#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a01 n ARG 171 N 0.00 0.00 -4.06 0.00 3.00 -1.26 -5.08 116.66 109.27 3a01 n ARG 171 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.44 3a01 n ARG 171 Cb 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 32.46 32.32 3a01 n ARG 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3a01 n ARG 172 N -1.10 -0.34 -2.01 -0.14 5.12 -1.26 -4.91 116.66 112.02 3a01 n ARG 172 Ca 0.00 -0.01 -0.37 0.00 -1.93 0.00 0.00 57.85 55.53 3a01 n ARG 172 Cb 0.00 -2.09 0.02 0.00 -1.16 0.00 0.00 32.46 29.23 3a01 n ARG 172 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 3a01 s ILE 173 N -3.75 2.58 0.00 0.55 2.07 -1.26 -5.07 121.20 116.32 3a01 s ILE 173 Ca 0.41 0.42 0.00 0.00 -1.41 0.00 0.00 60.65 60.07 3a01 s ILE 173 Cb -0.23 -3.21 0.00 0.00 0.13 0.00 0.00 42.46 39.15 3a01 s ILE 173 CO 0.86 -0.02 0.00 0.61 -1.91 0.00 0.00 174.94 174.48 3a01 n GLY 174 N 0.58 4.75 3.84 1.50 0.00 -1.26 -5.13 105.19 109.46 3a01 n GLY 174 Ca 0.10 -1.84 -0.37 0.00 0.00 0.00 0.00 46.02 43.91 3a01 n GLY 174 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3a01 s HIS 175 N 2.08 3.57 0.60 1.61 -3.43 -1.26 -5.08 115.29 113.38 3a01 s HIS 175 Ca 0.00 0.55 -0.18 0.00 -0.80 0.00 0.00 55.06 54.63 3a01 s HIS 175 Cb 0.00 -2.04 -0.03 0.00 -1.43 0.00 0.00 32.58 29.08 3a01 s HIS 175 CO 0.00 0.62 1.16 -1.25 -2.00 0.00 0.00 174.74 173.27 3a01 s PRO 176 N -0.71 3.01 0.07 -0.38 0.04 -1.26 -4.97 135.00 130.81 3a01 s PRO 176 Ca 0.15 1.64 -0.13 0.00 0.04 0.00 0.00 61.00 62.70 3a01 s PRO 176 Cb -0.12 -1.96 -0.24 0.00 0.04 0.00 0.00 34.50 32.22 3a01 s PRO 176 CO 0.04 -1.13 1.17 -0.92 0.04 0.00 0.00 177.00 176.20 3a01 h TYR 177 N 0.73 1.00 -0.73 0.56 3.20 -1.97 -3.25 116.97 116.50 3a01 h TYR 177 Ca -0.49 -0.57 0.15 0.00 3.14 0.00 0.00 58.73 60.95 3a01 h TYR 177 Cb 1.27 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 39.39 3a01 h TYR 177 CO 0.50 1.41 0.49 1.96 -1.64 0.00 0.00 178.16 180.88 3a01 h GLN 178 N 0.34 0.38 0.00 1.82 4.20 -2.01 -0.97 115.11 118.87 3a01 h GLN 178 Ca -0.14 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.54 3a01 h GLN 178 Cb 1.76 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.46 3a01 h GLN 178 CO 0.21 0.25 0.00 0.09 -0.67 0.00 0.00 178.83 178.71 3a01 n ASN 179 N -4.47 0.55 -4.81 1.46 3.02 -1.22 -4.81 115.26 104.97 3a01 n ASN 179 Ca 0.14 0.61 -0.33 0.00 -0.03 0.00 0.00 54.58 54.97 3a01 n ASN 179 Cb 0.53 -0.73 -0.01 0.00 -0.61 0.00 0.00 39.78 38.95 3a01 n ASN 179 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3a01 s ARG 180 N -3.19 3.60 0.24 3.52 0.52 -0.37 -5.00 118.95 118.27 3a01 s ARG 180 Ca 0.07 1.15 -0.30 0.00 -0.52 0.00 0.00 55.73 56.13 3a01 s ARG 180 Cb 