#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r58 s PHE 175 N 0.00 3.45 -1.21 0.00 2.19 -1.26 -4.94 117.98 116.20 2r58 s PHE 175 Ca 0.00 1.41 -0.20 0.00 0.33 0.00 0.00 56.93 58.47 2r58 s PHE 175 Cb 0.00 -3.32 0.06 0.00 -1.31 0.00 0.00 43.02 38.44 2r58 s PHE 175 CO 0.00 -0.87 1.67 0.34 1.83 0.00 0.00 175.22 178.18 2r58 s ASP 176 N 1.14 6.66 0.23 6.13 -1.08 -1.26 -4.80 116.67 123.68 2r58 s ASP 176 Ca 0.56 -2.12 -0.08 0.00 -0.52 0.00 0.00 52.55 50.39 2r58 s ASP 176 Cb -0.25 -2.58 0.22 0.00 -1.46 0.00 0.00 42.92 38.85 2r58 s ASP 176 CO 0.27 -1.36 1.90 -0.50 0.52 0.00 0.00 175.17 176.00 2r58 h TRP 177 N 8.32 1.10 -0.64 -5.34 4.06 -1.99 -1.87 115.95 119.60 2r58 h TRP 177 Ca 0.37 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 61.31 2r58 h TRP 177 Cb 0.91 -0.37 -0.03 0.00 -1.00 0.00 0.00 29.16 28.68 2r58 h TRP 177 CO 1.38 0.68 0.26 -0.44 -3.56 0.00 0.00 178.44 176.76 2r58 h ASP 178 N 1.17 0.87 -0.32 -3.49 3.32 -1.99 0.21 116.42 116.19 2r58 h ASP 178 Ca 0.33 -0.16 -0.14 0.00 0.02 0.00 0.00 57.03 57.08 2r58 h ASP 178 Cb -0.11 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 2r58 h ASP 178 CO -0.08 0.80 -0.30 0.00 -1.72 0.00 0.00 179.24 177.93 2r58 h ALA 179 N 1.11 0.73 -0.30 3.45 0.00 -1.96 -2.68 119.26 119.62 2r58 h ALA 179 Ca 0.21 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2r58 h ALA 179 Cb 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2r58 h ALA 179 CO -0.02 0.66 0.05 -0.92 0.00 0.00 0.00 179.25 179.02 2r58 h TYR 180 N 0.71 0.53 -0.27 0.00 3.20 -0.75 -2.11 116.97 118.28 2r58 h TYR 180 Ca 0.08 -0.07 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 2r58 h TYR 180 Cb 0.86 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 2r58 h TYR 180 CO 0.05 0.59 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.94 2r58 h LEU 181 N 0.32 0.44 -0.54 2.82 3.38 -0.65 -2.05 115.31 119.04 2r58 h LEU 181 Ca 0.09 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2r58 h LEU 181 Cb 0.34 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2r58 h LEU 181 CO 0.01 0.61 -0.23 -0.08 0.09 0.00 0.00 178.44 178.83 2r58 h GLU 182 N 0.42 0.94 0.00 1.13 4.81 -1.36 0.78 114.58 121.28 2r58 h GLU 182 Ca 0.08 -0.40 -0.08 0.00 -0.13 0.00 0.00 59.36 58.82 2r58 h GLU 182 Cb 0.50 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 2r58 h GLU 182 CO 0.03 1.06 -0.47 1.05 -0.73 0.00 0.00 179.01 179.96 2r58 h GLU 183 N 0.81 0.00 -0.16 1.92 4.11 -1.12 -3.00 114.58 117.14 2r58 h GLU 183 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 2r58 h GLU 183 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2r58 h GLU 183 CO 0.07 0.37 0.00 0.25 0.07 0.00 0.00 179.01 179.76 2r58 n THR 184 N -3.16 0.18 -3.89 -1.06 -2.24 -0.79 -4.96 114.28 98.35 2r58 n THR 184 Ca 0.02 -0.50 -0.25 0.00 -2.27 0.00 0.00 64.05 61.05 2r58 n THR 184 Cb 0.69 0.96 -0.00 0.00 -2.10 0.00 0.00 70.33 69.88 2r58 n THR 184 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2r58 n GLY 185 N 1.32 -0.28 3.40 3.38 0.00 -0.93 -4.98 105.19 107.10 2r58 n GLY 185 Ca 0.17 0.14 -0.21 0.00 0.00 0.00 0.00 46.02 46.13 2r58 n GLY 185 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r58 s SER 186 N -4.19 2.95 0.04 1.61 0.01 0.22 -5.04 113.70 109.31 2r58 s SER 186 Ca 0.12 -1.05 0.03 0.00 1.31 0.00 0.00 55.95 56.36 2r58 s SER 186 Cb -0.06 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 2r58 s SER 186 CO 0.86 -0.13 0.01 -1.61 0.41 0.00 0.00 173.24 172.78 2r58 s GLU 187 N -3.61 2.71 0.26 12.44 2.02 -1.26 -4.58 118.70 126.68 2r58 s GLU 187 Ca 0.26 -0.70 -0.19 0.00 0.02 0.00 0.00 54.97 54.36 2r58 s GLU 187 Cb -0.01 -2.63 -0.09 0.00 0.10 0.00 0.00 34.13 31.50 2r58 s GLU 187 CO 0.10 0.59 0.76 0.00 0.02 0.00 0.00 175.26 176.73 2r58 s ALA 188 N -1.20 3.36 0.19 5.21 0.00 -1.26 -0.92 121.76 127.14 2r58 s ALA 188 Ca 0.23 0.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.06 2r58 s ALA 188 Cb -0.12 -2.86 -0.10 0.00 0.00 0.00 0.00 23.12 20.05 2r58 s ALA 188 CO 0.14 0.31 1.55 0.00 0.00 0.00 0.00 175.76 177.76 2r58 s ALA 189 N -1.67 3.76 0.66 0.00 0.00 0.28 -4.75 121.76 120.05 2r58 s ALA 189 Ca 0.47 1.39 -0.17 0.00 0.00 0.00 0.00 51.96 53.65 2r58 s ALA 189 Cb -0.15 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 19.35 2r58 s ALA 189 CO 0.20 -0.80 1.27 -2.14 0.00 0.00 0.00 175.76 174.29 2r58 s PRO 190 N 0.72 2.48 0.53 0.00 0.02 -1.26 -4.59 135.00 132.90 2r58 s PRO 190 Ca 0.68 1.97 0.28 0.00 0.02 0.00 0.00 61.00 63.95 2r58 s PRO 190 Cb -0.44 -1.85 1.43 0.00 0.02 0.00 0.00 34.50 33.66 2r58 s PRO 190 CO 0.35 -1.63 1.95 0.00 -0.33 0.00 0.00 177.00 177.34 2r58 h ALA 191 N 0.36 2.63 0.00 -1.55 0.00 -1.97 -1.73 119.26 117.00 2r58 h ALA 191 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2r58 h ALA 191 Cb 1.32 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2r58 h ALA 191 CO 0.52 -0.83 0.00 1.57 0.00 0.00 0.00 179.25 180.51 2r58 h LYS 192 N 0.01 0.00 0.00 0.00 2.10 -1.98 -2.52 116.57 114.18 2r58 h LYS 192 Ca 0.32 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.94 2r58 h LYS 192 Cb 1.29 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.62 2r58 h LYS 192 CO -0.01 0.00 -0.14 0.00 -2.00 0.00 0.00 179.45 177.31 2r58 s PHE 194 N -3.69 3.40 -1.35 0.00 0.08 -0.95 -4.76 117.98 110.70 2r58 s PHE 194 Ca 0.01 0.37 -0.15 0.00 0.12 0.00 0.00 56.93 57.27 2r58 s PHE 194 Cb 0.10 -1.87 0.07 0.00 -0.57 0.00 0.00 43.02 40.75 2r58 s PHE 194 CO 0.60 0.61 1.92 1.17 -0.10 0.00 0.00 175.22 179.41 2r58 n LYS 195 N 2.08 3.11 -3.93 0.44 4.81 -1.26 -4.62 118.16 118.79 2r58 n LYS 195 Ca -0.19 -3.08 -0.10 0.00 -0.87 0.00 0.00 58.31 54.07 2r58 n LYS 195 Cb 0.54 -3.34 -0.10 0.00 0.02 0.00 0.00 35.03 32.16 2r58 n LYS 195 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2r58 s GLN 196 N 3.32 0.52 0.63 1.64 -1.52 -1.26 -4.72 119.66 118.28 2r58 s GLN 196 Ca 0.49 -0.66 -0.17 0.00 -1.95 0.00 0.00 55.36 53.08 2r58 s GLN 196 Cb 0.08 0.21 -0.01 0.00 -0.22 0.00 0.00 33.01 33.06 2r58 s GLN 196 CO 0.00 -0.12 1.14 0.00 -0.25 0.00 0.00 175.29 176.06 2r58 s ALA 197 N -2.18 2.49 0.23 6.09 0.00 -1.26 -4.80 121.76 122.33 2r58 s ALA 197 Ca -0.09 0.73 -0.07 0.00 0.00 0.00 0.00 51.96 52.53 2r58 s ALA 197 Cb -0.04 -3.37 0.27 0.00 0.00 0.00 0.00 23.12 19.98 2r58 s ALA 197 CO -0.03 -1.21 1.86 1.96 0.00 0.00 0.00 175.76 178.34 2r58 h GLN 198 N 0.40 0.96 -6.24 0.00 4.20 -1.98 -3.40 115.11 109.06 2r58 h GLN 198 Ca -0.48 -0.06 -0.69 0.00 0.06 0.00 0.00 58.65 57.48 2r58 h GLN 198 Cb 1.26 -0.22 -0.23 0.00 0.30 0.00 0.00 27.48 28.59 2r58 h GLN 198 CO 0.54 0.64 -0.76 -0.80 -0.67 0.00 0.00 178.83 177.78 2r58 s ASN 199 N -5.82 4.07 0.25 1.46 0.01 -1.26 -5.09 114.94 108.55 2r58 s ASN 199 Ca -0.13 -0.19 -0.31 0.00 -0.71 0.00 0.00 52.86 51.52 2r58 s ASN 199 Cb 0.17 -0.92 -0.12 0.00 0.41 0.00 0.00 41.25 40.79 2r58 s ASN 199 CO 0.79 0.33 1.65 -2.65 -1.51 0.00 0.00 177.10 175.71 2r58 n PRO 200 N 2.39 2.69 -2.22 -0.60 -0.02 -1.26 -4.91 135.00 131.06 2r58 n PRO 200 Ca -0.17 0.96 -0.39 0.00 -2.02 0.00 0.00 63.50 61.88 2r58 