0.36 -1.98 -0.02 0.00 -2.33 0.00 0.00 43.42 39.46 2pq8 n LEU 214 CO 0.37 -0.70 0.94 1.17 -1.33 0.00 0.00 177.39 177.83 2pq8 n LYS 215 N -1.63 2.06 -4.41 3.23 4.81 -1.26 -4.66 118.16 116.29 2pq8 n LYS 215 Ca -0.08 0.73 -0.34 0.00 -0.87 0.00 0.00 58.31 57.74 2pq8 n LYS 215 Cb 0.41 -2.33 -0.11 0.00 0.02 0.00 0.00 35.03 33.02 2pq8 n LYS 215 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2pq8 s TYR 216 N -0.63 3.08 0.11 5.64 -0.85 -1.26 -1.10 117.35 122.34 2pq8 s TYR 216 Ca 0.61 0.01 0.04 0.00 -0.52 0.00 0.00 57.07 57.21 2pq8 s TYR 216 Cb -0.61 -1.84 -0.04 0.00 0.38 0.00 0.00 41.96 39.85 2pq8 s TYR 216 CO 0.56 0.28 -0.10 -1.64 -1.52 0.00 0.00 175.55 173.13 2pq8 s MET 217 N -0.43 0.92 0.04 -3.49 -1.94 0.13 -4.97 119.30 109.57 2pq8 s MET 217 Ca 0.07 -1.28 0.22 0.00 -1.71 0.00 0.00 55.69 53.00 2pq8 s MET 217 Cb -0.12 -0.54 -0.18 0.00 2.01 0.00 0.00 34.83 36.00 2pq8 s MET 217 CO 0.02 0.07 0.75 1.63 -0.01 0.00 0.00 175.02 177.48 2pq8 n LYS 218 N 0.25 0.51 -4.02 2.03 5.02 -1.26 -1.16 118.16 119.53 2pq8 n LYS 218 Ca -0.14 -0.07 -0.12 0.00 -2.02 0.00 0.00 58.31 55.96 2pq8 n LYS 218 Cb 0.59 -1.60 -0.12 0.00 -0.02 0.00 0.00 35.03 33.88 2pq8 n LYS 218 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2pq8 s TYR 219 N -3.37 0.39 0.36 2.13 2.02 -1.26 -4.86 117.35 112.75 2pq8 s TYR 219 Ca -0.03 -0.38 0.06 0.00 -0.37 0.00 0.00 57.07 56.36 2pq8 s TYR 219 Cb 0.13 -0.25 0.75 0.00 -0.40 0.00 0.00 41.96 42.19 2pq8 s TYR 219 CO 0.86 -0.10 1.95 1.49 -1.57 0.00 0.00 175.55 178.18 2pq8 h GLU 220 N 5.01 0.73 -0.47 -0.62 4.81 -1.94 -0.98 114.58 121.11 2pq8 h GLU 220 Ca -0.31 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 58.79 2pq8 h GLU 220 Cb 1.20 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 2pq8 h GLU 220 CO 0.44 0.48 -0.01 0.87 -0.73 0.00 0.00 179.01 180.06 2pq8 h LYS 221 N 0.75 0.84 -0.28 1.92 1.79 -1.99 0.94 116.57 120.54 2pq8 h LYS 221 Ca 0.33 -0.27 -0.13 0.00 -2.18 0.00 0.00 60.65 58.39 2pq8 h LYS 221 Cb 0.30 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 2pq8 h LYS 221 CO -0.11 0.90 -0.36 0.66 -1.08 0.00 0.00 179.45 179.45 2pq8 h SER 222 N 0.70 0.68 -0.13 0.86 4.64 -1.90 -2.28 113.55 116.11 2pq8 h SER 222 Ca 0.13 -0.29 0.01 0.00 -0.47 0.00 0.00 61.79 61.18 2pq8 h SER 222 Cb 0.52 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 2pq8 h SER 222 CO 0.03 0.98 0.04 0.22 -0.87 0.00 0.00 176.83 177.22 2pq8 h TYR 223 N 0.54 0.06 -0.78 4.77 3.20 -0.88 -1.13 116.97 122.75 2pq8 h TYR 223 Ca 0.05 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2pq8 h TYR 223 Cb 0.87 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.10 2pq8 h TYR 223 CO 0.04 0.03 0.38 0.00 -1.64 0.00 0.00 178.16 176.97 2pq8 h ARG 224 N 0.09 1.12 -0.20 1.82 2.47 -0.75 -0.71 114.38 118.22 2pq8 h ARG 224 Ca 0.06 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.62 2pq8 h ARG 224 Cb 0.04 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 2pq8 h ARG 224 CO -0.06 0.86 0.12 0.35 0.56 0.00 0.00 179.97 181.80 2pq8 h PHE 225 N 1.09 0.24 -0.56 3.04 3.57 -1.29 -2.52 116.94 120.51 2pq8 h PHE 225 Ca 0.27 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.83 2pq8 h PHE 225 Cb 0.11 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 2pq8 h PHE 225 CO 0.01 0.15 0.28 1.25 -2.23 0.00 0.00 178.31 177.76 2pq8 h HIS 226 N 0.26 0.50 -0.60 0.41 2.76 -0.75 -2.52 115.15 115.21 2pq8 h HIS 226 Ca 0.07 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.28 2pq8 h HIS 226 Cb -0.02 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 28.76 2pq8 h HIS 226 CO -0.07 0.23 0.40 -0.07 -1.30 0.00 0.00 177.93 177.11 2pq8 h LEU 227 N 0.52 0.66 -0.93 0.26 3.38 -0.88 0.38 115.31 118.71 2pq8 h LEU 227 Ca 0.25 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2pq8 h LEU 227 Cb 0.19 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2pq8 h LEU 227 CO -0.19 0.47 -0.10 1.23 0.09 0.00 0.00 178.44 179.95 2pq8 h GLY 228 N 0.78 0.00 0.00 0.83 0.00 -1.03 -3.34 103.07 100.31 2pq8 h GLY 228 Ca 0.22 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.31 2pq8 h GLY 228 CO -0.05 0.00 -1.93 -1.06 0.00 0.00 0.00 176.54 173.49 2pq8 n GLN 229 N -3.19 1.66 -2.10 4.80 1.13 -0.42 -5.00 117.38 114.26 2pq8 n GLN 229 Ca 0.01 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.66 2pq8 n GLN 229 Cb 0.42 -1.35 -0.03 0.00 0.11 0.00 0.00 30.24 29.40 2pq8 n GLN 229 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2pq8 n GLN 231 N 3.13 0.25 -2.47 0.00 1.13 -1.26 -4.92 117.38 113.24 2pq8 n GLN 231 Ca 0.09 -0.18 -0.41 0.00 -1.94 0.00 0.00 57.00 54.56 2pq8 n GLN 231 Cb 0.41 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.23 2pq8 n GLN 231 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2pq8 s TRP 232 N -2.87 3.55 -0.04 1.08 0.52 -1.26 -4.92 118.94 114.99 2pq8 s TRP 232 Ca 0.13 1.57 0.06 0.00 0.02 0.00 0.00 56.10 57.88 2pq8 s TRP 232 Cb 0.17 -3.32 0.10 0.00 -1.15 0.00 0.00 33.47 29.28 2pq8 s TRP 232 CO 0.71 -0.75 0.97 0.54 0.02 0.00 0.00 176.95 178.45 2pq8 n ARG 233 N 2.22 0.88 -3.72 4.98 5.12 -1.26 -4.81 116.66 120.06 2pq8 n ARG 233 Ca 0.02 -1.54 -0.04 0.00 -1.93 0.00 0.00 57.85 54.37 2pq8 n ARG 233 Cb 0.46 -0.92 -0.01 0.00 -1.16 0.00 0.00 32.46 30.83 2pq8 n ARG 233 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2pq8 s GLN 234 N -1.13 1.15 0.91 5.56 -2.07 -1.26 -0.61 119.66 122.20 2pq8 s GLN 234 Ca 0.11 -0.61 -0.11 0.00 -1.82 0.00 0.00 55.36 52.93 2pq8 s GLN 234 Cb 0.10 0.41 0.14 0.00 -1.09 0.00 0.00 33.01 32.56 2pq8 s GLN 234 CO 0.01 -0.52 1.12 -2.14 -1.32 0.00 0.00 175.29 172.43 2pq8 s PRO 235 N -3.27 1.12 0.00 9.60 0.02 -1.26 -4.80 135.00 136.41 2pq8 s PRO 235 Ca 0.11 1.32 0.00 0.00 0.02 0.00 0.00 61.00 62.45 2pq8 s PRO 235 Cb -0.01 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.75 2pq8 s PRO 235 CO 0.01 -2.49 0.00 -0.35 -0.33 0.00 0.00 177.00 173.84 2pq8 n PRO 236 N -4.11 -0.22 0.00 5.54 -0.04 -1.26 -4.94 135.00 129.97 2pq8 n PRO 236 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2pq8 n PRO 236 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 2pq8 n PRO 236 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2pq8 n GLY 237 N 4.05 -0.98 3.52 0.55 0.00 -1.26 -4.70 105.19 106.36 2pq8 n GLY 237 Ca 0.00 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.47 2pq8 n GLY 237 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pq8 s LYS 238 N 0.00 3.75 -0.23 1.61 2.47 -0.58 -4.90 119.74 121.88 2pq8 s LYS 238 Ca 0.00 -0.46 -0.29 0.00 -1.56 0.00 0.00 55.97 53.66 2pq8 s LYS 238 Cb 0.00 -3.13 -0.01 0.00 -1.46 0.00 0.00 37.83 33.23 2pq8 s LYS 238 CO 0.00 0.11 1.27 -2.00 0.16 0.00 0.00 175.35 174.89 2pq8 s GLU 239 N 0.76 4.10 0.00 4.03 2.12 -1.26 -0.63 118.70 127.82 2pq8 s GLU 239 Ca 0.01 1.47 0.03 0.00 0.36 0.00 0.00 54.97 56.84 2pq8 s GLU 239 Cb -0.14 -3.81 0.02 0.00 0.26 0.00 0.00 34.13 30.46 2pq8 s GLU 239 CO 0.02 -0.88 0.52 0.44 -0.54 0.00 0.00 175.26 174.82 2pq8 n ILE 240 N 5.73 0.00 -3.65 -3.70 -5.35 -0.16 -4.94 119.36 107.28 2pq8 n ILE 240 Ca 0.14 -0.49 -0.12 0.00 -0.27 0.00 0.00 62.75 62.01 2pq8 n ILE 240 Cb 0.46 1.05 -0.08 0.00 -1.74 0.00 0.00 39.64 39.33 2pq8 n ILE 240 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2pq8 s TYR 241 N -0.41 -0.79 -0.13 4.28 5.04 -1.20 -0.17 117.35 123.97 2pq8 s TYR 241 Ca 0.03 1.79 -0.05 0.00 -2.44 0.00 0.00 57.07 56.40 2pq8 s TYR 241 Cb 0.02 0.34 0.06 0.00 0.35 0.00 0.00 41.96 42.74 2pq8 s TYR 241 CO 0.05 -0.39 0.28 0.50 -1.34 0.00 0.00 175.55 174.65 2pq8 s ARG 242 N 0.74 0.19 -0.09 4.97 6.06 -1.12 -1.64 118.95 128.06 2pq8 s ARG 242 Ca -0.03 0.74 -0.04 0.00 -2.50 0.00 0.00 55.73 53.90 2pq8 s ARG 242 Cb -0.05 -0.01 0.04 0.00 0.06 0.00 0.00 34.95 34.99 2pq8 s ARG 242 CO -0.05 -0.25 0.20 0.21 -2.50 0.00 0.00 175.30 172.90 2pq8 s LYS 243 N 2.17 0.15 4.67 5.12 2.20 -0.43 -4.83 119.74 128.79 2pq8 s LYS 243 Ca -0.02 0.45 0.00 0.00 -0.36 0.00 0.00 55.97 56.05 2pq8 s LYS 243 Cb -0.12 -0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.05 2pq8 s LYS 243 CO -0.09 -0.17 0.00 0.45 -0.36 0.00 0.00 175.35 175.18 2pq8 n SER 244 N 4.24 0.00 -1.74 1.43 2.88 -1.26 -1.54 113.62 117.63 2pq8 n SER 244 Ca -0.26 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.36 2pq8 n SER 244 Cb 0.52 0.00 0.38 0.00 -0.75 0.00 0.00 64.21 64.37 2pq8 n SER 244 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2pq8 n ASN 245 N 4.57 5.34 -4.32 -3.46 6.94 -1.26 -4.93 115.26 118.14 2pq8 n ASN 245 Ca 0.00 -2.79 -0.28 0.00 -0.02 0.00 0.00 54.58 51.49 2pq8 n ASN 245 Cb 0.00 -0.64 -0.14 0.00 -2.36 0.00 0.00 39.78 36.64 2pq8 n ASN 245 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 2pq8 s ILE 246 N -2.49 1.96 0.04 1.53 -4.36 -0.59 -0.32 121.20 116.98 2pq8 s ILE 246 Ca 0.53 -1.42 0.01 0.00 -0.26 0.00 0.00 60.65 59.51 2pq8 s ILE 246 Cb 0.39 -1.71 -0.03 0.00 1.25 0.00 0.00 42.46 42.36 2pq8 s ILE 246 CO 0.18 0.21 -0.05 -0.55 0.24 0.00 0.00 174.94 174.97 2pq8 s SER 247 N -1.46 0.59 -0.07 4.36 0.15 -0.56 -1.32 113.70 115.40 2pq8 s SER 247 Ca 0.10 -0.67 0.04 0.00 0.70 0.00 0.00 55.95 56.11 2pq8 s SER 247 Cb -0.10 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2pq8 s SER 247 CO 0.03 -0.35 -0.18 -0.69 1.20 0.00 0.00 173.24 173.25 2pq8 s VAL 248 N -2.18 1.54 -0.09 4.45 1.01 -0.65 -1.26 120.40 123.22 2pq8 s VAL 248 Ca -0.06 -0.74 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 2pq8 s VAL 248 Cb -0.05 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2pq8 s VAL 248 CO -0.03 0.44 -0.07 -1.00 0.00 0.00 0.00 175.10 174.45 2pq8 s HIS 249 N 0.34 2.95 -0.26 5.22 3.76 -0.38 -0.99 115.29 125.93 2pq8 s HIS 249 Ca -0.12 -0.08 -0.13 0.00 -0.15 0.00 0.00 55.06 54.57 2pq8 s HIS 249 Cb -0.15 -1.77 -0.04 0.00 1.11 0.00 0.00 32.58 31.73 2pq8 s HIS 249 CO 0.05 0.22 0.29 -2.00 -0.85 0.00 0.00 174.74 172.45 2pq8 s GLU 250 N -0.50 4.01 -0.25 1.40 2.12 0.20 -0.77 118.70 124.92 2pq8 s GLU 250 Ca 0.07 -0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.31 2pq8 s GLU 250 Cb -0.12 -3.63 0.06 0.00 0.26 0.00 0.00 34.13 30.70 2pq8 s GLU 250 CO 0.02 -0.19 -0.04 0.08 -0.54 0.00 0.00 175.26 174.60 2pq8 s VAL 251 N 1.79 1.54 -0.09 3.70 1.01 0.11 -1.52 120.40 126.94 2pq8 s VAL 251 Ca 0.12 -1.30 -0.30 0.00 0.00 0.00 0.00 61.98 60.50 2pq8 s VAL 251 Cb -0.16 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2pq8 s VAL 251 CO 0.10 -0.17 1.01 -0.62 0.00 0.00 0.00 175.10 175.42 2pq8 s ASP 252 N 1.37 7.26 0.52 3.32 -1.08 -1.26 -0.38 116.67 126.42 2pq8 s ASP 252 Ca -0.04 1.56 0.25 0.00 -0.52 0.00 0.00 52.55 53.80 2pq8 s ASP 252 Cb -0.19 -2.56 1.38 0.00 -1.46 0.00 0.00 42.92 40.09 2pq8 s ASP 252 CO -0.07 -0.43 1.97 1.23 0.52 0.00 0.00 175.17 178.39 2pq8 h GLY 253 N 7.86 0.08 1.77 2.66 0.00 -1.34 -0.76 103.07 113.34 2pq8 h GLY 253 Ca -0.32 -0.02 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 2pq8 h GLY 253 CO 0.84 0.01 -0.45 1.70 0.00 0.00 0.00 176.54 178.64 2pq8 h LYS 254 N 0.05 0.25 0.00 4.80 3.64 -1.78 -3.10 116.57 120.43 2pq8 h LYS 254 Ca 0.30 -0.13 -0.20 0.00 -1.27 0.00 0.00 60.65 59.35 2pq8 h LYS 254 Cb 1.13 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.92 2pq8 h LYS 254 CO -0.02 0.66 -1.48 -0.25 -2.27 0.00 0.00 179.45 176.09 2pq8 n ASP 255 N -3.99 0.88 -3.11 4.20 8.00 -0.38 -4.49 116.55 117.66 2pq8 n ASP 255 Ca -0.02 0.40 -0.20 0.00 0.71 0.00 0.00 54.79 55.68 2pq8 n ASP 255 Cb 0.51 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 2pq8 n ASP 255 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2pq8 n HIS 256 N -2.93 1.25 -0.02 1.24 8.25 -0.68 -4.98 115.22 117.34 2pq8 n HIS 256 Ca -0.11 -3.84 -0.09 0.00 -0.26 0.00 0.00 57.72 53.42 2pq8 n HIS 256 Cb 0.89 -0.44 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 2pq8 n HIS 256 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2pq8 h LYS 257 N 2.99 -0.03 -0.35 -0.41 3.64 -1.76 -2.03 116.57 118.62 2pq8 h LYS 257 Ca 0.11 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2pq8 h LYS 257 Cb 0.85 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 2pq8 h LYS 257 CO 0.59 -0.02 0.14 0.82 -2.27 0.00 0.00 179.45 178.70 2pq8 h ILE 258 N -0.04 1.19 -0.47 2.00 1.08 -1.94 -0.19 117.51 119.14 2pq8 h ILE 258 Ca 0.09 -0.58 0.05 0.00 -0.39 0.00 0.00 64.86 64.03 2pq8 h ILE 258 Cb 0.17 0.92 -0.05 0.00 -3.07 0.00 0.00 36.82 34.79 2pq8 h ILE 258 CO -0.19 0.20 0.21 0.22 -0.69 0.00 0.00 178.15 177.90 2pq8 h TYR 259 N 0.42 0.37 -0.13 1.37 3.20 -1.81 -0.20 116.97 120.19 2pq8 h TYR 259 Ca 0.12 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 2pq8 h TYR 259 Cb 0.19 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 2pq8 h TYR 259 CO -0.00 0.16 -0.51 0.00 -1.64 0.00 0.00 178.16 176.17 2pq8 h GLN 261 N 0.28 0.67 -0.78 0.00 4.20 -0.77 -0.96 115.11 117.75 2pq8 h GLN 261 Ca 0.01 -0.18 0.04 0.00 0.06 0.00 0.00 58.65 58.58 2pq8 h GLN 261 Cb 1.00 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.65 2pq8 h GLN 261 CO 0.09 0.72 0.49 -0.91 -0.67 0.00 0.00 178.83 178.55 2pq8 h ASN 262 N 0.53 0.81 -0.48 1.46 2.35 -0.64 -1.95 115.58 117.65 2pq8 h ASN 262 Ca 0.12 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 2pq8 h ASN 262 Cb 0.37 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 2pq8 h ASN 262 CO 0.01 0.55 0.27 0.25 -1.65 0.00 0.00 177.43 176.85 2pq8 h LEU 263 N 0.95 0.60 -0.89 1.61 5.85 -0.76 -1.62 115.31 121.05 2pq8 h LEU 263 Ca 0.32 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2pq8 h LEU 263 Cb 0.04 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2pq8 h LEU 263 CO -0.12 0.51 0.03 0.00 -0.34 0.00 0.00 178.44 178.52 2pq8 h LEU 265 N 0.80 0.71 -0.20 0.00 3.38 -1.15 -0.64 115.31 118.23 2pq8 h LEU 265 Ca 0.16 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2pq8 h LEU 265 Cb 0.43 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2pq8 h LEU 265 CO 0.02 0.76 0.05 0.25 0.09 0.00 0.00 178.44 179.60 2pq8 h LEU 266 N 0.63 0.03 -1.13 1.67 5.85 -1.02 -3.11 115.31 118.24 2pq8 h LEU 266 Ca 0.15 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 2pq8 h LEU 266 Cb 0.33 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2pq8 h LEU 266 CO 0.00 0.05 -0.21 0.00 -0.34 0.00 0.00 178.44 177.94 2pq8 h ALA 267 N 1.13 1.27 0.00 1.25 0.00 -0.59 -2.40 119.26 119.93 2pq8 h ALA 267 Ca 0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2pq8 h ALA 267 Cb 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2pq8 h ALA 267 CO -0.11 0.48 -0.02 -0.22 0.00 0.00 0.00 179.25 179.39 2pq8 h LYS 268 N 0.32 0.00 0.00 0.00 1.63 -1.04 -0.03 116.57 117.45 2pq8 h LYS 268 Ca 0.05 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.85 2pq8 h LYS 268 Cb 0.56 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.19 2pq8 h LYS 268 CO 0.04 0.02 -0.04 -0.07 -3.45 0.00 0.00 179.45 175.94 2pq8 h LEU 269 N 0.00 0.00 -1.01 5.20 3.38 -1.47 -3.25 115.31 118.17 2pq8 h LEU 269 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pq8 h LEU 269 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2pq8 h LEU 269 CO 0.00 0.04 0.00 0.49 0.09 0.00 0.00 178.44 179.06 2pq8 n PHE 270 N -3.35 0.00 -3.87 1.13 3.72 -0.10 -0.75 117.46 114.24 2pq8 n PHE 270 Ca -0.02 -0.03 -0.12 0.00 -0.05 0.00 0.00 57.45 57.24 2pq8 n PHE 270 Cb 0.18 -0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.58 2pq8 n PHE 270 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2pq8 s LEU 271 N -0.06 1.83 -0.45 4.37 2.96 -0.75 -4.97 118.68 121.62 2pq8 s LEU 271 Ca 0.00 0.02 -0.06 0.00 -0.22 0.00 0.00 54.13 53.87 2pq8 s LEU 271 Cb 0.00 0.21 0.12 0.00 0.50 0.00 0.00 46.19 47.02 2pq8 s LEU 271 CO 0.00 -0.07 0.29 -0.62 -1.32 0.00 0.00 176.35 174.63 2pq8 s ASP 272 N -0.23 5.51 -0.09 3.68 -1.08 -1.26 -4.52 116.67 118.68 2pq8 s ASP 272 Ca -0.03 -1.99 -0.06 0.00 -0.52 0.00 0.00 52.55 49.96 2pq8 s ASP 272 Cb -0.02 -1.93 0.04 0.00 -1.46 0.00 0.00 42.92 39.54 2pq8 s ASP 272 CO 0.00 -0.62 0.22 -2.28 0.52 0.00 0.00 175.17 173.01 2pq8 s HIS 273 N 1.23 -0.28 0.40 -5.34 2.46 -1.26 -5.06 115.29 107.44 2pq8 s HIS 273 Ca 0.07 0.67 0.19 0.00 0.47 0.00 0.00 55.06 56.47 2pq8 s HIS 273 Cb -0.25 0.05 1.08 0.00 -0.13 0.00 0.00 32.58 33.33 2pq8 s HIS 273 CO -0.02 -0.18 1.96 0.07 -2.47 0.00 0.00 174.74 174.10 2pq8 h ARG 274 N 6.64 0.00 0.00 2.88 0.11 -1.99 -2.59 114.38 119.42 2pq8 h ARG 274 Ca -0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.73 2pq8 h ARG 274 Cb 1.