0.11 -2.08 -0.10 0.00 0.52 0.00 0.00 34.95 33.40 3a01 s ARG 180 CO 0.43 -0.57 1.38 0.95 0.02 0.00 0.00 175.30 177.51 3a01 s THR 181 N -2.43 2.83 0.25 0.02 -4.23 -1.26 -4.95 115.64 105.87 3a01 s THR 181 Ca 0.63 0.71 -0.30 0.00 -1.18 0.00 0.00 61.69 61.55 3a01 s THR 181 Cb -0.14 -3.45 -0.15 0.00 1.34 0.00 0.00 72.50 70.10 3a01 s THR 181 CO 0.32 0.12 1.04 -2.65 -0.54 0.00 0.00 174.62 172.91 3a01 n PRO 182 N 2.23 1.24 -0.73 3.99 -0.02 -1.26 -4.93 135.00 135.51 3a01 n PRO 182 Ca 0.06 0.44 -0.32 0.00 -2.02 0.00 0.00 63.50 61.65 3a01 n PRO 182 Cb 0.41 -1.83 0.15 0.00 -0.02 0.00 0.00 33.50 32.21 3a01 n PRO 182 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3a01 n PRO 183 N 1.08 -0.58 -3.84 0.52 -0.02 -1.26 -5.02 135.00 125.88 3a01 n PRO 183 Ca 0.12 -0.12 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 3a01 n PRO 183 Cb 0.29 -2.00 -0.13 0.00 -0.02 0.00 0.00 33.50 31.65 3a01 n PRO 183 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3a01 s LYS 184 N -3.93 2.00 -0.79 -0.52 1.02 -1.26 -5.07 119.74 111.19 3a01 s LYS 184 Ca 0.60 -2.81 -0.26 0.00 0.02 0.00 0.00 55.97 53.52 3a01 s LYS 184 Cb -0.21 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.06 3a01 s LYS 184 CO 0.65 -1.22 1.57 1.03 -0.92 0.00 0.00 175.35 176.45 3a01 s ARG 185 N -0.69 3.03 -0.35 1.68 3.00 -1.26 -4.90 118.95 119.45 3a01 s ARG 185 Ca 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 55.73 55.75 3a01 s ARG 185 Cb -0.13 -4.60 0.13 0.00 0.00 0.00 0.00 34.95 30.35 3a01 s ARG 185 CO -0.09 -2.50 0.20 -1.59 0.00 0.00 0.00 175.30 171.32 3a01 s LYS 186 N 6.12 0.61 0.23 3.54 0.00 -1.26 -4.95 119.74 124.04 3a01 s LYS 186 Ca 0.51 -1.32 0.00 0.00 0.00 0.00 0.00 55.97 55.16 3a01 s LYS 186 Cb -0.07 -1.44 0.00 0.00 0.00 0.00 0.00 37.83 36.31 3a01 s LYS 186 CO 0.09 -1.18 0.00 0.36 0.00 0.00 0.00 175.35 174.63 3a01 n LYS 187 N 4.13 0.00 -1.58 1.78 0.00 -1.26 -5.18 118.16 116.06 3a01 n LYS 187 Ca 0.09 0.00 -0.48 0.00 -0.00 0.00 0.00 58.31 57.92 3a01 n LYS 187 Cb 0.37 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.37 3a01 n LYS 187 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3a01 n PRO 188 N -2.99 1.18 -2.39 -1.58 -0.04 -1.26 -4.76 135.00 123.16 3a01 n PRO 188 Ca 0.00 0.42 -0.37 0.00 -0.04 0.00 0.00 63.50 63.51 3a01 n PRO 188 Cb 0.00 -1.87 -0.04 0.00 -0.04 0.00 0.00 33.50 31.55 3a01 n PRO 188 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3a01 s ARG 189 N -0.68 3.21 0.66 0.54 3.52 -1.26 -4.98 118.95 119.97 3a01 s ARG 189 Ca 0.69 -0.73 -0.11 0.00 -0.13 0.00 0.00 55.73 55.46 3a01 s ARG 189 Cb -0.82 -5.13 -0.01 0.00 -1.56 0.00 0.00 34.95 27.44 3a01 s ARG 189 CO 0.54 -2.56 1.05 0.95 -0.81 0.00 0.00 175.30 174.47 3a01 s THR 