n PRO 200 Cb 0.52 -2.77 -0.02 0.00 -0.02 0.00 0.00 33.50 31.21 2r58 n PRO 200 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2r58 s PRO 201 N 0.34 4.20 0.28 0.52 0.04 -1.26 -4.96 135.00 134.16 2r58 s PRO 201 Ca 0.70 2.00 -0.30 0.00 0.04 0.00 0.00 61.00 63.44 2r58 s PRO 201 Cb -0.51 -2.87 -0.11 0.00 0.04 0.00 0.00 34.50 31.05 2r58 s PRO 201 CO 0.41 -0.24 1.48 -0.80 0.04 0.00 0.00 177.00 177.88 2r58 s ASN 202 N -0.84 6.55 -0.40 6.66 0.02 -1.26 -4.62 114.94 121.05 2r58 s ASN 202 Ca 0.53 2.79 -0.09 0.00 -1.02 0.00 0.00 52.86 55.07 2r58 s ASN 202 Cb -0.35 -2.63 0.06 0.00 0.02 0.00 0.00 41.25 38.35 2r58 s ASN 202 CO 0.45 -0.77 0.23 0.21 0.02 0.00 0.00 177.10 177.24 2r58 s ASN 203 N 0.31 5.62 -0.02 -1.22 3.84 -1.26 -4.91 114.94 117.29 2r58 s ASN 203 Ca 0.59 -1.37 0.14 0.00 0.21 0.00 0.00 52.86 52.43 2r58 s ASN 203 Cb -0.44 -1.98 0.42 0.00 -0.55 0.00 0.00 41.25 38.70 2r58 s ASN 203 CO 0.47 -0.48 1.35 0.47 -2.79 0.00 0.00 177.10 176.11 2r58 n ASP 204 N 4.92 3.32 -4.79 -4.21 8.00 -1.26 -5.00 116.55 117.53 2r58 n ASP 204 Ca -0.11 -2.11 -0.34 0.00 0.71 0.00 0.00 54.79 52.94 2r58 n ASP 204 Cb 0.44 -0.33 -0.01 0.00 -0.02 0.00 0.00 41.12 41.20 2r58 n ASP 204 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2r58 s PHE 205 N -1.21 2.83 0.12 1.24 0.40 -1.26 -5.06 117.98 115.05 2r58 s PHE 205 Ca 0.31 1.55 0.10 0.00 -0.60 0.00 0.00 56.93 58.30 2r58 s PHE 205 Cb 0.18 -3.16 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 2r58 s PHE 205 CO 0.19 -1.23 -0.24 0.15 0.70 0.00 0.00 175.22 174.79 2r58 s LYS 206 N -3.39 1.30 0.18 0.44 -0.14 -1.26 -5.02 119.74 111.84 2r58 s LYS 206 Ca 0.69 -1.29 -0.32 0.00 -1.36 0.00 0.00 55.97 53.70 2r58 s LYS 206 Cb -0.20 -1.68 -0.11 0.00 -1.68 0.00 0.00 37.83 34.17 2r58 s LYS 206 CO 0.26 0.39 1.61 0.42 -0.76 0.00 0.00 175.35 177.27 2r58 s ILE 207 N -1.17 2.45 0.00 2.17 1.01 -1.26 -2.10 121.20 122.30 2r58 s ILE 207 Ca 0.12 0.32 0.00 0.00 0.00 0.00 0.00 60.65 61.09 2r58 s ILE 207 Cb -0.10 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.17 2r58 s ILE 207 CO 0.06 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.63 2r58 n GLY 208 N 3.77 2.87 3.75 6.18 0.00 0.48 -5.00 105.19 117.24 2r58 n GLY 208 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2r58 n GLY 208 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2r58 s MET 209 N -0.53 4.23 0.04 1.61 -1.94 -0.89 -4.57 119.30 117.24 2r58 s MET 209 Ca 0.00 2.38 -0.01 0.00 -1.71 0.00 0.00 55.69 56.35 2r58 s MET 209 Cb 0.00 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.73 2r58 s MET 209 CO 0.00 -0.45 0.18 0.15 -0.01 0.00 0.00 175.02 174.89 2r58 s LYS 210 N -0.75 3.36 0.27 2.03 1.02 0.99 -0.95 119.74 125.70 2r58 s LYS 210 Ca 0.58 -0.43 -0.04 0.00 0.02 0.00 0.00 55.97 56.10 2r58 s LYS 210 Cb -0.43 -3.01 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2r58 s LYS 210 CO 0.47 0.63 0.43 1.47 -0.92 0.00 0.00 175.35 177.43 2r58 n LEU 211 N 0.57 0.00 -4.59 3.17 -0.00 0.10 -1.63 117.00 114.63 2r58 n LEU 211 Ca -0.08 -2.01 -0.34 0.00 -0.00 0.00 0.00 56.01 53.58 2r58 n LEU 211 Cb 0.52 2.15 -0.11 0.00 -0.00 0.00 0.00 43.42 45.98 2r58 n LEU 211 CO 0.48 -0.52 -0.32 -1.61 -0.00 0.00 0.00 177.39 175.41 2r58 s GLU 212 N -2.42 3.39 0.00 1.47 2.02 0.19 -0.87 118.70 122.49 2r58 s GLU 212 Ca 0.18 -0.46 -0.03 0.00 0.02 0.00 0.00 54.97 54.69 2r58 s GLU 212 Cb -0.02 -2.89 -0.01 0.00 0.10 0.00 0.00 34.13 31.32 2r58 s GLU 212 CO 0.13 0.45 0.04 0.00 0.02 0.00 0.00 175.26 175.90 2r58 s ALA 213 N -0.19 -0.08 0.15 5.21 0.00 0.03 -0.67 121.76 126.22 2r58 s ALA 213 Ca 0.04 -0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.44 2r58 s ALA 213 Cb -0.13 0.07 -0.09 0.00 0.00 0.00 0.00 23.12 22.97 2r58 s ALA 213 CO 0.02 -0.13 1.45 -0.51 0.00 0.00 0.00 175.76 176.59 2r58 s LEU 214 N -1.01 4.38 -0.13 0.00 1.43 -0.83 -0.49 118.68 122.02 2r58 s LEU 214 Ca -0.11 2.47 -0.29 0.00 -1.03 0.00 0.00 54.13 55.17 2r58 s LEU 214 Cb -0.07 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.51 2r58 s LEU 214 CO -0.00 -0.71 1.72 -0.62 0.23 0.00 0.00 176.35 176.97 2r58 s ASP 215 N 0.98 6.41 0.52 2.29 -1.08 -0.40 -4.90 116.67 120.49 2r58 s ASP 215 Ca 0.65 1.98 0.17 0.00 -0.52 0.00 0.00 52.55 54.83 2r58 s ASP 215 Cb -0.40 -2.53 1.30 0.00 -1.46 0.00 0.00 42.92 39.83 2r58 s ASP 215 CO 0.33 -1.17 2.14 -0.65 0.52 0.00 0.00 175.17 176.33 2r58 h PRO 216 N 10.65 0.00 0.00 4.34 0.11 -1.92 -1.12 132.00 144.05 2r58 h PRO 216 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2r58 h PRO 216 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2r58 h PRO 216 CO 0.97 0.02 -0.13 0.54 -0.21 0.00 0.00 178.00 179.20 2r58 n ARG 217 N -4.43 0.04 -3.24 1.05 1.74 -1.26 -4.44 116.66 106.12 2r58 n ARG 217 Ca -0.03 0.03 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 2r58 n ARG 217 Cb 0.11 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 2r58 n ARG 217 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2r58 s ASN 218 N -3.24 -0.75 0.00 0.55 2.47 -0.50 -4.97 114.94 108.50 2r58 s ASN 218 Ca 0.13 -0.62 0.14 0.00 0.42 0.00 0.00 52.86 52.93 2r58 s ASN 218 Cb 0.18 1.59 0.75 0.00 -1.45 0.00 0.00 41.25 42.31 2r58 s ASN 218 CO 0.58 -0.25 1.33 1.33 -3.72 0.00 0.00 177.10 176.37 2r58 n VAL 219 N 4.79 0.40 0.20 -5.21 0.24 -0.74 -1.22 118.33 116.79 2r58 n VAL 219 Ca 0.08 0.10 0.09 0.00 -2.04 0.00 0.00 64.34 62.57 2r58 n VAL 219 Cb 0.53 -0.88 0.22 0.00 -1.47 0.00 0.00 33.84 32.24 2r58 n VAL 219 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2r58 h THR 220 N 0.00 0.41 -3.27 3.34 1.35 -1.97 -3.45 112.91 109.32 2r58 h THR 220 Ca 0.00 -1.40 -0.58 0.00 -0.55 0.00 0.00 66.41 63.88 2r58 h THR 220 Cb 0.08 2.06 -0.07 0.00 -1.73 0.00 0.00 68.15 68.49 2r58 h THR 220 CO 0.00 0.21 -0.15 -0.44 -0.25 0.00 0.00 175.52 174.90 2r58 s SER 221 N -6.24 6.72 -0.20 5.36 0.01 -0.36 -5.03 113.70 113.97 2r58 s SER 221 Ca 0.04 0.86 -0.14 0.00 1.31 0.00 0.00 55.95 58.03 2r58 s SER 221 Cb 0.07 -2.28 -0.04 0.00 0.21 0.00 0.00 66.02 63.98 2r58 s SER 221 CO 0.68 0.08 0.29 -0.89 0.41 0.00 0.00 173.24 173.81 2r58 s THR 222 N 0.23 5.28 0.20 1.44 2.01 -1.26 -1.27 115.64 122.26 2r58 s THR 222 Ca 0.26 0.51 0.07 0.00 0.31 0.00 0.00 61.69 62.83 2r58 s THR 222 Cb -0.16 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 2r58 s THR 222 CO 0.11 0.33 -0.12 0.00 -0.69 0.00 0.00 174.62 174.26 2r58 s ILE 224 N -3.10 4.54 0.11 0.00 -1.09 -1.26 -0.79 121.20 119.61 2r58 s ILE 224 Ca 0.22 1.82 0.08 0.00 -2.23 0.00 0.00 60.65 60.55 2r58 s ILE 224 Cb 0.01 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.68 2r58 s ILE 224 CO 0.06 0.09 -0.21 0.00 -1.23 0.00 0.00 174.94 173.65 2r58 s ALA 225 N 1.46 1.83 -0.04 9.38 0.00 -0.05 -1.96 121.76 132.39 2r58 s ALA 225 Ca 0.54 -1.27 0.05 0.00 0.00 0.00 0.00 51.96 51.27 2r58 s ALA 225 Cb -0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 2r58 s ALA 225 CO 0.25 0.36 -0.17 0.99 0.00 0.00 0.00 175.76 177.18 2r58 s THR 226 N -1.22 2.79 -0.28 0.00 2.01 -0.16 -0.72 115.64 118.06 2r58 s THR 226 Ca 0.07 -0.83 