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 2pq8 h ARG 274 CO 0.38 0.22 0.00 1.79 0.10 0.00 0.00 179.97 182.46 2pq8 h THR 275 N 0.00 0.00 0.00 0.08 1.35 -1.97 -1.64 112.91 110.74 2pq8 h THR 275 Ca -0.00 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 2pq8 h THR 275 Cb 0.45 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2pq8 h THR 275 CO 0.03 0.00 0.00 -0.07 -0.25 0.00 0.00 175.52 175.23 2pq8 h LEU 276 N 0.00 0.00 -1.53 3.87 3.38 -1.83 -1.75 115.31 117.45 2pq8 h LEU 276 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pq8 h LEU 276 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2pq8 h LEU 276 CO 0.00 0.00 -0.19 -1.22 0.09 0.00 0.00 178.44 177.12 2pq8 n TYR 277 N -2.42 0.00 -3.27 1.13 4.01 -0.61 -4.76 117.16 111.24 2pq8 n TYR 277 Ca 0.02 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.56 2pq8 n TYR 277 Cb 0.23 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 2pq8 n TYR 277 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2pq8 s PHE 278 N -2.19 2.44 0.25 -0.72 0.08 -0.66 -5.06 117.98 112.12 2pq8 s PHE 278 Ca 0.24 -0.52 -0.31 0.00 0.12 0.00 0.00 56.93 56.47 2pq8 s PHE 278 Cb 0.19 -2.25 -0.14 0.00 -0.57 0.00 0.00 43.02 40.26 2pq8 s PHE 278 CO 0.41 -0.45 1.27 -3.47 -0.10 0.00 0.00 175.22 172.88 2pq8 n ASP 279 N -1.81 2.21 0.13 1.36 2.03 -1.26 -4.90 116.55 114.31 2pq8 n ASP 279 Ca 0.07 1.16 0.12 0.00 0.52 0.00 0.00 54.79 56.66 2pq8 n ASP 279 Cb 0.61 -1.37 0.23 0.00 -0.72 0.00 0.00 41.12 39.87 2pq8 n ASP 279 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2pq8 h VAL 280 N 2.73 0.00 -0.91 5.18 -1.51 -1.91 -3.38 116.25 116.45 2pq8 h VAL 280 Ca -0.44 -0.72 -0.00 0.00 -1.23 0.00 0.00 66.70 64.31 2pq8 h VAL 280 Cb 1.30 1.57 -0.04 0.00 -2.13 0.00 0.00 31.29 31.99 2pq8 h VAL 280 CO 0.70 0.00 0.56 -0.33 -1.23 0.00 0.00 177.57 177.27 2pq8 h GLU 281 N 0.00 1.22 0.00 5.19 4.39 -1.91 -1.80 114.58 121.67 2pq8 h GLU 281 Ca 0.00 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2pq8 h GLU 281 Cb 0.86 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2pq8 h GLU 281 CO 0.00 0.84 0.00 -2.30 -1.16 0.00 0.00 179.01 176.39 2pq8 n PRO 282 N -4.37 0.65 -4.35 2.33 -0.02 -1.26 -3.87 135.00 124.11 2pq8 n PRO 282 Ca 0.10 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.37 2pq8 n PRO 282 Cb 0.05 -1.13 -0.11 0.00 -0.02 0.00 0.00 33.50 32.30 2pq8 n PRO 282 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2pq8 s PHE 283 N -2.00 1.85 0.02 6.00 0.08 -0.68 -1.21 117.98 122.04 2pq8 s PHE 283 Ca 0.08 -0.47 0.07 0.00 0.12 0.00 0.00 56.93 56.73 2pq8 s PHE 283 Cb 0.04 -0.90 -0.03 0.00 -0.57 0.00 0.00 43.02 41.56 2pq8 s PHE 283 CO 0.06 0.36 -0.21 0.08 -0.10 0.00 0.00 175.22 175.42 2pq8 s VAL 284 N -2.21 2.57 -0.10 -0.44 1.01 -0.00 -1.28 120.40 119.94 2pq8 s VAL 284 Ca 0.18 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2pq8 s VAL 284 Cb -0.05 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.31 2pq8 s VAL 284 CO 0.07 0.42 -0.23 -0.36 0.00 0.00 0.00 175.10 175.00 2pq8 s PHE 285 N -0.82 2.48 -0.36 5.22 0.08 0.48 -0.82 117.98 124.24 2pq8 s PHE 285 Ca 0.13 -1.06 -0.06 0.00 0.12 0.00 0.00 56.93 56.06 2pq8 s PHE 285 Cb -0.10 -1.67 0.06 0.00 -0.57 0.00 0.00 43.02 40.73 2pq8 s PHE 285 CO 0.03 -0.44 0.14 0.71 -0.10 0.00 0.00 175.22 175.56 2pq8 s TYR 286 N 0.46 3.32 -0.23 0.36 2.02 -0.07 0.08 117.35 123.30 2pq8 s TYR 286 Ca -0.16 -1.65 -0.13 0.00 -0.37 0.00 0.00 57.07 54.76 2pq8 s TYR 286 Cb -0.17 -2.55 -0.04 0.00 -0.40 0.00 0.00 41.96 38.79 2pq8 s TYR 286 CO 0.07 -0.80 0.28 0.42 -1.57 0.00 0.00 175.55 173.94 2pq8 s ILE 287 N 1.35 5.27 -0.20 2.71 -1.09 0.05 -1.61 121.20 127.68 2pq8 s ILE 287 Ca 0.00 0.43 -0.12 0.00 -2.23 0.00 0.00 60.65 58.73 2pq8 s ILE 287 Cb -0.21 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.01 2pq8 s ILE 287 CO 0.01 0.28 0.22 -0.22 -1.23 0.00 0.00 174.94 174.01 2pq8 s LEU 288 N 1.31 4.19 0.06 2.97 2.96 -0.19 -1.25 118.68 128.73 2pq8 s LEU 288 Ca 0.13 0.32 0.05 0.00 -0.22 0.00 0.00 54.13 54.41 2pq8 s LEU 288 Cb -0.14 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.28 2pq8 s LEU 288 CO 0.07 0.09 -0.13 0.42 -1.32 0.00 0.00 176.35 175.48 2pq8 s THR 289 N 0.69 1.05 -0.07 3.68 -4.23 -0.39 -0.98 115.64 115.39 2pq8 s THR 289 Ca 0.12 -1.16 -0.19 0.00 -1.18 0.00 0.00 61.69 59.27 2pq8 s THR 289 Cb -0.13 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.67 2pq8 s THR 289 CO 0.03 -0.15 0.54 -1.61 -0.54 0.00 0.00 174.62 172.88 2pq8 s GLU 290 N -1.49 4.32 -0.14 3.99 2.02 -0.47 -1.49 118.70 125.43 2pq8 s GLU 290 Ca -0.01 0.59 -0.05 0.00 0.02 0.00 0.00 54.97 55.52 2pq8 s GLU 290 Cb -0.09 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.70 2pq8 s GLU 290 CO 0.02 0.23 0.03 0.08 0.02 0.00 0.00 175.26 175.63 2pq8 s VAL 291 N 0.33 4.49 0.21 2.63 1.01 0.57 -0.55 120.40 129.09 2pq8 s VAL 291 Ca 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2pq8 s VAL 291 Cb -0.16 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.25 2pq8 s VAL 291 CO 0.13 0.52 0.27 -0.90 0.00 0.00 0.00 175.10 175.12 2pq8 n ASP 292 N 3.02 -0.73 0.33 3.32 5.68 -0.44 -4.85 116.55 122.88 2pq8 n ASP 292 Ca -0.18 -2.18 0.22 0.00 -0.50 0.00 0.00 54.79 52.16 2pq8 n ASP 292 Cb 0.53 1.41 1.17 0.00 -1.14 0.00 0.00 41.12 43.08 2pq8 n ASP 292 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2pq8 h ARG 293 N 0.00 0.00 0.00 0.11 9.65 -2.03 -2.23 114.38 119.88 2pq8 h ARG 293 Ca -0.16 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.50 2pq8 h ARG 293 Cb 0.72 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.26 2pq8 h ARG 293 CO 0.22 0.00 -1.30 1.96 2.80 0.00 0.00 179.97 183.65 2pq8 h GLN 294 N 0.00 0.00 0.00 0.20 7.50 -1.98 -3.50 115.11 117.33 2pq8 h GLN 294 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2pq8 h GLN 294 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.58 2pq8 h GLN 294 CO 0.00 0.63 0.00 0.41 -1.50 0.00 0.00 178.83 178.37 2pq8 n GLY 295 N 1.43 -1.46 3.29 3.46 0.00 -0.84 -4.96 105.19 106.11 2pq8 n GLY 295 Ca -0.08 -1.21 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 2pq8 n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pq8 s ALA 296 N -1.05 3.08 -0.26 4.61 0.00 0.21 -1.33 121.76 127.02 2pq8 s ALA 296 Ca 0.00 -1.74 -0.13 0.00 0.00 0.00 0.00 51.96 50.10 2pq8 s ALA 296 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 2pq8 s ALA 296 CO 0.00 -1.34 0.27 -1.01 0.00 0.00 0.00 175.76 173.68 2pq8 s HIS 297 N 1.43 3.26 0.16 0.00 4.02 0.29 -4.38 115.29 120.05 2pq8 s HIS 297 Ca -0.01 0.29 -0.31 0.00 1.02 0.00 0.00 55.06 56.04 2pq8 s HIS 297 Cb -0.19 -2.45 -0.10 0.00 -1.02 0.00 0.00 32.58 28.81 2pq8 s HIS 297 CO 0.03 -0.14 1.64 -1.50 1.02 0.00 0.00 174.74 175.79 2pq8 s ILE 298 N 1.75 2.52 -0.04 0.60 2.07 -1.26 -1.37 121.20 125.46 2pq8 s ILE 298 Ca 0.11 0.31 0.08 0.00 -1.41 0.00 0.00 60.65 59.74 2pq8 s ILE 298 