190 N 6.70 4.26 -0.13 4.11 -4.23 -1.26 -5.08 115.64 120.01 3a01 s THR 190 Ca 0.53 0.73 -0.04 0.00 -1.18 0.00 0.00 61.69 61.73 3a01 s THR 190 Cb -0.03 -3.63 0.06 0.00 1.34 0.00 0.00 72.50 70.25 3a01 s THR 190 CO -0.04 -0.96 0.24 -0.55 -0.54 0.00 0.00 174.62 172.77 3a01 s SER 191 N -4.05 0.49 0.37 3.99 0.15 -1.26 -5.15 113.70 108.24 3a01 s SER 191 Ca 0.57 0.49 -0.26 0.00 0.70 0.00 0.00 55.95 57.45 3a01 s SER 191 Cb -0.12 0.60 -0.09 0.00 -1.71 0.00 0.00 66.02 64.70 3a01 s SER 191 CO 0.54 -0.25 1.09 -0.36 1.20 0.00 0.00 173.24 175.46 3a01 s PHE 192 N 2.39 3.31 0.75 3.44 0.08 -1.26 -5.01 117.98 121.68 3a01 s PHE 192 Ca 0.02 1.64 -0.12 0.00 0.12 0.00 0.00 56.93 58.59 3a01 s PHE 192 Cb -0.12 -3.23 0.05 0.00 -0.57 0.00 0.00 43.02 39.15 3a01 s PHE 192 CO -0.08 -0.75 1.11 0.95 -0.10 0.00 0.00 175.22 176.35 3a01 s THR 193 N -1.47 3.10 0.44 0.64 -4.23 -1.26 -4.71 115.64 108.15 3a01 s THR 193 Ca 0.54 0.41 0.18 0.00 -1.18 0.00 0.00 61.69 61.65 3a01 s THR 193 Cb -0.27 -2.87 0.21 0.00 1.34 0.00 0.00 72.50 70.92 3a01 s THR 193 CO 0.34 -0.41 2.01 0.08 -0.54 0.00 0.00 174.62 176.10 3a01 h ARG 194 N -0.79 0.00 0.26 3.99 0.11 -1.98 0.26 114.38 116.23 3a01 h ARG 194 Ca -0.45 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.62 3a01 h ARG 194 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 3a01 h ARG 194 CO 0.51 0.17 -0.13 0.82 0.10 0.00 0.00 179.97 181.44 3a01 h ILE 195 N 0.00 0.75 -0.81 0.08 1.08 -1.98 0.41 117.51 117.04 3a01 h ILE 195 Ca -0.00 -0.73 0.14 0.00 -0.39 0.00 0.00 64.86 63.88 3a01 h ILE 195 Cb 0.33 1.12 -0.14 0.00 -3.07 0.00 0.00 36.82 35.06 3a01 h ILE 195 CO 0.02 0.14 -0.32 1.56 -0.69 0.00 0.00 178.15 178.87 3a01 h GLN 196 N -0.77 -0.06 0.48 2.37 4.20 -1.75 0.08 115.11 119.65 3a01 h GLN 196 Ca -0.04 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 3a01 h GLN 196 Cb 0.50 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.30 3a01 h GLN 196 CO 0.06 -0.04 -0.23 0.28 -0.67 0.00 0.00 178.83 178.23 3a01 h VAL 197 N -0.06 0.52 0.00 -0.54 2.07 -0.32 -2.39 116.25 115.53 3a01 h VAL 197 Ca 0.32 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 3a01 h VAL 197 Cb 0.59 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3a01 h VAL 197 CO -0.84 0.03 -0.04 0.00 0.02 0.00 0.00 177.57 176.73 3a01 h ALA 198 N -0.28 1.72 -0.21 1.67 0.00 0.47 -0.12 119.26 122.51 3a01 h ALA 198 Ca -0.07 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3a01 h ALA 198 Cb 0.54 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3a01 h ALA 198 CO 0.11 0.06 -0.13 0.93 0.00 0.00 0.00 179.25 180.21 3a01 h GLU 199 N 0.00 0.45 -0.25 0.00 4.39 -0.90 -1.87 114.58 116.40 3a01 h GLU 199 Ca -0.00 -0.21 0.03 0.00 0.34 0.00 0.00 59.36 