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 2r58 s THR 226 Cb -0.10 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.33 2r58 s THR 226 CO 0.04 0.59 1.61 -0.69 -0.69 0.00 0.00 174.62 175.48 2r58 s VAL 227 N -0.70 3.70 -1.40 3.82 1.01 -0.12 -1.79 120.40 124.92 2r58 s VAL 227 Ca 0.11 0.77 0.15 0.00 0.00 0.00 0.00 61.98 63.01 2r58 s VAL 227 Cb -0.10 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2r58 s VAL 227 CO 0.00 -0.40 0.82 1.33 0.00 0.00 0.00 175.10 176.86 2r58 n VAL 228 N 6.73 0.00 -3.52 2.92 0.24 0.15 -0.39 118.33 124.46 2r58 n VAL 228 Ca 0.19 -0.34 -0.09 0.00 -2.04 0.00 0.00 64.34 62.06 2r58 n VAL 228 Cb 0.46 1.18 -0.03 0.00 -1.47 0.00 0.00 33.84 33.98 2r58 n VAL 228 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2r58 s GLY 229 N -1.82 -0.42 -0.01 7.63 0.00 -1.10 -4.96 107.32 106.63 2r58 s GLY 229 Ca 0.13 1.24 0.02 0.00 0.00 0.00 0.00 44.72 46.10 2r58 s GLY 229 CO 0.38 0.49 -0.06 0.14 0.00 0.00 0.00 173.10 174.05 2r58 s VAL 230 N -2.67 0.52 -0.20 1.40 1.01 -1.26 -0.47 120.40 118.73 2r58 s VAL 230 Ca 0.04 -0.26 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 2r58 s VAL 230 Cb -0.01 -0.46 0.10 0.00 0.00 0.00 0.00 36.38 36.02 2r58 s VAL 230 CO -0.06 0.16 0.38 -0.22 0.00 0.00 0.00 175.10 175.35 2r58 s LEU 231 N 0.00 -0.57 0.00 3.92 2.96 -0.59 -4.96 118.68 119.43 2r58 s LEU 231 Ca 0.00 0.65 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 2r58 s LEU 231 Cb -0.04 1.15 0.00 0.00 0.50 0.00 0.00 46.19 47.80 2r58 s LEU 231 CO -0.00 -0.26 0.00 0.61 -1.32 0.00 0.00 176.35 175.38 2r58 n GLY 232 N 5.37 3.35 0.91 7.98 0.00 -1.24 -0.71 105.19 120.85 2r58 n GLY 232 Ca -0.06 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 45.92 2r58 n GLY 232 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2r58 n SER 233 N 3.94 2.57 -4.65 1.61 7.64 -1.26 -4.66 113.62 118.82 2r58 n SER 233 Ca 0.00 -2.24 -0.25 0.00 1.01 0.00 0.00 58.87 57.40 2r58 n SER 233 Cb 0.00 -0.43 -0.07 0.00 -1.01 0.00 0.00 64.21 62.70 2r58 n SER 233 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2r58 s ARG 234 N -1.69 2.35 -0.08 1.43 0.52 0.11 -1.66 118.95 119.93 2r58 s ARG 234 Ca 0.24 -1.26 0.05 0.00 -0.52 0.00 0.00 55.73 54.24 2r58 s ARG 234 Cb 0.16 -2.26 -0.01 0.00 0.52 0.00 0.00 34.95 33.36 2r58 s ARG 234 CO 0.11 0.41 -0.23 -0.51 0.02 0.00 0.00 175.30 175.09 2r58 s LEU 235 N -3.32 2.16 -0.20 2.53 1.43 0.77 -1.55 118.68 120.51 2r58 s LEU 235 Ca 0.29 -0.50 -0.19 0.00 -1.03 0.00 0.00 54.13 52.70 2r58 s LEU 235 Cb -0.08 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 44.70 2r58 s LEU 235 CO 0.19 0.22 0.55 -0.60 0.23 0.00 0.00 176.35 176.93 2r58 s ARG 236 N 0.01 4.19 0.07 1.70 3.52 0.38 -1.41 118.95 127.41 2r58 s ARG 236 Ca -0.08 0.46 0.09 0.00 -0.13 0.00 0.00 55.73 56.07 2r58 s ARG 236 Cb -0.15 -3.57 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 2r58 s ARG 236 CO 0.05 -0.18 -0.24 -0.51 -0.81 0.00 0.00 175.30 173.61 2r58 s LEU 237 N 1.74 2.31 -0.02 -0.88 1.43 0.16 -0.67 118.68 122.75 2r58 s LEU 237 Ca 0.25 -0.59 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 2r58 s LEU 237 Cb -0.16 -1.33 0.01 0.00 0.03 0.00 0.00 46.19 44.74 2r58 s LEU 237 CO 0.10 0.24 -0.04 -0.60 0.23 0.00 0.00 176.35 176.27 2r58 s ARG 238 N -1.49 0.55 -0.12 1.70 3.52 -0.74 -1.18 118.95 121.19 2r58 s ARG 238 Ca 0.13 -0.12 -0.29 0.00 -0.13 0.00 0.00 55.73 55.32 2r58 s ARG 238 Cb -0.10 -0.58 -0.01 0.00 -1.56 0.00 0.00 34.95 32.70 2r58 s ARG 238 CO 0.04 0.00 1.04 -0.51 -0.81 0.00 0.00 175.30 175.06 2r58 s LEU 239 N 0.44 4.23 0.23 -0.88 1.43 -1.26 -0.99 118.68 121.88 2r58 s LEU 239 Ca -0.05 1.55 -0.31 0.00 -1.03 0.00 0.00 54.13 54.28 2r58 s LEU 239 Cb -0.09 -3.55 -0.14 0.00 0.03 0.00 0.00 46.19 42.44 2r58 s LEU 239 CO -0.00 -0.50 1.32 0.47 0.23 0.00 0.00 176.35 177.87 2r58 n ASP 240 N 5.25 2.31 0.00 2.29 9.92 -0.83 -1.87 116.55 133.62 2r58 n ASP 240 Ca 0.10 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.50 2r58 n ASP 240 Cb 0.48 -1.37 0.00 0.00 -0.64 0.00 0.00 41.12 39.59 2r58 n ASP 240 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2r58 n GLY 241 N 2.03 0.52 0.00 0.44 0.00 -1.26 -4.71 105.19 102.21 2r58 n GLY 241 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2r58 n GLY 241 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2r58 n SER 242 N -0.01 0.00 -3.96 1.61 3.41 -0.78 -0.47 113.62 113.42 2r58 n SER 242 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 2r58 n SER 242 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2r58 n SER 242 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2r58 s ASP 243 N -0.41 0.71 0.00 4.04 -4.77 -1.26 -4.57 116.67 110.40 2r58 s ASP 243 Ca 0.00 -1.50 0.19 0.00 -3.30 0.00 0.00 52.55 47.94 2r58 s ASP 243 Cb 0.00 0.42 0.53 0.00 -1.09 0.00 0.00 42.92 42.78 2r58 s ASP 243 CO 0.00 -0.90 1.43 -1.54 0.70 0.00 0.00 175.17 174.86 2r58 n SER 244 N -0.68 2.75 -0.81 2.11 3.41 -1.26 -4.32 113.62 114.82 2r58 n SER 244 Ca 0.03 -1.93 0.09 0.00 -0.26 0.00 0.00 58.87 56.81 2r58 n SER 244 Cb 0.65 -0.27 0.11 0.00 -0.26 0.00 0.00 64.21 64.44 2r58 n SER 244 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r58 n GLN 245 N 1.01 1.83 -2.12 4.33 1.13 -1.26 -4.51 117.38 117.79 2r58 n GLN 245 Ca 0.18 -1.77 -0.05 0.00 -1.94 0.00 0.00 57.00 53.42 2r58 n GLN 245 Cb 0.47 -1.38 0.05 0.00 0.11 0.00 0.00 30.24 29.49 2r58 n GLN 245 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2r58 n ASN 246 N 1.09 2.36 -4.75 1.08 3.02 -1.26 -5.09 115.26 111.72 2r58 n ASN 246 Ca 0.13 -2.68 -0.34 0.00 -0.03 0.00 0.00 54.58 51.65 2r58 n ASN 246 Cb 0.48 -0.42 0.07 0.00 -0.61 0.00 0.00 39.78 39.31 2r58 n ASN 246 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2r58 s ASP 247 N -3.35 4.67 0.05 6.41 1.01 -1.26 -4.90 116.67 119.30 2r58 s ASP 247 Ca 0.36 2.19 -0.01 0.00 0.71 0.00 0.00 52.55 55.80 2r58 s ASP 247 Cb 0.36 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.68 2r58 s ASP 247 CO -0.05 -1.93 -0.03 0.72 0.21 0.00 0.00 175.17 174.09 2r58 s PHE 248 N -2.14 0.51 -0.13 4.23 -0.71 -0.32 -4.94 117.98 114.48 2r58 s PHE 248 Ca 0.71 -1.00 0.01 0.00 -1.04 0.00 0.00 56.93 55.61 2r58 s PHE 248 Cb -0.25 -0.37 -0.01 0.00 -1.21 0.00 0.00 43.02 41.18 2r58 s PHE 248 CO 0.43 -0.35 -0.16 -1.58 -1.34 0.00 0.00 175.22 172.22 2r58 s TRP 249 N -3.62 2.74 0.01 3.49 0.52 -1.26 0.35 118.94 121.18 2r58 s TRP 249 Ca 0.05 -0.86 0.04 0.00 0.02 0.00 0.00 56.10 55.34 2r58 s TRP 249 Cb 0.06 -1.83 -0.01 0.00 -1.15 0.00 0.00 33.47 30.54 2r58 s TRP 249 CO -0.09 -0.34 -0.11 1.03 0.02 0.00 0.00 176.95 177.46 2r58 s ARG 250 N 0.49 0.86 0.60 4.98 1.81 -0.50 -4.95 118.95 122.24 2r58 s ARG 250 Ca -0.11 -0.50 -0.17 0.00 -1.72 0.00 0.00 55.73 53.22 2r58 s ARG 250 Cb -0.16 -0.83 -0.03 0.00 -0.45 0.00 0.00 34.95 33.49 2r58 s ARG 250 CO 0.05 0.22 1.14 -0.51 -0.68 0.00 0.00 175.30 175.51 2r58 s LEU 251 N -0.57 3.57 0.32 2.53 1.43 -1.26 -0.16 118.68 124.54 2r58 s LEU 251 Ca 0.03 2.14 0.24 0.00 -1.03 0.00 0.00 54.13 55.51 2r58 s LEU 251 Cb -0.05 -4.57 1.13 