Cb -0.15 -3.20 -0.12 0.00 0.13 0.00 0.00 42.46 39.12 2pq8 s ILE 298 CO 0.09 0.02 0.12 1.33 -1.91 0.00 0.00 174.94 174.60 2pq8 n VAL 299 N 4.15 0.22 -1.15 4.00 0.24 -0.15 -4.91 118.33 120.72 2pq8 n VAL 299 Ca 0.15 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 2pq8 n VAL 299 Cb 0.38 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 2pq8 n VAL 299 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pq8 n GLY 300 N 2.21 -1.35 3.65 7.63 0.00 -1.19 -0.79 105.19 115.35 2pq8 n GLY 300 Ca -0.06 -0.99 -0.05 0.00 0.00 0.00 0.00 46.02 44.91 2pq8 n GLY 300 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2pq8 s TYR 301 N -2.36 -0.21 0.07 1.61 -0.85 -0.07 -1.02 117.35 114.51 2pq8 s TYR 301 Ca 0.00 -0.02 0.03 0.00 -0.52 0.00 0.00 57.07 56.56 2pq8 s TYR 301 Cb 0.00 0.60 -0.03 0.00 0.38 0.00 0.00 41.96 42.91 2pq8 s TYR 301 CO 0.00 -0.70 -0.10 -0.59 -1.52 0.00 0.00 175.55 172.64 2pq8 s PHE 302 N -3.19 0.94 0.25 -3.49 -0.12 -0.64 -1.22 117.98 110.52 2pq8 s PHE 302 Ca 0.10 -0.55 0.07 0.00 -0.05 0.00 0.00 56.93 56.50 2pq8 s PHE 302 Cb -0.01 -0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 41.81 2pq8 s PHE 302 CO -0.02 -0.02 0.21 -1.54 -0.05 0.00 0.00 175.22 173.79 2pq8 s SER 303 N -1.91 5.55 -0.12 1.98 1.04 -0.03 -0.89 113.70 119.31 2pq8 s SER 303 Ca -0.03 -0.25 -0.07 0.00 0.48 0.00 0.00 55.95 56.08 2pq8 s SER 303 Cb -0.08 -1.41 0.05 0.00 0.10 0.00 0.00 66.02 64.68 2pq8 s SER 303 CO 0.01 -0.05 0.30 -0.75 0.98 0.00 0.00 173.24 173.73 2pq8 s LYS 304 N -3.85 0.28 -0.03 4.02 2.20 0.00 -0.74 119.74 121.62 2pq8 s LYS 304 Ca 0.33 0.59 -0.30 0.00 -0.36 0.00 0.00 55.97 56.23 2pq8 s LYS 304 Cb -0.08 -0.05 -0.03 0.00 -1.51 0.00 0.00 37.83 36.16 2pq8 s LYS 304 CO 0.25 -0.14 1.13 -2.00 -0.36 0.00 0.00 175.35 174.23 2pq8 s GLU 305 N 1.13 4.42 0.26 4.03 2.12 -1.26 -0.82 118.70 128.57 2pq8 s GLU 305 Ca -0.08 1.60 -0.30 0.00 0.36 0.00 0.00 54.97 56.55 2pq8 s GLU 305 Cb -0.09 -3.49 -0.11 0.00 0.26 0.00 0.00 34.13 30.71 2pq8 s GLU 305 CO -0.08 -0.31 1.58 0.15 -0.54 0.00 0.00 175.26 176.05 2pq8 s LYS 306 N 1.69 4.16 -1.52 4.30 1.02 -0.35 -3.19 119.74 125.85 2pq8 s LYS 306 Ca 0.55 2.50 -0.10 0.00 0.02 0.00 0.00 55.97 58.94 2pq8 s LYS 306 Cb -0.24 -3.06 0.07 0.00 -0.52 0.00 0.00 37.83 34.08 2pq8 s LYS 306 CO 0.24 -0.60 0.73 0.39 -0.92 0.00 0.00 175.35 175.19 2pq8 n GLU 307 N 2.66 -4.11 -1.69 1.68 1.02 -1.26 -4.84 120.64 114.10 2pq8 n GLU 307 Ca 0.10 0.48 -0.51 0.00 -0.02 0.00 0.00 57.16 57.20 2pq8 n GLU 307 Cb 0.38 -5.06 -0.06 0.00 -0.02 0.00 0.00 31.44 26.68 2pq8 n GLU 307 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2pq8 n SER 308 N -2.85 2.98 0.26 1.62 2.88 -1.19 -4.87 113.62 112.45 2pq8 n SER 308 Ca -0.09 1.02 0.13 0.00 -1.33 0.00 0.00 58.87 58.60 2pq8 n SER 308 Cb 0.58 -1.29 0.71 0.00 -0.75 0.00 0.00 64.21 63.46 2pq8 n SER 308 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2pq8 h PRO 309 N 8.09 0.00 -0.08 -1.46 0.13 -1.94 -2.55 132.00 134.19 2pq8 h PRO 309 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2pq8 h PRO 309 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2pq8 h PRO 309 CO 0.94 0.12 0.00 -0.25 -0.23 0.00 0.00 178.00 178.59 2pq8 n ASP 310 N -3.59 1.75 -2.26 1.44 9.92 -1.26 -4.94 116.55 117.61 2pq8 n ASP 310 Ca -0.02 -1.62 -0.15 0.00 -0.53 0.00 0.00 54.79 52.47 2pq8 n ASP 310 Cb 0.26 -0.04 0.04 0.00 -0.64 0.00 0.00 41.12 40.73 2pq8 n ASP 310 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2pq8 n GLY 311 N 1.19 -0.02 3.65 0.44 0.00 -0.96 -4.92 105.19 104.57 2pq8 n GLY 311 Ca 0.18 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2pq8 n GLY 311 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pq8 s ASN 312 N -3.05 6.86 0.00 1.61 0.01 -1.26 -2.31 114.94 116.80 2pq8 s ASN 312 Ca 0.30 1.07 0.25 0.00 -0.71 0.00 0.00 52.86 53.77 2pq8 s ASN 312 Cb -0.13 -2.44 0.52 0.00 0.41 0.00 0.00 41.25 39.61 2pq8 s ASN 312 CO 0.37 -0.47 1.42 -0.46 -1.51 0.00 0.00 177.10 176.46 2pq8 n ASN 313 N 5.72 1.68 -3.82 -1.22 6.94 -0.61 -4.60 115.26 119.35 2pq8 n ASN 313 Ca 0.05 -1.34 -0.12 0.00 -0.02 0.00 0.00 54.58 53.14 2pq8 n ASN 313 Cb 0.48 0.19 -0.13 0.00 -2.36 0.00 0.00 39.78 37.96 2pq8 n ASN 313 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2pq8 s VAL 314 N -2.33 -0.00 -0.06 3.53 1.01 -1.26 -4.81 120.40 116.49 2pq8 s VAL 314 Ca 0.26 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 62.20 2pq8 s VAL 314 Cb 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.34 2pq8 s VAL 314 CO 0.47 0.01 -0.10 0.00 0.00 0.00 0.00 175.10 175.48 2pq8 n ALA 315 N 3.11 0.25 -2.44 5.51 0.00 0.08 -1.05 120.51 125.97 2pq8 n ALA 315 Ca -0.14 -0.34 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 2pq8 n ALA 315 Cb 0.58 0.01 -0.13 0.00 0.00 0.00 0.00 19.45 19.91 2pq8 n ALA 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pq8 s ILE 317 N -0.89 0.64 -0.13 0.00 2.07 -1.26 -0.85 121.20 120.77 2pq8 s ILE 317 Ca 0.14 -0.33 -0.09 0.00 -1.41 0.00 0.00 60.65 58.96 2pq8 s ILE 317 Cb -0.10 -0.55 0.05 0.00 0.13 0.00 0.00 42.46 41.98 2pq8 s ILE 317 CO 0.04 0.19 0.33 -0.22 -1.91 0.00 0.00 174.94 173.38 2pq8 s LEU 318 N -0.05 0.36 -0.23 8.50 2.96 -0.36 -5.01 118.68 124.85 2pq8 s LEU 318 Ca 0.01 0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 54.55 2pq8 s LEU 318 Cb -0.05 1.09 -0.03 0.00 0.50 0.00 0.00 46.19 47.71 2pq8 s LEU 318 CO -0.00 -0.16 0.06 -0.89 -1.32 0.00 0.00 176.35 174.04 2pq8 s THR 319 N 0.91 4.36 0.35 3.68 2.01 -1.26 -0.90 115.64 124.79 2pq8 s THR 319 Ca -0.06 -0.17 -0.28 0.00 0.31 0.00 0.00 61.69 61.49 2pq8 s THR 319 Cb -0.07 -3.01 -0.12 0.00 0.01 0.00 0.00 72.50 69.32 2pq8 s THR 319 CO -0.07 0.38 1.44 0.18 -0.69 0.00 0.00 174.62 175.86 2pq8 n LEU 320 N 4.51 4.26 -0.31 4.42 4.77 0.03 -4.74 117.00 129.93 2pq8 n LEU 320 Ca -0.16 1.21 0.06 0.00 -0.03 0.00 0.00 56.01 57.08 2pq8 n LEU 320 Cb 0.52 -1.57 0.15 0.00 -2.33 0.00 0.00 43.42 40.19 2pq8 n LEU 320 CO 0.32 -0.07 0.72 -0.65 -1.33 0.00 0.00 177.39 176.38 2pq8 h PRO 321 N 3.16 0.02 0.00 3.23 0.11 -1.99 -0.70 132.00 135.82 2pq8 h PRO 321 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2pq8 h PRO 321 Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2pq8 h PRO 321 CO 0.66 0.01 0.00 -0.35 -0.21 0.00 0.00 178.00 178.11 2pq8 n PRO 322 N -5.52 0.13 -0.06 1.05 -0.04 -1.26 -1.66 135.00 127.64 2pq8 n PRO 322 Ca 0.15 0.56 0.08 0.00 -0.04 0.00 0.00 63.50 64.25 2pq8 n PRO 322 Cb 0.50 -1.87 0.10 0.00 -0.04 0.00 0.00 33.50 32.19 2pq8 n PRO 322 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2pq8 n TYR 323 N -2.13 0.16 -1.16 0.54 4.01 -0.28 -5.02 117.16 113.27 2pq8 n TYR 323 Ca -0.00 -0.12 -0.31 0.00 -0.16 0.00 0.00 57.90 57.30 2pq8 n TYR 323 Cb 0.08 -0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.21 2pq8 n TYR 323 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2pq8 s GLN 324 N -1.20 1.96 -0.94 -0.72 -0.21 -0.66 -3.97 119.66 113.92 2pq8 s GLN 324 Ca 0.21 1.33 0.00 0.00 0.02 0.00 0.00 55.36 56.92 2pq8 s GLN 324 Cb 0.14 -1.85 0.00 0.00 1.00 0.00 0.00 33.01 32.29 2pq8 s GLN 324 CO 0.20 -1.89 0.00 0.54 -2.12 0.00 0.00 175.29 172.02 2pq8 n ARG 325 N -3.56 -0.87 0.00 2.91 5.12 -1.26 -4.88 116.66 114.12 2pq8 n ARG 325 Ca 0.10 0.54 0.00 0.00 -1.93 0.00 0.00 57.85 56.56 2pq8 n ARG 325 Cb 0.52 -4.64 0.00 0.00 -1.16 0.00 0.00 32.46 27.18 2pq8 n ARG 325 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2pq8 n ARG 326 N -2.07 -0.39 -0.07 5.56 1.74 -1.25 -5.01 116.66 115.17 2pq8 n ARG 326 Ca -0.13 -0.52 0.00 0.00 -0.77 0.00 0.00 57.85 56.43 2pq8 n ARG 326 Cb 0.59 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 31.13 2pq8 n ARG 326 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pq8 n GLY 327 N -0.05 0.63 0.29 -0.13 