0.00 0.03 0.00 0.00 46.19 42.72 2r58 s LEU 251 CO 0.00 -1.48 1.74 -0.37 0.23 0.00 0.00 176.35 176.47 2r58 h VAL 252 N 0.62 0.00 -0.48 -1.59 -1.51 -1.67 -0.69 116.25 110.93 2r58 h VAL 252 Ca -0.49 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2r58 h VAL 252 Cb 1.26 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 2r58 h VAL 252 CO 0.55 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 175.99 2r58 n ASP 253 N -2.34 4.31 -4.76 4.19 3.85 -1.26 -1.64 116.55 118.90 2r58 n ASP 253 Ca 0.01 -2.57 -0.41 0.00 -0.71 0.00 0.00 54.79 51.10 2r58 n ASP 253 Cb 0.17 -0.52 -0.02 0.00 -1.35 0.00 0.00 41.12 39.40 2r58 n ASP 253 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 2r58 s SER 254 N -1.19 6.54 0.00 -1.12 0.15 -0.27 -4.32 113.70 113.49 2r58 s SER 254 Ca 0.44 2.82 0.29 0.00 0.70 0.00 0.00 55.95 60.20 2r58 s SER 254 Cb 0.30 -2.64 1.71 0.00 -1.71 0.00 0.00 66.02 63.68 2r58 s SER 254 CO 0.18 -0.75 2.08 0.35 1.20 0.00 0.00 173.24 176.30 2r58 n THR 255 N 1.52 0.00 0.54 6.45 -2.24 -1.26 -3.53 114.28 115.76 2r58 n THR 255 Ca 0.04 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 2r58 n THR 255 Cb 0.40 -0.48 0.23 0.00 -2.10 0.00 0.00 70.33 68.38 2r58 n THR 255 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2r58 n GLU 256 N -0.96 2.36 -4.63 -0.78 1.02 -1.26 -4.90 120.64 111.49 2r58 n GLU 256 Ca 0.22 -2.05 -0.24 0.00 -0.02 0.00 0.00 57.16 55.07 2r58 n GLU 256 Cb 0.10 -1.49 -0.14 0.00 -0.02 0.00 0.00 31.44 29.88 2r58 n GLU 256 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2r58 s ILE 257 N -1.60 1.38 0.16 -3.67 -4.36 -1.23 -1.97 121.20 109.91 2r58 s ILE 257 Ca 0.37 -0.95 -0.11 0.00 -0.26 0.00 0.00 60.65 59.70 2r58 s ILE 257 Cb 0.22 -1.19 0.00 0.00 1.25 0.00 0.00 42.46 42.73 2r58 s ILE 257 CO 0.31 0.22 0.32 -1.00 0.24 0.00 0.00 174.94 175.03 2r58 s HIS 258 N -0.65 0.26 0.58 1.37 3.76 0.15 -4.93 115.29 115.83 2r58 s HIS 258 Ca 0.06 -0.63 -0.19 0.00 -0.15 0.00 0.00 55.06 54.15 2r58 s HIS 258 Cb -0.08 0.04 -0.04 0.00 1.11 0.00 0.00 32.58 33.61 2r58 s HIS 258 CO 0.01 -0.74 1.20 0.00 -0.85 0.00 0.00 174.74 174.36 2r58 s ALA 259 N -3.94 2.60 0.25 -1.40 0.00 -1.26 -0.64 121.76 117.38 2r58 s ALA 259 Ca 0.14 0.99 -0.31 0.00 0.00 0.00 0.00 51.96 52.78 2r58 s ALA 259 Cb 0.03 -3.44 -0.13 0.00 0.00 0.00 0.00 23.12 19.58 2r58 s ALA 259 CO -0.02 -1.08 1.44 -0.89 0.00 0.00 0.00 175.76 175.21 2r58 n ILE 260 N -1.45 0.98 0.00 0.00 5.41 -1.26 -2.00 119.36 121.04 2r58 n ILE 260 Ca 0.13 -0.24 0.00 0.00 1.00 0.00 0.00 62.75 63.63 2r58 n ILE 260 Cb 0.50 -1.57 0.00 0.00 -0.71 0.00 0.00 39.64 37.86 2r58 n ILE 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2r58 n GLY 261 N 2.14 1.99 0.06 7.39 0.00 -1.26 -4.97 105.19 110.54 2r58 n GLY 261 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 2r58 n GLY 261 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2r58 h HIS 262 N 0.00 0.08 -0.18 1.61 6.17 -1.76 -1.81 115.15 119.25 2r58 h HIS 262 Ca 0.00 -0.00 0.05 0.00 0.71 0.00 0.00 60.37 61.13 2r58 h HIS 262 Cb 0.00 -0.03 -0.06 0.00 2.52 0.00 0.00 27.41 29.85 2r58 h HIS 262 CO 0.00 0.09 -0.18 0.00 0.71 0.00 0.00 177.93 178.56 2r58 h GLU 264 N -0.20 -0.10 -1.07 0.00 4.81 -1.65 0.33 114.58 116.71 2r58 h GLU 264 Ca 0.12 0.01 0.29 0.00 -0.13 0.00 0.00 59.36 59.64 2r58 h GLU 264 Cb 0.37 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.69 2r58 h GLU 264 CO -0.30 -0.05 0.71 -0.22 -0.73 0.00 0.00 179.01 178.42 2r58 h LYS 265 N -0.12 0.27 -0.59 1.92 3.64 -1.13 -0.30 116.57 120.26 2r58 h LYS 265 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2r58 h LYS 265 Cb 0.09 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2r58 h LYS 265 CO 0.02 0.18 0.00 0.09 -2.27 0.00 0.00 179.45 177.47 2r58 n ASN 266 N -4.52 3.35 0.00 4.20 4.13 -0.79 -4.91 115.26 116.72 2r58 n ASN 266 Ca 0.25 -2.17 0.00 0.00 1.68 0.00 0.00 54.58 54.35 2r58 n ASN 266 Cb 0.98 -0.44 0.00 0.00 -1.54 0.00 0.00 39.78 38.78 2r58 n ASN 266 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2r58 n GLY 267 N 1.16 0.73 4.00 7.41 0.00 -0.12 -5.06 105.19 113.31 2r58 n GLY 267 Ca 0.19 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2r58 n GLY 267 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r58 s GLY 268 N -2.00 1.90 -0.04 -0.02 0.00 0.06 -4.99 107.32 102.22 2r58 s GLY 268 Ca 0.00 -1.91 0.02 0.00 0.00 0.00 0.00 44.72 42.83 2r58 s GLY 268 CO 0.00 -1.75 -0.08 -0.29 0.00 0.00 0.00 173.10 170.98 2r58 s MET 269 N -4.56 1.10 0.46 2.90 1.75 -1.26 -3.82 119.30 115.87 2r58 s MET 269 Ca 0.54 -0.24 -0.24 0.00 -1.25 0.00 0.00 55.69 54.50 2r58 s MET 269 Cb -0.05 -1.00 -0.07 0.00 2.84 0.00 0.00 34.83 36.54 2r58 s MET 269 CO 0.34 -0.00 1.36 -0.51 -0.65 0.00 0.00 175.02 175.56 2r58 s LEU 270 N 0.66 4.07 0.19 4.11 1.43 -1.26 -4.70 118.68 123.17 2r58 s LEU 270 Ca -0.11 2.77 0.11 0.00 -1.03 0.00 0.00 54.13 55.88 2r58 s LEU 270 Cb -0.13 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.01 2r58 s LEU 270 CO 0.01 -1.17 -0.21 -1.10 0.23 0.00 0.00 176.35 174.11 2r58 s GLN 271 N -2.53 1.65 0.55 1.70 -1.52 -0.08 -5.02 119.66 114.41 2r58 s GLN 271 Ca 0.63 -1.47 -0.21 0.00 -1.95 0.00 0.00 55.36 52.36 2r58 s GLN 271 Cb -0.40 -1.92 -0.05 0.00 -0.22 0.00 0.00 33.01 30.42 2r58 s GLN 271 CO 0.51 0.41 1.29 -1.25 -0.25 0.00 0.00 175.29 175.99 2r58 s PRO 272 N -2.72 3.15 0.65 2.91 0.04 -1.26 -4.46 135.00 133.32 2r58 s PRO 272 Ca 0.22 2.06 -0.16 0.00 0.04 0.00 0.00 61.00 63.16 2r58 s PRO 272 Cb -0.08 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 2r58 s PRO 272 CO 0.11 -1.13 1.13 -1.25 0.04 0.00 0.00 177.00 175.90 2r58 s PRO 273 N -3.00 2.79 0.38 0.56 0.04 -1.26 -4.90 135.00 129.60 2r58 s PRO 273 Ca 0.73 1.47 0.12 0.00 0.04 0.00 0.00 61.00 63.35 2r58 s PRO 273 Cb -0.36 -1.94 0.91 0.00 0.04 0.00 0.00 34.50 33.15 2r58 s PRO 273 CO 0.42 -1.27 1.86 1.25 0.04 0.00 0.00 177.00 179.30 2r58 h LEU 274 N 0.15 0.57 -2.76 -3.56 5.85 -1.94 -1.79 115.31 111.83 2r58 h LEU 274 Ca -0.47 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.23 2r58 h LEU 274 Cb 1.26 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2r58 h LEU 274 CO 0.54 0.27 0.07 0.61 -0.34 0.00 0.00 178.44 179.59 2r58 n GLY 275 N -1.46 2.66 3.63 3.75 0.00 -1.26 -4.98 105.19 107.53 2r58 n GLY 275 Ca 0.18 -0.61 -0.50 0.00 0.00 0.00 0.00 46.02 45.09 2r58 n GLY 275 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2r58 n PHE 276 N 0.24 1.91 1.22 1.61 7.35 -0.68 -4.36 117.46 124.75 2r58 n PHE 276 Ca 0.21 0.44 0.14 0.00 -0.76 0.00 0.00 57.45 57.49 2r58 n PHE 276 Cb 0.93 -2.44 0.60 0.00 0.35 0.00 0.00 39.48 38.92 2r58 n PHE 276 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2r58 s MET 278 N -2.75 2.13 0.56 0.00 -1.94 -1.26 -5.13 119.30 110.90 2r58 s MET 278 Ca 0.21 -2.16 -0.15 0.00 -1.71 0.00 0.00 55.69 51.88 2r58 s MET 278 Cb 0.19 -1.71 -0.06 0.00 2.01 0.00 0.00 34.83 35.26 2r58 s MET 278 CO 0.52 -0.23 1.01 0.54 -0.01 0.00 0.00 175.02 176.86 2r58 s ASN 279 N -3.86 6.28 0.35 3.03 6.03 -1.26 -4.98 114.94 120.53 2r58 s ASN 279 Ca 0.25 1.63 0.04 0.00 -1.03 0.00 0.00 52.86 53.75 2r58 s ASN 279 Cb 0.05 -2.51 0.68 0.00 -3.03 0.00 0.00 41.25 36.43 2r58 s ASN 279 CO 0.14 -0.83 1.99 0.00 -2.03 0.00 0.00 177.10 176.37 2r58 h ALA 280 N 0.56 1.61 0.00 3.54 0.00 -2.01 -0.49 119.26 122.48 2r58 h ALA 280 Ca -0.46 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2r58 h ALA 280 Cb 1.20 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2r58 h ALA 280 CO 0.60 0.32 0.00 -1.13 0.00 0.00 0.00 179.25 179.04 2r58 n SER 281 N -4.46 0.24 -0.49 0.00 3.41 -1.26 -1.01 113.62 110.06 2r58 n SER 281 Ca 0.08 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 2r58 n SER 281 Cb 0.12 -0.62 0.47 0.00 -0.26 0.00 0.00 64.21 63.92 2r58 n SER 281 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2r58 n SER 282 N -1.78 1.49 0.13 4.04 7.64 -0.19 -4.55 113.62 120.40 2r58 n SER 282 Ca 0.02 -1.58 -0.12 0.00 1.01 0.00 0.00 58.87 58.20 2r58 n SER 282 Cb 0.16 -0.05 -0.08 0.00 -1.01 0.00 0.00 64.21 63.23 2r58 n SER 282 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 2r58 h TRP 283 N 2.13 -0.35 -0.75 1.43 2.91 -1.16 -2.68 115.95 117.48 2r58 h TRP 283 Ca 0.00 -0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.12 2r58 h TRP 283 Cb 0.46 0.12 -0.08 0.00 -0.51 0.00 0.00 29.16 29.15 2r58 h TRP 283 CO 0.05 0.00 0.37 -1.35 -1.03 0.00 0.00 178.44 176.49 2r58 h PRO 284 N -0.83 0.59 -0.81 2.65 0.11 -1.80 -0.01 132.00 131.89 2r58 h PRO 284 Ca -0.04 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 2r58 h PRO 284 Cb 0.51 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.46 2r58 h PRO 284 CO 0.06 0.39 0.34 0.78 -0.21 0.00 0.00 178.00 179.37 2r58 h GLY 285 N 0.60 1.29 0.63 -0.55 0.00 -1.87 -3.08 103.07 100.09 2r58 h GLY 285 Ca 0.38 -0.69 0.04 0.00 0.00 0.00 0.00 47.33 47.07 2r58 h GLY 285 CO -0.30 0.65 0.02 -1.82 0.00 0.00 0.00 176.54 175.09 2r58 h TYR 286 N 1.18 0.03 -0.59 5.60 3.20 -0.66 -2.31 116.97 123.41 2r58 h TYR 286 Ca 0.27 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.18 2r58 h TYR 286 Cb 0.19 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 2r58 h TYR 286 CO 0.02 -0.02 0.37 1.25 -1.64 0.00 0.00 178.16 178.14 2r58 h LEU 287 N 0.11 0.62 -0.48 2.82 6.46 -1.30 -1.29 115.31 122.25 2r58 h LEU 287 Ca 0.13 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.94 2r58 h LEU 287 Cb 0.15 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 39.89 2r58 h LEU 287 CO -0.19 0.44 0.20 0.00 -0.62 0.00 0.00 178.44 178.27 2r58 h LYS 289 N 0.40 0.43 0.00 0.00 1.57 -0.79 -2.55 116.57 115.64 2r58 h LYS 289 Ca 0.22 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 2r58 h LYS 289 Cb 0.20 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2r58 h LYS 289 CO -0.20 0.41 -0.54 -0.84 -0.57 0.00 0.00 179.45 177.70 2r58 h ILE 290 N 0.36 1.22 0.00 1.86 3.07 -1.17 -3.11 117.51 119.73 2r58 h ILE 290 Ca 0.10 -1.96 0.00 0.00 1.55 0.00 0.00 64.86 64.55 2r58 h ILE 290 Cb 0.11 2.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.77 2r58 h ILE 290 CO -0.01 0.53 -0.30 0.18 -1.05 0.00 0.00 178.15 177.50 2r58 n LEU 291 N -3.65 0.51 -4.64 0.16 4.77 -0.79 -4.49 117.00 108.87 2r58 n LEU 291 Ca -0.01 0.33 -0.43 0.00 -0.03 0.00 0.00 56.01 55.87 2r58 n LEU 291 Cb 0.60 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2r58 n LEU 291 CO 0.40 -0.03 1.36 0.21 -1.33 0.00 0.00 177.39 178.00 2r58 s ASN 292 N -3.73 6.49 -1.27 -1.43 2.47 -0.97 -2.67 114.94 113.84 2r58 s ASN 292 Ca 0.10 1.83 -0.09 0.00 0.42 0.00 0.00 52.86 55.12 2r58 s ASN 292 Cb 0.15 -2.53 0.07 0.00 -1.45 0.00 0.00 41.25 37.49 2r58 s ASN 292 CO 0.64 -1.13 0.47 -3.20 -3.72 0.00 0.00 177.10 170.16 2r58 n ASN 293 N 7.96 -3.63 -4.77 -4.21 4.05 -1.26 -4.95 115.26 108.45 2r58 n ASN 293 Ca 0.18 -0.38 -0.37 0.00 0.45 0.00 0.00 54.58 54.46 2r58 n ASN 293 Cb 0.44 -3.02 -0.02 0.00 1.23 0.00 0.00 39.78 38.42 2r58 n ASN 293 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2r58 s ALA 294 N -2.91 3.01 -0.27 5.20 0.00 -1.09 -5.00 121.76 120.69 2r58 s ALA 294 Ca 0.39 0.86 -0.29 0.00 0.00 0.00 0.00 51.96 52.92 2r58 s ALA 294 Cb -0.21 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 2r58 s ALA 294 CO 0.48 -0.51 1.34 1.41 0.00 0.00 0.00 175.76 178.48 2r58 s MET 295 N -2.65 3.95 -0.04 0.00 1.75 -1.26 -5.00 119.30 116.04 2r58 s MET 295 Ca 0.62 1.37 0.05 0.00 -1.25 0.00 0.00 55.69 56.47 2r58 s MET 295 Cb -0.26 -3.88 -0.02 0.00 2.84 0.00 0.00 34.83 33.50 2r58 s MET 295 CO 0.32 -1.08 -0.18 0.14 -0.65 0.00 0.00 175.02 173.58 2r58 s VAL 296 N 4.34 2.76 -0.02 10.11 -7.23 -1.26 -0.01 120.40 129.08 2r58 s VAL 296 Ca 0.58 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.61 2r58 s VAL 296 Cb -0.19 -2.05 -0.05 0.00 0.56 0.00 0.00 36.38 34.65 2r58 s VAL 296 CO 0.23 0.59 1.50 0.00 -0.31 0.00 0.00 175.10 177.10 2r58 s ALA 297 N -0.65 3.62 0.51 1.32 0.00 -0.64 -4.79 121.76 121.13 2r58 s ALA 297 Ca 0.10 0.90 -0.20 0.00 0.00 0.00 0.00 51.96 52.76 2r58 s ALA 297 Cb -0.11 -3.66 -0.07 0.00 0.00 0.00 0.00 23.12 19.28 2r58 s ALA 297 CO 0.00 -1.12 1.10 -1.25 0.00 0.00 0.00 175.76 174.50 2r58 s PRO 298 N 3.06 3.55 0.53 0.00 0.04 -1.26 -4.55 135.00 136.37 2r58 s PRO 298 Ca 0.67 1.55 0.18 0.00 0.04 0.00 0.00 61.00 63.45 2r58 s PRO 298 Cb -0.32 -2.09 1.34 0.00 0.04 0.00 0.00 34.50 33.47 2r58 s PRO 298 CO 0.27 -0.68 2.14 1.05 0.04 0.00 0.00 177.00 179.82 2r58 h GLU 299 N 1.43 0.00 0.00 4.56 4.11 -1.97 -2.66 114.58 120.05 2r58 h GLU 299 Ca -0.50 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.92 2r58 h GLU 299 Cb 1.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 2r58 h GLU 299 CO 0.58 0.00 -0.05 1.05 0.07 0.00 0.00 179.01 180.66 2r58 h GLU 300 N 0.00 0.00 -0.01 1.06 9.09 -2.03 -2.83 114.58 119.86 2r58 h GLU 300 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 2r58 h GLU 300 Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 2r58 h GLU 300 CO -0.00 0.05 -0.21 0.44 0.05 0.00 0.00 179.01 179.33 2r58 n ILE 301 N -3.21 0.00 -2.60 -1.06 -5.35 -1.00 -4.80 119.36 101.34 2r58 n ILE 301 Ca -0.01 -0.12 -0.42 0.00 -0.27 0.00 0.00 62.75 61.93 2r58 n ILE 301 Cb 0.26 0.31 -0.03 0.00 -1.74 0.00 0.00 39.64 38.44 2r58 n ILE 301 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2r58 s PHE 302 N -2.46 3.55 0.15 4.28 0.40 -1.07 -4.71 117.98 118.11 2r58 s PHE 302 Ca 0.26 1.54 -0.06 0.00 -0.60 0.00 0.00 56.93 58.07 2r58 s PHE 302 Cb 0.19 -3.24 -0.06 0.00 0.51 0.00 0.00 43.02 40.43 2r58 s PHE 302 CO 0.50 -0.50 0.41 -0.65 0.70 0.00 0.00 175.22 175.67 2r58 s GLN 303 N 1.21 3.66 0.54 0.44 -1.52 -0.65 -5.02 119.66 118.32 2r58 s GLN 303 Ca 0.54 0.00 -0.22 0.00 -1.95 0.00 0.00 55.36 53.73 2r58 s GLN 303 Cb -0.24 -2.83 -0.05 0.00 -0.22 0.00 0.00 33.01 29.67 2r58 s GLN 303 CO 0.27 0.45 1.34 -1.25 -0.25 0.00 0.00 175.29 175.85 2r58 s PRO 304 N -2.60 3.19 0.07 2.91 0.04 -1.26 -4.28 135.00 133.07 2r58 s PRO 304 Ca 0.41 2.18 -0.31 0.00 0.04 0.00 0.00 61.00 63.33 2r58 s PRO 304 Cb -0.12 -2.26 -0.08 0.00 0.04 0.00 0.00 34.50 32.08 2r58 s PRO 304 CO 0.23 -1.13 1.53 -2.00 0.04 0.00 0.00 