0.00 -1.26 -4.72 105.19 99.94 2pq8 n GLY 327 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2pq8 n GLY 327 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2pq8 h TYR 328 N 0.00 0.94 -0.07 1.61 0.05 -1.94 -1.32 116.97 116.24 2pq8 h TYR 328 Ca 0.00 -0.16 0.02 0.00 0.05 0.00 0.00 58.73 58.65 2pq8 h TYR 328 Cb 0.00 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.47 2pq8 h TYR 328 CO 0.00 0.88 -0.06 0.78 -1.05 0.00 0.00 178.16 178.71 2pq8 h GLY 329 N 0.98 0.01 1.86 3.88 0.00 -1.93 -0.08 103.07 107.78 2pq8 h GLY 329 Ca 0.14 0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.45 2pq8 h GLY 329 CO 0.03 -0.07 -0.35 0.50 0.00 0.00 0.00 176.54 176.65 2pq8 h LYS 330 N -0.07 0.16 -0.22 4.80 1.57 -1.88 -0.78 116.57 120.16 2pq8 h LYS 330 Ca 0.05 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2pq8 h LYS 330 Cb 0.14 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2pq8 h LYS 330 CO -0.11 0.50 0.14 0.35 -0.57 0.00 0.00 179.45 179.76 2pq8 h PHE 331 N 0.14 0.28 -0.75 -1.35 3.57 -0.84 -0.88 116.94 117.11 2pq8 h PHE 331 Ca 0.02 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2pq8 h PHE 331 Cb 0.70 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 2pq8 h PHE 331 CO 0.01 0.19 0.42 -0.07 -2.23 0.00 0.00 178.31 176.63 2pq8 h LEU 332 N 0.29 0.93 -0.06 0.59 3.38 -0.52 0.11 115.31 120.04 2pq8 h LEU 332 Ca 0.08 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2pq8 h LEU 332 Cb -0.02 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2pq8 h LEU 332 CO -0.02 0.76 0.03 0.40 0.09 0.00 0.00 178.44 179.70 2pq8 h ILE 333 N 1.04 1.07 -0.95 1.22 2.04 -1.11 -0.97 117.51 119.85 2pq8 h ILE 333 Ca 0.27 -0.20 0.05 0.00 1.00 0.00 0.00 64.86 65.98 2pq8 h ILE 333 Cb 0.02 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 2pq8 h ILE 333 CO -0.04 0.06 0.61 0.00 0.00 0.00 0.00 178.15 178.77 2pq8 h ALA 334 N 0.95 1.28 -0.63 1.87 0.00 -0.76 -2.01 119.26 119.96 2pq8 h ALA 334 Ca 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2pq8 h ALA 334 Cb 0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2pq8 h ALA 334 CO -0.00 0.42 0.17 0.35 0.00 0.00 0.00 179.25 180.20 2pq8 h PHE 335 N 1.13 1.04 -0.68 0.00 3.57 -0.46 -0.62 116.94 120.92 2pq8 h PHE 335 Ca 0.40 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.79 2pq8 h PHE 335 Cb 0.10 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 2pq8 h PHE 335 CO -0.01 0.86 0.45 0.66 -2.23 0.00 0.00 178.31 178.04 2pq8 h SER 336 N 0.92 0.78 0.74 0.41 4.64 -0.47 -1.83 113.55 118.75 2pq8 h SER 336 Ca 0.20 -0.02 -0.18 0.00 -0.47 0.00 0.00 61.79 61.32 2pq8 h SER 336 Cb 0.33 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2pq8 h SER 336 CO -0.00 0.57 -0.83 1.88 -0.87 0.00 0.00 176.83 177.58 2pq8 h TYR 337 N 0.92 0.09 -0.62 4.77 0.05 -0.96 -2.31 116.97 118.91 2pq8 h TYR 337 Ca 0.25 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.96 2pq8 h TYR 337 Cb -0.10 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.60 2pq8 h TYR 337 CO -0.00 0.86 0.29 0.93 -1.05 0.00 0.00 178.16 179.18 2pq8 h GLU 338 N 0.03 0.89 -0.26 4.88 4.39 -0.35 -0.13 114.58 124.04 2pq8 h GLU 338 Ca -0.02 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.50 2pq8 h GLU 338 Cb 1.45 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 2pq8 h GLU 338 CO 0.11 0.70 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.51 2pq8 h LEU 339 N 0.88 0.52 -0.79 1.33 3.38 -1.24 -2.49 115.31 116.91 2pq8 h LEU 339 Ca 0.22 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.88 2pq8 h LEU 339 Cb 0.11 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 2pq8 h LEU 339 CO -0.03 0.79 0.45 0.28 0.09 0.00 0.00 178.44 180.02 2pq8 h SER 340 N 0.26 0.67 0.03 -0.43 0.02 -0.84 -0.49 113.55 112.77 2pq8 h SER 340 Ca 0.06 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2pq8 h SER 340 Cb 0.57 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2pq8 h SER 340 CO 0.03 0.41 -0.05 0.11 -1.14 0.00 0.00 176.83 176.18 2pq8 h LYS 341 N 0.79 -0.10 0.00 3.45 1.57 -0.99 -1.68 116.57 119.61 2pq8 h LYS 341 Ca 0.36 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 2pq8 h LYS 341 Cb 0.27 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 2pq8 h LYS 341 CO -0.22 -0.07 -0.05 -0.07 -0.57 0.00 0.00 179.45 178.48 2pq8 h LEU 342 N -0.11 0.00 -0.46 2.94 3.38 -0.95 -0.02 115.31 120.09 2pq8 h LEU 342 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2pq8 h LEU 342 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2pq8 h LEU 342 CO -0.03 0.05 -0.02 -0.62 0.09 0.00 0.00 178.44 177.91 2pq8 n GLU 343 N -3.63 1.25 -3.56 1.13 1.02 -0.24 -4.60 120.64 112.00 2pq8 n GLU 343 Ca -0.02 -0.46 -0.21 0.00 -0.02 0.00 0.00 57.16 56.44 2pq8 n GLU 343 Cb 0.15 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.13 2pq8 n GLU 343 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2pq8 n SER 344 N -0.47 -2.96 -3.65 1.62 7.64 -0.02 -5.00 113.62 110.78 2pq8 n SER 344 Ca 0.20 -0.79 -0.15 0.00 1.01 0.00 0.00 58.87 59.14 2pq8 n SER 344 Cb 0.24 -4.37 -0.07 0.00 -1.01 0.00 0.00 64.21 59.01 2pq8 n SER 344 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2pq8 s THR 345 N -3.53 0.04 0.55 0.44 -1.32 -0.73 -5.04 115.64 106.04 2pq8 s THR 345 Ca 0.16 -0.30 -0.08 0.00 -1.21 0.00 0.00 61.69 60.27 2pq8 s THR 345 Cb -0.04 -0.84 -0.03 0.00 -1.51 0.00 0.00 72.50 70.08 2pq8 s THR 345 CO 0.79 -0.16 0.89 0.68 -2.21 0.00 0.00 174.62 174.61 2pq8 s VAL 346 N -1.62 4.73 0.17 5.08 -7.23 -1.26 -4.18 120.40 116.09 2pq8 s VAL 346 Ca -0.10 0.46 -0.20 0.00 -1.81 0.00 0.00 61.98 60.32 2pq8 s VAL 346 Cb -0.02 -3.84 0.05 0.00 0.56 0.00 0.00 36.38 33.13 2pq8 s VAL 346 CO 0.04 -0.94 0.56 -0.83 -0.31 0.00 0.00 175.10 173.62 2pq8 s GLY 347 N -4.15 -0.41 0.03 2.32 0.00 -0.47 -4.93 107.32 99.71 2pq8 s GLY 347 Ca 0.51 0.18 -0.05 0.00 0.00 0.00 0.00 44.72 45.36 2pq8 s GLY 347 CO 0.49 -0.03 0.07 -0.45 0.00 0.00 0.00 173.10 173.18 2pq8 s SER 348 N -2.80 0.18 0.47 1.64 0.15 -0.98 -3.86 113.70 108.50 2pq8 s SER 348 Ca 0.04 -0.49 -0.24 0.00 0.70 0.00 0.00 55.95 55.96 2pq8 s SER 348 Cb -0.01 0.20 -0.07 0.00 -1.71 0.00 0.00 66.02 64.43 2pq8 s SER 348 CO -0.09 -0.44 1.31 -2.16 1.20 0.00 0.00 173.24 173.05 2pq8 s PRO 349 N -2.21 3.62 0.14 5.44 0.04 -1.26 -1.58 135.00 139.19 2pq8 s PRO 349 Ca -0.08 2.14 -0.35 0.00 0.04 0.00 0.00 61.00 62.75 2pq8 s PRO 349 Cb -0.04 -2.51 -0.15 0.00 0.04 0.00 0.00 34.50 31.85 2pq8 s PRO 349 CO -0.03 -0.78 1.53 -1.91 0.04 0.00 0.00 177.00 175.85 2pq8 n GLU 350 N -0.42 1.90 -3.51 4.56 2.13 -0.21 -4.91 120.64 120.18 2pq8 n GLU 350 Ca 0.07 0.69 -0.23 0.00 0.66 0.00 0.00 57.16 58.35 2pq8 n GLU 350 Cb 0.45 -2.43 -0.01 0.00 0.27 0.00 0.00 31.44 29.72 2pq8 n GLU 350 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2pq8 s LYS 351 N 0.88 3.40 0.50 5.31 3.01 -1.26 -4.48 119.74 127.09 2pq8 s LYS 351 Ca 0.80 -0.52 -0.19 0.00 -1.01 0.00 0.00 55.97 55.06 2pq8 s LYS 351 Cb -0.75 -2.73 -0.08 0.00 -1.01 0.00 0.00 37.83 33.27 2pq8 s LYS 351 CO 0.40 0.18 1.01 -1.25 0.51 0.00 0.00 175.35 176.21 2pq8 s PRO 352 N -4.24 3.83 0.07 -1.68 0.04 -1.26 -5.15 135.00 126.61 2pq8 s PRO 352 Ca 0.39 1.21 -0.20 0.00 0.04 0.00 0.00 61.00 62.44 2pq8 s PRO 352 Cb -0.09 -2.11 -0.07 0.00 0.04 0.00 0.00 34.50 32.27 2pq8 s PRO 352 CO 0.34 -0.38 0.60 -0.51 0.04 0.00 0.00 177.00 177.09 2pq8 s LEU 353 N -3.70 4.51 0.93 -3.56 1.43 -1.26 -5.08 118.68 111.95 2pq8 s LEU 353 Ca 0.64 1.29 -0.11 0.00 -1.03 0.00 0.00 54.13 54.92 2pq8 s LEU 353 Cb -0.13 -2.95 0.15 0.00 0.03 0.00 0.00 46.19 43.28 2pq8 s LEU 353 CO 0.23 0.23 1.11 -0.94 0.23 0.00 0.00 176.35 177.21 2pq8 s SER 354 N -0.90 2.88 0.27 2.29 1.04 -1.26 -4.71 113.70 113.31 2pq8 s SER 354 Ca 0.30 1.94 -0.01 0.00 0.48 0.00 0.00 55.95 