177.00 175.67 2r58 s GLU 305 N -2.90 4.24 0.63 4.56 2.12 -1.26 -4.81 118.70 121.28 2r58 s GLU 305 Ca 0.71 2.19 -0.18 0.00 0.36 0.00 0.00 54.97 58.05 2r58 s GLU 305 Cb -0.39 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.50 2r58 s GLU 305 CO 0.46 -0.63 1.23 -1.25 -0.54 0.00 0.00 175.26 174.53 2r58 s PRO 306 N 2.16 2.73 0.59 4.30 0.04 -1.26 -4.96 135.00 138.59 2r58 s PRO 306 Ca 0.69 1.87 -0.20 0.00 0.04 0.00 0.00 61.00 63.40 2r58 s PRO 306 Cb -0.37 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 2r58 s PRO 306 CO 0.30 -1.41 1.27 -2.30 0.04 0.00 0.00 177.00 174.90 2r58 n PRO 307 N -1.87 1.37 -4.07 0.56 -0.02 -1.26 -4.88 135.00 124.82 2r58 n PRO 307 Ca 0.14 0.51 -0.32 0.00 -2.02 0.00 0.00 63.50 61.81 2r58 n PRO 307 Cb 0.49 -2.48 -0.07 0.00 -0.02 0.00 0.00 33.50 31.42 2r58 n PRO 307 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2r58 s GLU 308 N -3.01 3.06 0.47 -0.52 -1.05 -1.26 -4.42 118.70 111.98 2r58 s GLU 308 Ca 0.76 -0.53 -0.24 0.00 -0.15 0.00 0.00 54.97 54.81 2r58 s GLU 308 Cb -0.41 -2.85 -0.08 0.00 -0.44 0.00 0.00 34.13 30.36 2r58 s GLU 308 CO 0.46 0.63 1.36 -2.30 0.95 0.00 0.00 175.26 176.36 2r58 n PRO 309 N 0.94 2.01 0.24 -4.83 -0.02 -1.26 -4.92 135.00 127.15 2r58 n PRO 309 Ca -0.11 0.72 0.12 0.00 -2.02 0.00 0.00 63.50 62.21 2r58 n PRO 309 Cb 0.52 -2.55 0.49 0.00 -0.02 0.00 0.00 33.50 31.94 2r58 n PRO 309 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2r58 h GLU 310 N 1.99 0.00 -3.83 -0.52 5.08 -1.98 -3.46 114.58 111.85 2r58 h GLU 310 Ca -0.50 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.73 2r58 h GLU 310 Cb 1.29 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.45 2r58 h GLU 310 CO 0.59 0.14 -0.17 -1.83 -1.00 0.00 0.00 179.01 176.75 2r58 s GLU 311 N -3.58 1.64 -0.43 2.33 -1.05 -1.26 -5.11 118.70 111.24 2r58 s GLU 311 Ca 0.02 -1.43 -0.29 0.00 -0.15 0.00 0.00 54.97 53.12 2r58 s GLU 311 Cb 0.09 0.45 0.01 0.00 -0.44 0.00 0.00 34.13 34.24 2r58 s GLU 311 CO 0.61 -0.68 1.48 1.21 0.95 0.00 0.00 175.26 178.83 2r58 s ASN 312 N -3.09 6.22 0.00 0.83 3.84 -1.26 -4.85 114.94 116.63 2r58 s ASN 312 Ca 0.26 0.80 0.17 0.00 0.21 0.00 0.00 52.86 54.29 2r58 s ASN 312 Cb -0.00 -2.54 0.01 0.00 -0.55 0.00 0.00 41.25 38.18 2r58 s ASN 312 CO 0.12 -1.54 0.89 0.18 -2.79 0.00 0.00 177.10 173.97 2r58 n LEU 313 N 9.24 1.75 -4.73 3.21 4.32 -1.26 -4.98 117.00 124.54 2r58 n LEU 313 Ca 0.17 -0.80 -0.35 0.00 -0.02 0.00 0.00 56.01 55.01 2r58 n LEU 313 Cb 0.48 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.35 2r58 n LEU 313 CO 0.70 0.33 0.82 -0.36 -1.22 0.00 0.00 177.39 177.66 2r58 s PHE 314 N -1.85 2.18 0.02 -1.77 0.08 -1.26 -4.94 117.98 110.44 2r58 s PHE 314 Ca 0.14 1.56 0.04 0.00 0.12 0.00 0.00 56.93 58.79 2r58 s PHE 314 Cb 0.13 -3.48 -0.02 0.00 -0.57 0.00 0.00 43.02 39.09 2r58 s PHE 314 CO 0.38 -2.48 -0.12 0.15 -0.10 0.00 0.00 175.22 173.06 2r58 s LYS 315 N -3.71 0.83 0.18 0.44 -0.14 -1.26 -5.08 119.74 111.00 2r58 s LYS 315 Ca 0.76 -0.58 -0.33 0.00 -1.36 0.00 0.00 55.97 54.46 2r58 s LYS 315 Cb -0.30 -0.80 -0.15 0.00 -1.68 0.00 0.00 37.83 34.91 2r58 s LYS 315 CO 0.41 0.20 1.31 0.28 -0.76 0.00 0.00 175.35 176.80 2r58 n VAL 316 N 2.26 0.68 0.00 3.17 0.31 -1.26 -2.22 118.33 121.27 2r58 n VAL 316 Ca -0.17 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2r58 n VAL 316 Cb 0.56 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.37 2r58 n VAL 316 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2r58 n GLY 317 N 2.29 3.34 3.77 2.92 0.00 0.15 -5.04 105.19 112.62 2r58 n GLY 317 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2r58 n GLY 317 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r58 s GLN 318 N -0.97 4.31 0.20 1.61 -0.21 -0.94 -4.61 119.66 119.04 2r58 s GLN 318 Ca 0.00 1.99 0.03 0.00 0.02 0.00 0.00 55.36 57.40 2r58 s GLN 318 Cb 0.00 -2.95 -0.03 0.00 1.00 0.00 0.00 33.01 31.02 2r58 s GLN 318 CO 0.00 -0.15 0.34 0.15 -2.12 0.00 0.00 175.29 173.51 2r58 s LYS 319 N -1.90 3.45 0.34 2.91 1.02 -0.10 -0.81 119.74 124.65 2r58 s LYS 319 Ca 0.51 -0.63 -0.17 0.00 0.02 0.00 0.00 55.97 55.70 2r58 s LYS 319 Cb -0.35 -2.91 0.06 0.00 -0.52 0.00 0.00 37.83 34.11 2r58 s LYS 319 CO 0.45 0.46 0.85 -0.48 -0.92 0.00 0.00 175.35 175.71 2r58 s LEU 320 N -3.59 0.00 -0.18 3.17 0.05 -0.19 -0.56 118.68 117.39 2r58 s LEU 320 Ca 0.35 -1.03 -0.05 0.00 0.05 0.00 0.00 54.13 53.45 2r58 s LEU 320 Cb -0.10 2.66 -0.03 0.00 -2.05 0.00 0.00 46.19 46.67 2r58 s LEU 320 CO 0.29 -1.52 0.01 -1.61 -0.55 0.00 0.00 176.35 172.97 2r58 s GLU 321 N -2.28 3.79 -0.00 1.48 2.02 0.12 -1.15 118.70 122.68 2r58 s GLU 321 Ca 0.17 -0.45 0.03 0.00 0.02 0.00 0.00 54.97 54.74 2r58 s GLU 321 Cb -0.04 -3.07 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 2r58 s GLU 321 CO 0.10 0.21 -0.09 0.00 0.02 0.00 0.00 175.26 175.50 2r58 s ALA 322 N 0.50 0.74 0.20 5.21 0.00 -0.36 0.33 121.76 128.38 2r58 s ALA 322 Ca -0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 51.96 51.24 2r58 s ALA 322 Cb -0.14 -0.18 -0.10 0.00 0.00 0.00 0.00 23.12 22.71 2r58 s ALA 322 CO 0.02 0.17 1.51 0.08 0.00 0.00 0.00 175.76 177.54 2r58 s VAL 323 N -0.27 2.64 -0.62 0.00 1.01 -0.06 -0.15 120.40 122.96 2r58 s VAL 323 Ca 0.03 0.49 -0.28 0.00 0.00 0.00 0.00 61.98 62.22 2r58 s VAL 323 Cb -0.04 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 33.05 2r58 s VAL 323 CO -0.00 0.06 1.33 -0.62 0.00 0.00 0.00 175.10 175.86 2r58 s ASP 324 N 0.81 6.20 0.64 3.32 2.15 -0.20 -4.87 116.67 124.72 2r58 s ASP 324 Ca 0.65 0.04 0.42 0.00 0.43 0.00 0.00 52.55 54.10 2r58 s ASP 324 Cb -0.43 -2.55 2.20 0.00 -0.30 0.00 0.00 42.92 41.84 2r58 s ASP 324 CO 0.37 -1.70 2.29 0.11 -0.17 0.00 0.00 175.17 176.07 2r58 h LYS 325 N 10.47 0.00 0.00 4.34 1.57 -1.88 0.74 116.57 131.81 2r58 h LYS 325 Ca -0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2r58 h LYS 325 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2r58 h LYS 325 CO 1.21 0.00 -0.42 1.63 -0.57 0.00 0.00 179.45 181.30 2r58 n LYS 326 N -3.09 0.27 -3.06 3.15 5.02 -1.26 -4.36 118.16 114.83 2r58 n LYS 326 Ca -0.02 0.12 -0.18 0.00 -2.02 0.00 0.00 58.31 56.21 2r58 n LYS 326 Cb 0.12 -1.72 -0.02 0.00 -0.02 0.00 0.00 35.03 33.40 2r58 n LYS 326 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2r58 n ASN 327 N -2.13 -0.44 0.00 4.39 3.02 0.11 -5.04 115.26 115.17 2r58 n ASN 327 Ca 0.04 -3.00 0.04 0.00 -0.03 0.00 0.00 54.58 51.63 2r58 n ASN 327 Cb 0.43 0.07 0.22 0.00 -0.61 0.00 0.00 39.78 39.89 2r58 n ASN 327 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2r58 n PRO 328 N 1.01 0.12 0.24 3.52 -0.04 -0.35 -0.85 135.00 138.66 2r58 n PRO 328 Ca 0.18 0.20 0.10 0.00 -0.04 0.00 0.00 63.50 63.95 2r58 n PRO 328 Cb 0.60 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 33.17 2r58 n PRO 328 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2r58 h GLN 329 N 0.00 0.00 -5.80 0.54 4.15 -1.96 -3.44 115.11 108.60 2r58 h GLN 329 Ca 0.00 0.00 -0.58 0.00 0.77 0.00 0.00 58.65 58.84 2r58 h GLN 329 Cb 0.08 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.70 2r58 h GLN 329 CO 0.00 0.18 -0.16 -0.51 -1.93 0.00 0.00 178.83 176.41 2r58 s LEU 330 N -7.48 4.33 -0.13 -2.39 1.43 -0.03 -5.00 118.68 109.41 2r58 s LEU 330 Ca -0.02 0.84 0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2r58 s LEU 330 Cb 0.13 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.69 2r58 s LEU 330 CO 0.63 0.09 -0.20 -0.63 0.23 0.00 0.00 176.35 176.47 2r58 s ILE 331 N 0.18 2.34 0.15 -0.59 1.01 -1.26 -1.04 121.20 122.00 2r58 s ILE 331 Ca 0.25 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 60.05 2r58 s ILE 331 Cb -0.15 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 2r58 s ILE 331 CO 0.11 0.54 -0.11 0.00 0.00 0.00 0.00 174.94 175.48 2r58 s ALA 334 N 2.42 0.17 -0.00 0.00 0.00 -0.30 -2.67 121.76 121.38 2r58 s ALA 334 Ca 0.86 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.89 2r58 s ALA 334 Cb -0.72 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 2r58 s ALA 334 CO 0.46 -0.52 -0.08 0.99 0.00 0.00 0.00 175.76 176.61 2r58 s THR 335 N -3.94 0.63 -0.43 0.00 2.01 0.36 -1.02 115.64 113.26 2r58 s THR 335 Ca 0.12 -0.38 -0.29 0.00 0.31 0.00 0.00 61.69 61.45 2r58 s THR 335 Cb 0.05 -0.54 0.02 0.00 0.01 0.00 0.00 72.50 72.04 2r58 s THR 335 CO -0.05 0.15 1.31 -0.69 -0.69 0.00 0.00 174.62 174.65 2r58 s VAL 336 N -0.25 4.02 0.05 3.82 1.01 0.01 -1.11 120.40 127.95 2r58 s VAL 336 Ca 0.03 1.04 -0.10 0.00 0.00 0.00 0.00 61.98 62.95 2r58 s VAL 336 Cb -0.03 -4.35 -0.32 0.00 0.00 0.00 0.00 36.38 31.68 2r58 s VAL 336 CO -0.00 -0.84 1.04 -0.78 0.00 0.00 0.00 175.10 174.52 2r58 h ASP 337 N 10.13 0.63 -4.86 3.32 3.58 -1.00 0.46 116.42 128.68 2r58 h ASP 337 Ca -0.26 -0.69 0.01 0.00 0.42 0.00 0.00 57.03 56.51 2r58 h ASP 337 Cb 1.09 -0.20 -0.15 0.00 1.72 0.00 0.00 39.33 41.79 2r58 h ASP 337 CO 1.10 1.54 0.29 0.00 -2.88 0.00 0.00 179.24 179.30 2r58 s ALA 338 N -2.63 -1.71 -0.02 -0.78 0.00 -1.25 -4.77 121.76 110.61 2r58 s ALA 338 Ca -0.07 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.74 2r58 s ALA 338 Cb 0.06 0.51 0.02 0.00 0.00 0.00 0.00 23.12 23.70 2r58 s ALA 338 CO 0.91 -0.64 -0.03 0.42 0.00 0.00 0.00 175.76 176.42 2r58 s ILE 339 N -2.94 0.33 -0.30 0.00 1.01 -1.26 -0.86 121.20 117.18 2r58 s ILE 339 Ca -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.57 2r58 s ILE 339 Cb -0.01 -0.36 0.10 0.00 0.01 0.00 0.00 42.46 42.20 2r58 s ILE 339 CO -0.07 0.15 0.10 -0.54 0.00 0.00 0.00 174.94 174.58 2r58 s LYS 340 N 0.62 0.65 5.00 2.79 -0.14 -0.50 -5.04 119.74 123.12 2r58 s LYS 340 Ca -0.07 -0.99 0.00 0.00 -1.36 0.00 0.00 55.97 53.55 2r58 s LYS 340 Cb -0.10 -1.89 0.00 0.00 -1.68 0.00 0.00 37.83 34.16 2r58 s LYS 340 CO -0.01 -0.98 0.00 -0.25 -0.76 0.00 0.00 175.35 173.35 2r58 n ASP 341 N 4.90 0.00 -0.49 2.83 8.00 -1.26 -1.31 116.55 129.22 2r58 n ASP 341 Ca -0.03 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.61 2r58 n ASP 341 Cb 0.42 0.00 0.50 0.00 -0.02 0.00 0.00 41.12 42.02 2r58 n ASP 341 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2r58 n ASP 342 N 9.68 1.54 -4.65 -2.24 9.92 -1.26 -4.76 116.55 124.78 2r58 n ASP 342 Ca 0.00 -1.49 -0.35 0.00 -0.53 0.00 0.00 54.79 52.42 2r58 n ASP 342 Cb 0.00 0.01 -0.10 0.00 -0.64 0.00 0.00 41.12 40.39 2r58 n ASP 342 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2r58 s GLN 343 N -2.02 3.59 0.04 -1.24 -1.52 -0.43 -0.69 119.66 117.39 2r58 s GLN 343 Ca 0.37 -0.37 0.04 0.00 -1.95 0.00 0.00 55.36 53.45 2r58 s GLN 343 Cb 0.21 -3.04 -0.04 0.00 -0.22 0.00 0.00 33.01 29.92 2r58 s GLN 343 CO 0.34 0.45 -0.04 0.96 -0.25 0.00 0.00 175.29 176.75 2r58 s ILE 344 N -0.14 3.82 -0.33 1.08 -4.36 0.49 -1.41 121.20 120.34 2r58 s ILE 344 Ca 0.06 -0.87 -0.11 0.00 -0.26 0.00 0.00 60.65 59.46 2r58 s ILE 344 Cb -0.12 -2.73 -0.01 0.00 1.25 0.00 0.00 42.46 40.84 2r58 s ILE 344 CO 0.02 0.27 0.20 -2.28 0.24 0.00 0.00 174.94 173.39 2r58 s HIS 345 N -1.14 3.21 -0.20 1.37 5.65 -0.04 -1.45 115.29 122.69 2r58 s HIS 345 Ca 0.21 -0.42 -0.14 0.00 0.25 0.00 0.00 55.06 54.96 2r58 s HIS 345 Cb -0.11 -2.43 -0.04 0.00 -1.18 0.00 0.00 32.58 28.82 2r58 s HIS 345 CO 0.12 -0.43 0.29 0.08 -0.65 0.00 0.00 174.74 174.16 2r58 s VAL 346 N 1.66 5.28 0.03 0.89 1.01 0.29 -0.31 120.40 129.25 2r58 s VAL 346 Ca 0.05 0.49 0.07 0.00 0.00 0.00 0.00 61.98 62.60 2r58 s VAL 346 Cb -0.17 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2r58 s VAL 346 CO 0.08 0.32 -0.20 0.42 0.00 0.00 0.00 175.10 175.72 2r58 s THR 347 N 1.02 1.65 -0.34 3.92 -4.23 -0.27 -1.62 115.64 115.77 2r58 s THR 347 Ca 0.15 -1.14 -0.15 0.00 -1.18 0.00 0.00 61.69 59.37 2r58 s THR 347 Cb -0.14 -1.42 -0.01 0.00 1.34 0.00 0.00 72.50 72.27 2r58 s THR 347 CO 0.06 0.24 0.33 -0.36 -0.54 0.00 0.00 174.62 174.35 2r58 s PHE 348 N -0.75 3.22 0.10 3.99 0.08 -1.26 -0.48 117.98 122.87 2r58 s PHE 348 Ca 0.07 -0.05 -0.33 0.00 0.12 0.00 0.00 56.93 56.74 2r58 s PHE 348 Cb -0.09 -2.62 -0.13 0.00 -0.57 0.00 0.00 43.02 39.62 2r58 s PHE 348 CO 0.01 -0.40 1.70 -0.25 -0.10 0.00 0.00 175.22 176.18 2r58 n ASP 349 N 5.32 3.37 0.00 1.36 9.92 -1.09 -1.47 116.55 133.96 2r58 n ASP 349 Ca -0.10 1.04 0.00 0.00 -0.53 0.00 0.00 54.79 55.20 2r58 n ASP 349 Cb 0.50 -1.44 0.00 0.00 -0.64 0.00 0.00 41.12 39.54 2r58 n ASP 349 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2r58 n GLY 350 N 3.81 0.80 3.38 0.44 0.00 -1.26 -1.21 105.19 111.16 2r58 n GLY 350 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2r58 n GLY 350 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2r58 s TRP 351 N -3.06 2.24 0.66 1.61 0.52 -0.54 -2.57 118.94 117.79 2r58 s TRP 351 Ca 0.00 -0.38 -0.18 0.00 0.02 0.00 0.00 56.10 55.56 2r58 s TRP 351 Cb 0.00 -1.19 -0.01 0.00 -1.15 0.00 0.00 33.47 31.13 2r58 s TRP 351 CO 0.00 0.36 1.29 -0.98 0.02 0.00 0.00 176.95 177.64 2r58 s ARG 352 N -2.19 2.49 0.00 4.98 1.70 -1.26 -4.73 118.95 119.94 2r58 s ARG 352 Ca 0.15 2.06 0.00 0.00 -0.47 0.00 0.00 55.73 57.47 2r58 s ARG 352 Cb -0.09 -1.84 0.00 0.00 -0.57 0.00 0.00 34.95 32.45 2r58 s ARG 352 CO 0.07 -1.64 0.49 0.41 -1.08 0.00 0.00 175.30 173.54 2r58 n GLY 353 N 0.89 -0.04 0.23 3.88 0.00 -1.26 -2.58 105.19 106.30 2r58 n GLY 353 Ca 0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.27 2r58 n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r58 h ALA 354 N 1.77 1.24 -0.04 4.61 0.00 -2.01 -2.61 119.26 122.21 2r58 h ALA 354 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2r58 h ALA 354 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2r58 h ALA 354 CO 0.00 0.28 0.00 1.19 0.00 0.00 0.00 179.25 180.72 2r58 n PHE 355 N -3.71 0.03 -1.73 0.00 3.72 -1.07 -4.94 117.46 109.77 2r58 n PHE 355 Ca -0.01 -0.02 -0.33 0.00 -0.05 0.00 0.00 57.45 57.04 2r58 n PHE 355 Cb 0.34 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.93 2r58 n PHE 355 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2r58 s ASP 356 N -1.95 5.06 0.02 4.37 1.01 -0.99 -4.79 116.67 119.41 2r58 s ASP 356 Ca 0.35 2.00 -0.27 0.00 0.71 0.00 0.00 52.55 55.35 2r58 s ASP 356 Cb 0.21 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.65 2r58 s