58.66 2pq8 s SER 354 Cb -0.20 -2.47 0.44 0.00 0.10 0.00 0.00 66.02 63.89 2pq8 s SER 354 CO 0.20 -3.08 1.88 0.44 0.98 0.00 0.00 173.24 173.66 2pq8 h ASP 355 N -1.85 1.01 -0.51 7.02 3.32 -1.99 0.22 116.42 123.64 2pq8 h ASP 355 Ca -0.47 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.47 2pq8 h ASP 355 Cb 1.28 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 2pq8 h ASP 355 CO 0.46 0.64 -0.14 -0.07 -1.72 0.00 0.00 179.24 178.40 2pq8 h LEU 356 N 1.14 1.01 -0.38 1.55 3.38 -2.00 -1.94 115.31 118.08 2pq8 h LEU 356 Ca 0.43 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 58.08 2pq8 h LEU 356 Cb 0.20 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2pq8 h LEU 356 CO -0.18 1.14 0.20 1.23 0.09 0.00 0.00 178.44 180.93 2pq8 h GLY 357 N 0.92 0.52 0.59 0.83 0.00 -1.64 -2.30 103.07 102.00 2pq8 h GLY 357 Ca 0.13 -0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.35 2pq8 h GLY 357 CO 0.05 0.12 -0.04 0.50 0.00 0.00 0.00 176.54 177.17 2pq8 h LYS 358 N 0.42 0.01 -0.78 4.80 1.57 -0.40 -0.03 116.57 122.16 2pq8 h LYS 358 Ca 0.16 -0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.00 2pq8 h LYS 358 Cb 0.04 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 2pq8 h LYS 358 CO -0.09 0.01 0.47 -0.07 -0.57 0.00 0.00 179.45 179.19 2pq8 h LEU 359 N 0.01 0.72 -0.04 2.94 3.38 -1.26 -0.76 115.31 120.30 2pq8 h LEU 359 Ca 0.10 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2pq8 h LEU 359 Cb 0.15 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2pq8 h LEU 359 CO -0.21 0.46 -0.03 0.28 0.09 0.00 0.00 178.44 179.04 2pq8 h SER 360 N 0.85 0.08 -0.35 -0.43 0.02 -0.97 -2.61 113.55 110.14 2pq8 h SER 360 Ca 0.34 -0.45 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2pq8 h SER 360 Cb 0.17 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 2pq8 h SER 360 CO -0.17 0.52 0.21 1.88 -1.14 0.00 0.00 176.83 178.13 2pq8 h TYR 361 N -0.35 0.47 -0.82 3.45 0.05 -0.93 -2.22 116.97 116.62 2pq8 h TYR 361 Ca 0.01 -0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.81 2pq8 h TYR 361 Cb 0.49 -0.15 -0.05 0.00 1.01 0.00 0.00 36.73 38.03 2pq8 h TYR 361 CO 0.08 0.34 0.54 0.00 -1.05 0.00 0.00 178.16 178.07 2pq8 h ARG 362 N 0.46 1.01 -0.06 4.88 2.47 -1.17 0.11 114.38 122.08 2pq8 h ARG 362 Ca 0.13 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 2pq8 h ARG 362 Cb 0.01 -0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 28.10 2pq8 h ARG 362 CO -0.02 0.67 -0.01 1.03 0.56 0.00 0.00 179.97 182.20 2pq8 h SER 363 N 1.04 0.11 0.29 7.04 0.87 -1.29 -1.01 113.55 120.60 2pq8 h SER 363 Ca 0.32 -0.34 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 2pq8 h SER 363 Cb -0.00 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2pq8 h SER 363 CO -0.09 0.43 -0.20 0.22 -0.53 0.00 0.00 176.83 176.66 2pq8 h TYR 364 N -0.21 -0.52 -0.32 2.24 3.20 -1.11 -2.53 116.97 117.71 2pq8 h TYR 364 Ca 0.02 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.90 2pq8 h TYR 364 Cb 0.38 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 2pq8 h TYR 364 CO 0.04 -0.31 0.17 -1.49 -1.64 0.00 0.00 178.16 174.93 2pq8 h TRP 365 N -0.49 0.31 -0.26 -3.82 6.55 -0.78 -1.52 115.95 115.94 2pq8 h TRP 365 Ca -0.03 0.01 0.06 0.00 0.95 0.00 0.00 58.89 59.89 2pq8 h TRP 365 Cb 0.41 -0.09 -0.06 0.00 -0.86 0.00 0.00 29.16 28.56 2pq8 h TRP 365 CO -0.11 0.17 -0.12 0.77 -1.05 0.00 0.00 178.44 178.11 2pq8 h SER 366 N 0.34 -0.40 -0.01 -3.49 0.02 -1.18 -0.42 113.55 108.42 2pq8 h SER 366 Ca 0.13 0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2pq8 h SER 366 Cb 0.04 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2pq8 h SER 366 CO -0.09 -0.15 -0.03 -0.25 -1.14 0.00 0.00 176.83 175.18 2pq8 h TRP 367 N -0.08 -0.06 -0.36 3.45 7.01 -1.13 -1.64 115.95 123.14 2pq8 h TRP 367 Ca 0.14 0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.16 2pq8 h TRP 367 Cb 0.29 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.35 2pq8 h TRP 367 CO -0.31 -0.04 0.20 0.28 -2.79 0.00 0.00 178.44 175.79 2pq8 h VAL 368 N -0.04 1.03 -0.49 2.65 2.07 -1.07 -0.91 116.25 119.49 2pq8 h VAL 368 Ca 0.01 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 2pq8 h VAL 368 Cb 0.06 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2pq8 h VAL 368 CO -0.03 0.08 0.05 -0.07 0.02 0.00 0.00 177.57 177.61 2pq8 h LEU 369 N 0.42 0.80 -0.55 2.57 3.38 -1.01 -2.22 115.31 118.71 2pq8 h LEU 369 Ca 0.14 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 2pq8 h LEU 369 Cb 0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2pq8 h LEU 369 CO -0.07 0.88 -0.08 -0.07 0.09 0.00 0.00 178.44 179.20 2pq8 h LEU 370 N 0.70 1.02 -1.22 1.67 3.38 -1.12 -1.12 115.31 118.62 2pq8 h LEU 370 Ca 0.14 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2pq8 h LEU 370 Cb 0.44 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 2pq8 h LEU 370 CO 0.02 1.12 0.51 -0.33 0.09 0.00 0.00 178.44 179.84 2pq8 h GLU 371 N 0.91 1.03 0.00 1.13 4.39 -1.11 -2.14 114.58 118.78 2pq8 h GLU 371 Ca 0.15 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 2pq8 h GLU 371 Cb 0.64 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2pq8 h GLU 371 CO 0.04 0.69 -0.20 -0.91 -1.16 0.00 0.00 179.01 177.47 2pq8 h ASN 372 N 1.06 0.00 -0.38 1.42 2.35 -0.88 -2.80 115.58 116.35 2pq8 h ASN 372 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 2pq8 h ASN 372 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 2pq8 h ASN 372 CO -0.06 0.20 0.00 0.18 -1.65 0.00 0.00 177.43 176.10 2pq8 n LEU 373 N -3.27 2.48 -0.58 1.61 4.77 -0.47 -5.10 117.00 116.44 2pq8 n LEU 373 Ca 0.01 -1.16 0.08 0.00 -0.03 0.00 0.00 56.01 54.91 2pq8 n LEU 373 Cb 0.47 -0.25 0.20 0.00 -2.33 0.00 0.00 43.42 41.51 2pq8 n LEU 373 CO 0.34 0.58 0.65 0.54 -1.33 0.00 0.00 177.39 178.16 2pq8 n ARG 374 N 0.85 2.49 -0.09 3.23 1.74 -0.86 -4.78 116.66 119.24 2pq8 n ARG 374 Ca 0.17 -2.59 -0.15 0.00 -0.77 0.00 0.00 57.85 54.51 2pq8 n ARG 374 Cb 0.42 -1.63 -0.07 0.00 -1.02 0.00 0.00 32.46 30.16 2pq8 n ARG 374 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2pq8 n ILE 382 N -0.63 1.00 0.13 0.55 5.41 -1.26 -5.03 119.36 119.53 2pq8 n ILE 382 Ca 0.17 -0.33 0.07 0.00 1.00 0.00 0.00 62.75 63.66 2pq8 n ILE 382 Cb 0.73 -1.36 0.55 0.00 -0.71 0.00 0.00 39.64 38.85 2pq8 n ILE 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2pq8 h LYS 383 N -0.26 0.22 0.04 0.38 1.57 -1.98 0.28 116.57 116.84 2pq8 h LYS 383 Ca -0.42 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2pq8 h LYS 383 Cb 1.53 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.79 2pq8 h LYS 383 CO -0.15 0.15 -0.02 -0.44 -0.57 0.00 0.00 179.45 178.42 2pq8 h ASP 384 N 0.23 -0.05 -0.86 0.86 3.32 -2.01 -0.04 116.42 117.87 2pq8 h ASP 384 Ca 0.08 -0.32 0.02 0.00 0.02 0.00 0.00 57.03 56.83 2pq8 h ASP 384 Cb 0.05 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.57 2pq8 h ASP 384 CO -0.02 0.30 0.57 -0.07 -1.72 0.00 0.00 179.24 178.30 2pq8 h LEU 385 N -0.40 0.96 -0.38 1.55 3.38 -1.87 -0.71 115.31 117.83 2pq8 h LEU 385 Ca -0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2pq8 h LEU 385 Cb 0.37 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2pq8 h LEU 385 CO 0.01 0.68 0.11 -1.28 0.09 0.00 0.00 178.44 178.05 2pq8 h SER 386 N 1.12 0.55 -0.40 -0.43 0.87 -0.36 -1.59 113.55 113.32 2pq8 h SER 386 Ca 0.33 -0.21 -0.09 0.00 -1.23 0.00 0.00 61.79 60.59 2pq8 h SER 386 Cb -0.07 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.73 2pq8 h SER 386 CO -0.08 0.61 -0.06 1.56 -0.53 0.00 0.00 176.83 178.32 2pq8 h GLN 387 N 0.46 0.83 0.00 2.24 7.50 -0.67 -0.37 115.11 125.10 2pq8 h GLN 387 Ca 0.12 -0.26 -0.13 0.00 0.50 0.00 0.00 58.65 58.88 2pq8 h GLN 387 Cb 0.26 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.69 2pq8 h