ASP 356 CO 0.32 -1.66 0.61 -0.72 0.21 0.00 0.00 175.17 173.93 2r58 s TYR 357 N -2.35 -0.56 0.07 4.23 -0.85 -0.64 -5.01 117.35 112.24 2r58 s TYR 357 Ca 0.67 0.76 -0.20 0.00 -0.52 0.00 0.00 57.07 57.78 2r58 s TYR 357 Cb -0.21 0.42 -0.07 0.00 0.38 0.00 0.00 41.96 42.49 2r58 s TYR 357 CO 0.42 -0.67 0.58 -1.58 -1.52 0.00 0.00 175.55 172.78 2r58 s TRP 358 N -2.11 3.80 0.10 -3.49 0.52 -1.26 -0.55 118.94 115.95 2r58 s TRP 358 Ca -0.07 1.28 -0.06 0.00 0.02 0.00 0.00 56.10 57.28 2r58 s TRP 358 Cb -0.01 -2.52 -0.02 0.00 -1.15 0.00 0.00 33.47 29.78 2r58 s TRP 358 CO 0.01 0.57 0.15 0.00 0.02 0.00 0.00 176.95 177.70 2r58 s ASN 360 N -2.92 5.88 0.57 0.00 3.84 -1.26 -0.38 114.94 120.67 2r58 s ASN 360 Ca 0.11 2.28 0.38 0.00 0.21 0.00 0.00 52.86 55.84 2r58 s ASN 360 Cb 0.06 -2.59 2.04 0.00 -0.55 0.00 0.00 41.25 40.20 2r58 s ASN 360 CO -0.07 -1.12 2.17 0.10 -2.79 0.00 0.00 177.10 175.40 2r58 h TYR 361 N 1.59 0.00 -0.05 0.43 -0.00 -1.27 -1.00 116.97 116.67 2r58 h TYR 361 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.23 2r58 h TYR 361 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.99 2r58 h TYR 361 CO 0.52 0.00 0.00 0.54 -0.00 0.00 0.00 178.16 179.22 2r58 n ARG 362 N -2.88 1.34 -1.62 0.10 1.74 -1.26 -4.39 116.66 109.69 2r58 n ARG 362 Ca -0.02 -0.51 -0.46 0.00 -0.77 0.00 0.00 57.85 56.10 2r58 n ARG 362 Cb 0.09 -1.41 -0.02 0.00 -1.02 0.00 0.00 32.46 30.10 2r58 n ARG 362 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2r58 n SER 363 N -0.33 1.89 -0.02 0.55 2.88 -0.38 -4.67 113.62 113.55 2r58 n SER 363 Ca 0.18 1.16 0.15 0.00 -1.33 0.00 0.00 58.87 59.03 2r58 n SER 363 Cb 0.21 -1.33 0.75 0.00 -0.75 0.00 0.00 64.21 63.09 2r58 n SER 363 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2r58 n ARG 364 N 1.39 0.51 -0.14 -1.46 5.12 -1.26 -3.88 116.66 116.93 2r58 n ARG 364 Ca 0.11 -0.03 0.10 0.00 -1.93 0.00 0.00 57.85 56.10 2r58 n ARG 364 Cb 0.30 -1.50 0.29 0.00 -1.16 0.00 0.00 32.46 30.39 2r58 n ARG 364 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2r58 n ASP 365 N -1.22 2.38 -4.26 0.55 8.00 -1.26 -4.88 116.55 115.86 2r58 n ASP 365 Ca 0.15 -1.86 -0.25 0.00 0.71 0.00 0.00 54.79 53.55 2r58 n ASP 365 Cb 0.24 -0.19 -0.13 0.00 -0.02 0.00 0.00 41.12 41.01 2r58 n ASP 365 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2r58 s ILE 366 N -1.62 1.68 0.01 0.53 -4.36 -1.25 -0.88 121.20 115.30 2r58 s ILE 366 Ca 0.34 -1.32 -0.04 0.00 -0.26 0.00 0.00 60.65 59.37 2r58 s ILE 366 Cb 0.19 -1.48 -0.01 0.00 1.25 0.00 0.00 42.46 42.41 2r58 s ILE 366 CO 0.27 0.11 0.06 -0.36 0.24 0.00 0.00 174.94 175.26 2r58 s PHE 367 N -0.93 0.14 0.64 1.37 0.40 0.15 -4.86 117.98 114.90 2r58 s PHE 367 Ca 0.07 -0.32 -0.16 0.00 -0.60 0.00 0.00 56.93 55.92 2r58 s PHE 367 Cb -0.09 -0.11 -0.01 0.00 0.51 0.00 0.00 43.02 43.32 2r58 s PHE 367 CO 0.03 -0.24 1.15 -1.25 0.70 0.00 0.00 175.22 175.60 2r58 s PRO 368 N -1.43 2.77 0.19 0.24 0.04 -1.26 -0.70 135.00 134.85 2r58 s PRO 368 Ca -0.15 1.58 -0.33 0.00 0.04 0.00 0.00 61.00 62.14 2r58 s PRO 368 Cb -0.09 -1.93 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 2r58 s PRO 368 CO 0.00 -1.31 1.62 0.00 0.04 0.00 0.00 177.00 177.36 2r58 n ALA 369 N -2.16 1.93 -0.01 8.56 0.00 -1.26 -2.04 120.51 125.52 2r58 n ALA 369 Ca 0.12 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2r58 n ALA 369 Cb 0.51 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.55 2r58 n ALA 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r58 n GLY 370 N 3.49 0.25 0.17 0.00 0.00 -1.26 -4.97 105.19 102.88 2r58 n GLY 370 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 2r58 n GLY 370 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2r58 h TRP 371 N 0.00 0.59 -0.47 1.61 7.01 -1.77 -2.67 115.95 120.24 2r58 h TRP 371 Ca 0.00 -0.12 0.03 0.00 2.11 0.00 0.00 58.89 60.90 2r58 h TRP 371 Cb 0.00 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 26.88 2r58 h TRP 371 CO 0.00 0.73 0.26 0.00 -2.79 0.00 0.00 178.44 176.64 2r58 h ALA 373 N 1.23 1.76 0.00 0.00 0.00 -1.71 -0.25 119.26 120.28 2r58 h ALA 373 Ca 0.20 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2r58 h ALA 373 Cb 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2r58 h ALA 373 CO -0.11 0.20 -0.39 -0.09 0.00 0.00 0.00 179.25 178.87 2r58 h ARG 374 N 0.32 0.00 -0.03 0.00 2.43 -1.03 -3.26 114.38 112.82 2r58 h ARG 374 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2r58 h ARG 374 Cb 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2r58 h ARG 374 CO -0.01 0.39 0.00 -1.13 -1.51 0.00 0.00 179.97 177.70 2r58 n SER 375 N -3.23 2.73 -3.16 -3.80 3.41 -0.37 -4.82 113.62 104.39 2r58 n SER 375 Ca 0.02 -1.86 -0.19 0.00 -0.26 0.00 0.00 58.87 56.57 2r58 n SER 375 Cb 0.66 -0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.68 2r58 n SER 375 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r58 s HIS 377 N -3.28 2.76 0.59 0.00 5.04 -0.47 -3.59 115.29 116.34 2r58 s HIS 377 Ca 0.39 -0.35 -0.19 0.00 -1.54 0.00 0.00 55.06 53.36 2r58 s HIS 377 Cb -0.17 -1.73 -0.04 0.00 0.04 0.00 0.00 32.58 30.68 2r58 s HIS 377 CO 0.63 0.02 1.19 -2.30 -2.34 0.00 0.00 174.74 171.94 2r58 n PRO 378 N 2.83 1.21 -3.76 2.88 -0.02 -1.26 -4.18 135.00 132.70 2r58 n PRO 378 Ca -0.18 0.46 -0.26 0.00 -2.02 0.00 0.00 63.50 61.51 2r58 n PRO 378 Cb 0.52 -2.40 -0.17 0.00 -0.02 0.00 0.00 33.50 31.44 2r58 n PRO 378 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2r58 s MET 379 N -2.97 0.71 0.03 -0.52 1.75 -1.26 -4.41 119.30 112.63 2r58 s MET 379 Ca 0.76 -0.23 -0.30 0.00 -1.25 0.00 0.00 55.69 54.67 2r58 s MET 379 Cb -0.41 -1.69 -0.05 0.00 2.84 0.00 0.00 34.83 35.52 2r58 s MET 379 CO 0.46 -0.50 1.25 -0.65 -0.65 0.00 0.00 175.02 174.93 2r58 s GLN 380 N 1.88 4.38 0.95 4.11 -1.52 0.01 -4.76 119.66 124.70 2r58 s GLN 380 Ca 0.01 1.82 -0.12 0.00 -1.95 0.00 0.00 55.36 55.12 2r58 s GLN 380 Cb -0.15 -3.42 0.16 0.00 -0.22 0.00 0.00 33.01 29.38 2r58 s GLN 380 CO -0.07 -0.37 1.09 -1.25 -0.25 0.00 0.00 175.29 174.44 2r58 s PRO 381 N 1.53 0.82 0.64 2.91 0.04 -1.26 -1.63 135.00 138.05 2r58 s PRO 381 Ca 0.60 0.74 -0.17 0.00 0.04 0.00 0.00 61.00 62.21 2r58 s PRO 381 Cb -0.30 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 2r58 s PRO 381 CO 0.27 -2.52 0.47 -2.30 0.04 0.00 0.00 177.00 172.96 2r58 n PRO 382 N -4.07 0.39 -1.12 0.56 -0.02 -1.26 -4.70 135.00 124.79 2r58 n PRO 382 Ca 0.06 0.16 -0.29 0.00 -2.02 0.00 0.00 63.50 61.41 2r58 n PRO 382 Cb 0.56 -1.72 0.16 0.00 -0.02 0.00 0.00 33.50 32.48 2r58 n PRO 382 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2r58 s GLY 383 N -1.29 1.61 -0.37 -1.23 0.00 -0.35 -4.91 107.32 100.77 2r58 s GLY 383 Ca 0.66 -0.09 0.03 0.00 0.00 0.00 0.00 44.72 45.32 2r58 s GLY 383 CO 0.57 0.44 1.76 1.42 0.00 0.00 0.00 173.10 177.28 2r58 n HIS 384 N -4.04 2.43 0.56 1.90 8.25 -1.25 -4.43 115.22 118.65 2r58 n HIS 384 Ca 0.07 -1.67 0.07 0.00 -0.26 0.00 0.00 57.72 55.92 2r58 n HIS 384 Cb 0.55 -0.85 0.06 0.00 1.12 0.00 0.00 29.99 30.87 2r58 n HIS 384 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61