GLN 387 CO -0.00 0.87 -0.62 0.52 -1.50 0.00 0.00 178.83 178.10 2pq8 h MET 388 N 0.76 0.00 0.00 1.46 2.07 -0.98 -3.36 114.93 114.89 2pq8 h MET 388 Ca 0.13 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.76 2pq8 h MET 388 Cb 0.55 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.28 2pq8 h MET 388 CO 0.03 0.62 -0.58 0.25 1.07 0.00 0.00 176.91 178.30 2pq8 n THR 389 N -3.78 0.00 -1.03 2.22 -2.24 -0.61 -4.99 114.28 103.85 2pq8 n THR 389 Ca -0.01 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.48 2pq8 n THR 389 Cb 0.62 0.88 -0.00 0.00 -2.10 0.00 0.00 70.33 69.73 2pq8 n THR 389 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2pq8 n SER 390 N -1.31 -5.77 -4.74 3.42 7.64 -0.16 -4.88 113.62 107.82 2pq8 n SER 390 Ca 0.01 0.02 -0.40 0.00 1.01 0.00 0.00 58.87 59.51 2pq8 n SER 390 Cb 0.15 -3.35 -0.05 0.00 -1.01 0.00 0.00 64.21 59.95 2pq8 n SER 390 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2pq8 s ILE 391 N -1.15 4.54 0.67 0.44 1.01 -1.23 -1.37 121.20 124.10 2pq8 s ILE 391 Ca 0.00 1.87 -0.14 0.00 0.00 0.00 0.00 60.65 62.37 2pq8 s ILE 391 Cb 0.00 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.25 2pq8 s ILE 391 CO 0.00 0.37 1.10 0.42 0.00 0.00 0.00 174.94 176.83 2pq8 s THR 392 N -0.23 3.31 0.29 2.92 -4.23 -1.25 -4.32 115.64 112.13 2pq8 s THR 392 Ca 0.42 0.58 -0.03 0.00 -1.18 0.00 0.00 61.69 61.48 2pq8 s THR 392 Cb -0.22 -3.10 0.26 0.00 1.34 0.00 0.00 72.50 70.77 2pq8 s THR 392 CO 0.27 -0.41 1.96 1.56 -0.54 0.00 0.00 174.62 177.46 2pq8 h GLN 393 N -0.11 1.14 -0.52 3.99 4.20 -1.94 -0.44 115.11 121.43 2pq8 h GLN 393 Ca -0.46 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.23 2pq8 h GLN 393 Cb 1.24 -0.26 -0.05 0.00 0.30 0.00 0.00 27.48 28.72 2pq8 h GLN 393 CO 0.54 0.76 0.26 -0.91 -0.67 0.00 0.00 178.83 178.81 2pq8 h ASN 394 N 1.18 0.38 0.41 1.46 2.35 -1.99 0.27 115.58 119.63 2pq8 h ASN 394 Ca 0.32 0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.96 2pq8 h ASN 394 Cb -0.14 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2pq8 h ASN 394 CO -0.07 0.26 -0.60 0.44 -1.65 0.00 0.00 177.43 175.81 2pq8 h ASP 395 N 0.51 0.20 -0.31 5.81 3.32 -1.78 -1.56 116.42 122.61 2pq8 h ASP 395 Ca 0.23 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 2pq8 h ASP 395 Cb 0.15 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2pq8 h ASP 395 CO -0.17 0.75 0.07 0.40 -1.72 0.00 0.00 179.24 178.57 2pq8 h ILE 396 N 0.13 1.22 -0.26 0.35 2.04 -0.72 -2.28 117.51 118.00 2pq8 h ILE 396 Ca -0.01 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 2pq8 h ILE 396 Cb 1.08 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 2pq8 h ILE 396 CO 0.09 0.25 0.15 0.40 0.00 0.00 0.00 178.15 179.03 2pq8 h ILE 397 N 0.34 1.12 -0.43 -0.67 2.04 -0.31 0.82 117.51 120.42 2pq8 h ILE 397 Ca 0.10 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 2pq8 h ILE 397 Cb 0.31 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 2pq8 h ILE 397 CO 0.00 0.12 0.02 0.77 0.00 0.00 0.00 178.15 179.06 2pq8 h SER 398 N 0.31 0.65 -0.16 1.72 4.64 -1.32 0.16 113.55 119.55 2pq8 h SER 398 Ca 0.09 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.21 2pq8 h SER 398 Cb 0.06 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2pq8 h SER 398 CO -0.02 0.70 -0.16 0.74 -0.87 0.00 0.00 176.83 177.23 2pq8 h THR 399 N 0.65 1.34 -0.25 2.95 2.02 -1.08 -2.77 112.91 115.77 2pq8 h THR 399 Ca 0.14 -1.31 -0.07 0.00 0.77 0.00 0.00 66.41 65.93 2pq8 h THR 399 Cb 0.37 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 2pq8 h THR 399 CO 0.01 0.39 -0.15 -0.07 0.37 0.00 0.00 175.52 176.07 2pq8 h LEU 400 N 0.03 0.41 -0.66 2.58 3.38 -0.65 -2.22 115.31 118.18 2pq8 h LEU 400 Ca 0.03 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 57.96 2pq8 h LEU 400 Cb 0.69 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 2pq8 h LEU 400 CO 0.04 0.60 0.34 1.56 0.09 0.00 0.00 178.44 181.07 2pq8 h GLN 401 N 0.39 0.60 0.00 1.13 4.20 -0.95 0.40 115.11 120.88 2pq8 h GLN 401 Ca 0.07 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 2pq8 h GLN 401 Cb 0.51 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2pq8 h GLN 401 CO 0.03 0.40 -0.22 0.77 -0.67 0.00 0.00 178.83 179.14 2pq8 h SER 402 N 0.62 0.00 0.01 1.46 0.02 -1.12 -1.69 113.55 112.85 2pq8 h SER 402 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2pq8 h SER 402 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2pq8 h SER 402 CO -0.21 0.22 -0.03 0.18 -1.14 0.00 0.00 176.83 175.84 2pq8 n LEU 403 N -3.69 1.57 -3.88 5.07 4.77 -0.73 -4.96 117.00 115.15 2pq8 n LEU 403 Ca -0.01 -0.52 -0.25 0.00 -0.03 0.00 0.00 56.01 55.20 2pq8 n LEU 403 Cb 0.33 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.41 2pq8 n LEU 403 CO 0.33 0.26 -0.16 0.59 -1.33 0.00 0.00 177.39 177.09 2pq8 n ASN 404 N 0.18 -0.92 -0.56 -1.43 3.02 -0.14 -4.92 115.26 110.50 2pq8 n ASN 404 Ca 0.18 -0.94 0.07 0.00 -0.03 0.00 0.00 54.58 53.86 2pq8 n ASN 404 Cb 0.37 -3.40 0.17 0.00 -0.61 0.00 0.00 39.78 36.31 2pq8 n ASN 404 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2pq8 n MET 405 N -4.37 1.31 -3.77 3.52 2.81 -0.06 -4.91 117.12 111.65 2pq8 n MET 405 Ca -0.27 -2.93 -0.13 0.00 -1.81 0.00 0.00 57.70 52.55 2pq8 n MET 405 Cb 0.67 -1.40 -0.10 0.00 -0.71 0.00 0.00 33.22 31.68 2pq8 n MET 405 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2pq8 s VAL 406 N -2.73 0.02 0.14 2.03 0.11 -1.26 0.06 120.40 118.78 2pq8 s VAL 406 Ca 0.35 -0.18 0.08 0.00 -2.93 0.00 0.00 61.98 59.30 2pq8 s VAL 406 Cb 0.34 -0.49 -0.04 0.00 -1.53 0.00 0.00 36.38 34.65 2pq8 s VAL 406 CO -0.05 -0.10 -0.18 -0.54 -3.33 0.00 0.00 175.10 170.90 2pq8 s LYS 407 N -0.36 1.20 -0.11 1.54 -0.14 0.68 -4.89 119.74 117.66 2pq8 s LYS 407 Ca -0.05 -1.32 0.00 0.00 -1.36 0.00 0.00 55.97 53.24 2pq8 s LYS 407 Cb -0.03 -1.27 -0.02 0.00 -1.68 0.00 0.00 37.83 34.83 2pq8 s LYS 407 CO 0.02 0.27 -0.12 -0.47 -0.76 0.00 0.00 175.35 174.28 2pq8 s TYR 408 N -1.85 2.83 -0.06 3.18 5.04 -1.26 0.86 117.35 126.08 2pq8 s TYR 408 Ca 0.12 -0.47 0.03 0.00 -2.44 0.00 0.00 57.07 54.31 2pq8 s TYR 408 Cb -0.07 -1.81 -0.02 0.00 0.35 0.00 0.00 41.96 40.41 2pq8 s TYR 408 CO 0.05 -0.08 -0.13 -1.01 -1.34 0.00 0.00 175.55 173.04 2pq8 s HIS 413 N 0.08 2.75 -0.09 4.97 3.76 -1.26 -5.24 115.29 120.25 2pq8 s HIS 413 Ca -0.05 -0.20 0.02 0.00 -0.15 0.00 0.00 55.06 54.68 2pq8 s HIS 413 Cb -0.14 -1.67 0.02 0.00 1.11 0.00 0.00 32.58 31.89 2pq8 s HIS 413 CO 0.04 0.15 -0.13 0.08 -0.85 0.00 0.00 174.74 174.03 2pq8 s VAL 414 N -0.59 1.33 0.18 -0.90 1.01 0.25 -4.78 120.40 116.89 2pq8 s VAL 414 Ca 0.09 -0.55 -0.30 0.00 0.00 0.00 0.00 61.98 61.21 2pq8 s VAL 414 Cb -0.11 -1.23 -0.08 0.00 0.00 0.00 0.00 36.38 34.96 2pq8 s VAL 414 CO 0.01 0.41 1.29 -0.63 0.00 0.00 0.00 175.10 176.17 2pq8 s ILE 415 N 0.97 3.35 -0.32 2.22 1.01 -1.26 -0.23 121.20 126.94 2pq8 s ILE 415 Ca -0.08 1.09 -0.02 0.00 0.00 0.00 0.00 60.65 61.64 2pq8 s ILE 415 Cb -0.15 -3.70 0.12 0.00 0.01 0.00 0.00 42.46 38.74 2pq8 s ILE 415 CO -0.01 0.15 0.16 0.00 0.00 0.00 0.00 174.94 175.25 2pq8 s VAL 417 N 1.60 0.01 0.20 0.00 0.11 -1.26 -4.41 120.40 116.64 2pq8 s VAL 417 Ca 0.13 -0.05 0.04 0.00 -2.93 0.00 0.00 61.98 59.16 2pq8 s VAL 417 Cb -0.19 -0.99 -0.03 0.00 -1.53 0.00 0.00 36.38 33.64 2pq8 s VAL 417 CO -0.21 -0.03 0.32 0.42 -3.33 0.00 0.00 175.10 172.28 2pq8 s THR 418 N -2.33 5.29 0.31 5.04 -4.23 -1.26 -5.01 115.64 113.46 2pq8 s THR 418 Ca -0.06 -0.84 0.07 0.00 -1.18 0.00 0.00 61.69 59.68 2pq8 s THR 418 Cb -0.01 -3.80 0.31 0.00 1.34 0.00 0.00 72.50 70.34 2pq8 s THR 418 CO -0.00 -0.21 1.78 -0.65 -0.54 0.00 0.00 174.62 174.99 2pq8 h PRO 419 N 1.64 0.71 -0.57 3.99 0.11 -2.00 -1.60 132.00 134.27 2pq8 h PRO 419 Ca -0.50 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.47 2pq8 h PRO 419 Cb 1.21 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2pq8 h PRO 419 CO 0.65 0.47 -0.02 0.87 -0.21 0.00 0.00 178.00 179.75 2pq8 h LYS 420 N 0.73 1.02 -0.58 1.05 6.56 -1.96 -0.92 116.57 122.46 2pq8 h LYS 420 Ca 0.57 -0.33 -0.06 0.00 -1.06 0.00 0.00 60.65 59.77 2pq8 h LYS 420 Cb 0.94 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 32.49 2pq8 h LYS 420 CO -0.36 1.01 0.12 1.37 -2.06 0.00 0.00 179.45 179.53 2pq8 h LEU 421 N 0.93 0.90 -0.46 2.94 -0.00 -1.83 -0.89 115.31 116.90 2pq8 h LEU 421 Ca 0.16 -0.25 -0.03 0.00 -0.00 0.00 0.00 57.88 57.77 2pq8 h LEU 421 Cb 0.57 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.97 2pq8 h LEU 421 CO 0.03 0.92 0.16 0.58 -0.00 0.00 0.00 178.44 180.13 2pq8 h VAL 422 N 0.85 1.21 -0.70 0.15 2.07 -1.08 -2.34 116.25 116.41 2pq8 h VAL 422 Ca 0.18 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 2pq8 h VAL 422 Cb 0.38 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2pq8 h VAL 422 CO 0.01 0.25 0.25 -0.33 0.02 0.00 0.00 177.57 177.76 2pq8 h GLU 423 N 0.60 1.07 -0.57 1.57 5.08 -1.04 -1.48 114.58 119.81 2pq8 h GLU 423 Ca 0.15 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2pq8 h GLU 423 Cb 0.23 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 2pq8 h GLU 423 CO -0.01 0.91 0.34 1.05 -1.00 0.00 0.00 179.01 180.30 2pq8 h GLU 424 N 1.02 0.66 -0.46 2.33 4.11 -1.02 -0.05 114.58 121.17 2pq8 h GLU 424 Ca 0.23 -0.04 -0.03 0.00 0.07 0.00 0.00 59.36 59.59 2pq8 h GLU 424 Cb 0.26 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2pq8 h GLU 424 CO -0.01 0.43 0.16 0.45 0.07 0.00 0.00 179.01 180.11 2pq8 h HIS 425 N 0.68 0.72 0.00 2.06 3.86 -1.18 -2.55 115.15 118.74 2pq8 h HIS 425 Ca 0.23 -0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 59.34 2pq8 h HIS 425 Cb 0.03 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.28 2pq8 h HIS 425 CO -0.06 0.63 -0.16 -0.07 0.86 0.00 0.00 177.93 179.14 2pq8 h LEU 426 N 0.60 0.00 -0.91 2.43 3.38 -0.97 -1.56 115.31 118.28 2pq8 h LEU 426 Ca 0.15 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2pq8 h LEU 426 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2pq8 h LEU 426 CO -0.01 0.16 -0.29 0.11 0.09 0.00 0.00 178.44 178.50 2pq8 h LYS 427 N 0.00 0.00 -7.32 1.13 1.57 -0.75 -3.45 116.57 107.76 2pq8 h LYS 427 Ca -0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 2pq8 h LYS 427 Cb 0.59 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.97 2pq8 h LYS 427 CO 0.02 0.29 0.39 -1.54 -0.57 0.00 0.00 179.45 178.04 2pq8 s SER 428 N -6.28 5.93 0.02 0.86 1.04 -0.59 -4.96 113.70 109.73 2pq8 s SER 428 Ca 0.01 1.54 0.20 0.00 0.48 0.00 0.00 55.95 58.18 2pq8 s SER 428 Cb 0.10 -2.49 0.83 0.00 0.10 0.00 0.00 66.02 64.56 2pq8 s SER 428 CO 0.66 -1.07 1.63 0.00 0.98 0.00 0.00 173.24 175.44 2pq8 n ALA 429 N -2.69 1.88 0.35 5.32 0.00 -1.26 -3.31 120.51 120.80 2pq8 n ALA 429 Ca 0.07 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.57 2pq8 n ALA 429 Cb 0.54 -1.32 0.18 0.00 0.00 0.00 0.00 19.45 18.84 2pq8 n ALA 429 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2pq8 h GLN 430 N 0.00 0.00 -1.05 0.00 7.50 -1.93 -3.37 115.11 116.26 2pq8 h GLN 430 Ca 0.00 0.00 -0.40 0.00 0.50 0.00 0.00 58.65 58.75 2pq8 h GLN 430 Cb 0.34 0.00 -0.40 0.00 0.05 0.00 0.00 27.48 27.47 2pq8 h GLN 430 CO 0.00 0.00 -1.10 0.66 -1.50 0.00 0.00 178.83 176.89 2pq8 n TYR 431 N -2.61 1.60 -1.94 2.96 4.01 -1.21 -5.06 117.16 114.91 2pq8 n TYR 431 Ca 0.03 -2.80 -0.33 0.00 -0.16 0.00 0.00 57.90 54.64 2pq8 n TYR 431 Cb 0.49 -0.32 0.03 0.00 -0.31 0.00 0.00 39.34 39.23 2pq8 n TYR 431 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2pq8 s LYS 432 N -3.25 3.10 0.45 -0.72 1.02 -1.25 -4.66 119.74 114.44 2pq8 s LYS 432 Ca 0.31 1.31 -0.25 0.00 0.02 0.00 0.00 55.97 57.37 2pq8 s LYS 432 Cb 0.44 -2.00 -0.09 0.00 -0.52 0.00 0.00 37.83 35.67 2pq8 s LYS 432 CO -0.01 -1.00 1.30 1.17 -0.92 0.00 0.00 175.35 175.90 2pq8 n LYS 433 N -2.13 1.92 -1.72 1.68 4.81 -1.26 -4.85 118.16 116.61 2pq8 n LYS 433 Ca 0.10 0.69 -0.42 0.00 -0.87 0.00 0.00 58.31 57.80 2pq8 n LYS 433 Cb 0.52 -2.45 -0.01 0.00 0.02 0.00 0.00 35.03 33.11 2pq8 n LYS 433 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2pq8 n PRO 434 N -0.19 2.34 0.26 1.64 -0.02 -1.26 -4.90 135.00 132.87 2pq8 n PRO 434 Ca 0.07 0.83 0.12 0.00 -2.02 0.00 0.00 63.50 62.50 2pq8 n PRO 434 Cb 0.41 -2.49 0.71 0.00 -0.02 0.00 0.00 33.50 32.11 2pq8 n PRO 434 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2pq8 h PRO 435 N 3.37 0.00 -4.55 0.52 0.13 -1.89 -3.39 132.00 126.20 2pq8 h PRO 435 Ca -0.47 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.06 2pq8 h PRO 435 Cb 1.26 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 32.03 2pq8 h PRO 435 CO 0.68 0.12 -0.82 0.42 -0.23 0.00 0.00 178.00 178.18 2pq8 s ILE 436 N -4.18 1.52 0.25 -3.56 1.01 -1.26 -5.09 121.20 109.88 2pq8 s ILE 436 Ca -0.03 -0.76 0.10 0.00 0.00 0.00 0.00 60.65 59.97 2pq8 s ILE 436 Cb 0.13 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 41.03 2pq8 s ILE 436 CO 0.59 0.30 -0.09 0.42 0.00 0.00 0.00 174.94 176.16 2pq8 s THR 437 N 1.48 3.06 -0.17 2.92 -4.23 -1.26 -4.20 115.64 113.23 2pq8 s THR 437 Ca 0.02 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.24 2pq8 s THR 437 Cb -0.14 -2.60 -0.01 0.00 1.34 0.00 0.00 72.50 71.08 2pq8 s THR 437 CO -0.09 -0.33 0.85 -0.69 -0.54 0.00 0.00 174.62 173.82 2pq8 s VAL 438 N -2.26 4.86 -0.40 2.29 1.01 -1.26 -5.03 120.40 119.60 2pq8 s VAL 438 Ca 0.30 1.67 -0.16 0.00 0.00 0.00 0.00 61.98 63.79 2pq8 s VAL 438 Cb -0.06 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.18 2pq8 s VAL 438 CO 0.17 0.01 0.36 -0.62 0.00 0.00 0.00 175.10 175.02 2pq8 s ASP 439 N 1.17 6.15 0.53 3.32 -1.08 -1.26 -4.98 116.67 120.52 2pq8 s ASP 439 Ca 0.39 -0.70 0.27 0.00 -0.52 0.00 0.00 52.55 51.98 2pq8 s ASP 439 Cb -0.16 -2.19 1.42 0.00 -1.46 0.00 0.00 42.92 40.53 2pq8 s ASP 439 CO 0.12 -0.48 1.97 0.28 0.52 0.00 0.00 175.17 177.58 2pq8 h SER 440 N 8.64 0.00 -0.25 -0.34 0.02 -1.96 -0.56 113.55 119.11 2pq8 h SER 440 Ca -0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2pq8 h SER 440 Cb 1.12 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2pq8 h SER 440 CO 0.75 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.77 2pq8 n VAL 441 N -4.35 0.64 -0.00 2.27 0.24 -1.26 -3.00 118.33 112.87 2pq8 n VAL 441 Ca 0.12 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2pq8 n VAL 441 Cb 0.70 -0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 2pq8 n VAL 441 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pq8 s LEU 443 N -0.76 3.61 -0.47 0.00 2.96 -1.16 -2.81 118.68 120.04 2pq8 s LEU 443 Ca 0.00 0.10 0.02 0.00 -0.22 0.00 0.00 54.13 54.04 2pq8 s LEU 443 Cb 0.00 -1.85 0.12 0.00 0.50 0.00 0.00 46.19 44.96 2pq8 s LEU 443 CO 0.00 0.31 0.22 -0.75 -1.32 0.00 0.00 176.35 174.81 2pq8 s LYS 444 N -0.46 1.92 -0.25 1.98 2.20 0.75 -5.00 119.74 120.88 2pq8 s LYS 444 Ca 0.09 -2.29 -0.16 0.00 -0.36 0.00 0.00 55.97 53.24 2pq8 s LYS 444 Cb -0.12 -3.38 0.07 0.00 -1.51 0.00 0.00 37.83 32.89 2pq8 s LYS 444 CO 0.02 -1.06 0.63 -0.46 -0.36 0.00 0.00 175.35 174.12 2pq8 s TRP 445 N 0.27 -0.91 0.06 4.03 -0.00 -1.26 -4.71 118.94 116.42 2pq8 s TRP 445 Ca 0.14 1.90 0.05 0.00 -0.00 0.00 0.00 56.10 58.19 2pq8 s TRP 445 Cb -0.23 0.48 -0.03 0.00 -0.00 0.00 0.00 33.47 33.70 2pq8 s TRP 445 CO -0.03 -0.45 -0.14 0.00 -0.00 0.00 0.00 176.95 176.32 2pq8 s ALA 446 N 1.31 1.15 -1.23 5.86 0.00 -1.26 -5.07 121.76 122.52 2pq8 s ALA 446 Ca -0.08 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.95 2pq8 s ALA 446 Cb -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2pq8 s ALA 446 CO -0.14 0.18 0.31 -2.30 0.00 0.00 0.00 175.76 173.81