59.52 3a01 h GLU 199 Cb 0.09 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 3a01 h GLU 199 CO 0.01 0.76 0.06 -0.07 -1.16 0.00 0.00 179.01 178.60 3a01 h LEU 200 N 0.14 0.03 -1.43 1.33 3.38 -0.56 -0.40 115.31 117.81 3a01 h LEU 200 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3a01 h LEU 200 Cb 0.64 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3a01 h LEU 200 CO 0.04 0.05 0.28 -0.08 0.09 0.00 0.00 178.44 178.82 3a01 h GLU 201 N 0.16 0.67 0.08 1.13 4.57 -1.11 -0.02 114.58 120.05 3a01 h GLU 201 Ca 0.11 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3a01 h GLU 201 Cb 0.11 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.55 3a01 h GLU 201 CO -0.14 0.48 -0.04 -0.22 -1.18 0.00 0.00 179.01 177.91 3a01 h LYS 202 N 0.68 -0.10 -0.88 1.92 3.64 -0.44 -2.12 116.57 119.28 3a01 h LYS 202 Ca 0.18 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.65 3a01 h LYS 202 Cb -0.00 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.78 3a01 h LYS 202 CO -0.03 0.26 0.57 -0.09 -2.27 0.00 0.00 179.45 177.89 3a01 h ARG 203 N -0.48 0.90 -0.70 1.90 9.65 -0.87 -2.67 114.38 122.12 3a01 h ARG 203 Ca -0.01 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.79 3a01 h ARG 203 Cb 0.41 -0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 28.75 3a01 h ARG 203 CO 0.02 0.59 0.35 0.35 2.80 0.00 0.00 179.97 184.08 3a01 h PHE 204 N 0.93 0.97 -0.66 2.20 3.57 -0.59 -0.89 116.94 122.46 3a01 h PHE 204 Ca 0.39 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 3a01 h PHE 204 Cb 0.32 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 3a01 h PHE 204 CO -0.00 0.70 0.39 1.25 -2.23 0.00 0.00 178.31 178.41 3a01 h HIS 205 N 0.98 0.86 -0.01 0.41 2.76 -1.03 -2.83 115.15 116.29 3a01 h HIS 205 Ca 0.24 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 3a01 h HIS 205 Cb 0.07 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.75 3a01 h HIS 205 CO 0.01 0.58 -0.45 0.36 -1.30 0.00 0.00 177.93 177.13 3a01 n LYS 206 N -4.40 1.37 -3.26 5.26 2.85 -0.93 -4.89 118.16 114.17 3a01 n LYS 206 Ca 0.07 -0.88 -0.05 0.00 -1.05 0.00 0.00 58.31 56.40 3a01 n LYS 206 Cb 0.07 -1.40 -0.04 0.00 -0.65 0.00 0.00 35.03 33.02 3a01 n LYS 206 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 3a01 s GLN 207 N -2.27 0.46 0.41 -1.58 0.74 -0.39 -5.03 119.66 112.00 3a01 s GLN 207 Ca 0.16 0.35 0.22 0.00 0.05 0.00 0.00 55.36 56.14 3a01 s GLN 207 Cb 0.16 -0.12 0.29 0.00 1.10 0.00 0.00 33.01 34.44 3a01 s GLN 207 CO 0.52 -0.97 1.56 0.87 -0.55 0.00 0.00 175.29 176.72 3a01 h LYS 208 N 8.11 0.00 -6.11 1.67 1.79 -1.83 -3.38 116.57 116.83 3a01 h LYS 208 Ca -0.09 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.81 3a01 h LYS 208 Cb 1.14 0.00 -0.25 0.00 -1.58 0.00 0.00 32.23 31.55 3a01 h LYS 208 CO 0.24 0.05 -0.84 0.71 -1.08 0.00 0.00 179.45 178.53 3a01 s TYR 209 N -3.19 1.80 -0.09 -1.35 2.02 -1.26 -4.96 117.35 110.32 3a01 s TYR 209 Ca 0.06 -0.39 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 3a01 s TYR 209 Cb 0.06 -1.05 0.01 0.00 -0.40 0.00 0.00 41.96 40.57 3a01 s TYR 209 CO 0.68 0.12 -0.16 -0.51 -1.57 0.00 0.00 175.55 174.11 3a01 s LEU 210 N -1.38 1.80 0.87 -1.29 1.43 -1.26 -5.12 118.68 113.72 3a01 s LEU 210 Ca 0.07 -0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 52.65 3a01 s LEU 210 Cb -0.09 -1.07 0.11 0.00 0.03 0.00 0.00 46.19 45.17 3a01 s LEU 210 CO 0.02 0.07 1.09 0.00 0.23 0.00 0.00 176.35 177.76 3a01 s ALA 211 N 0.65 1.69 0.05 4.21 0.00 -1.26 -4.82 121.76 122.28 3a01 s ALA 211 Ca -0.14 0.07 -0.27 0.00 0.00 0.00 0.00 51.96 51.61 3a01 s ALA 211 Cb -0.16 -3.23 -0.17 0.00 0.00 0.00 0.00 23.12 19.56 3a01 s ALA 211 CO 0.04 -2.25 1.48 0.66 0.00 0.00 0.00 175.76 175.69 3a01 h SER 212 N -1.47 -0.41 -1.00 0.00 4.64 -1.99 -0.82 113.55 112.49 3a01 h SER 212 Ca -0.48 -0.08 0.21 0.00 -0.47 0.00 0.00 61.79 60.97 3a01 h SER 212 Cb 1.27 0.10 -0.11 0.00 -0.31 0.00 0.00 62.40 63.35 3a01 h SER 212 CO 0.53 -0.16 0.61 0.00 -0.87 0.00 0.00 176.83 176.93 3a01 h ALA 213 N -0.05 1.73 0.00 5.18 0.00 -1.99 0.11 119.26 124.23 3a01 h ALA 213 Ca -0.05 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3a01 h ALA 213 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3a01 h ALA 213 CO 0.08 -0.13 -0.25 -0.85 0.00 0.00 0.00 179.25 178.10 3a01 n GLU 214 N -4.79 0.28 -0.03 0.00 0.28 -1.07 -1.78 120.64 113.53 3a01 n GLU 214 Ca 0.24 0.17 -0.14 0.00 -0.16 0.00 0.00 57.16 57.27 3a01 n GLU 214 Cb 0.63 -1.76 -0.11 0.00 1.43 0.00 0.00 31.44 31.62 3a01 n GLU 214 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 3a01 h ARG 215 N 0.00 0.13 -0.61 3.44 2.43 0.60 -2.17 114.38 118.19 3a01 h ARG 215 Ca 0.00 -0.12 0.12 0.00 -0.81 0.00 0.00 59.98 59.17 3a01 h ARG 215 Cb 0.75 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 30.21 3a01 h ARG 215 CO 0.00 0.83 -0.24 0.00 -1.51 0.00 0.00 179.97 179.05 3a01 h ALA 216 N 0.31 0.22 -0.55 2.80 0.00 -0.75 0.15 119.26 121.45 3a01 h ALA 216 Ca -0.02 0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3a01 h ALA 216 Cb 0.87 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 3a01 h ALA 216 CO 0.03 -0.53 0.14 0.00 0.00 0.00 0.00 179.25 178.89 3a01 h ALA 217 N 1.36 0.72 -0.91 0.00 0.00 -1.38 0.35 119.26 119.40 3a01 h ALA 217 Ca 0.28 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3a01 h ALA 217 Cb 0.51 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3a01 h ALA 217 CO -0.67 0.41 0.52 1.25 0.00 0.00 0.00 179.25 180.75 3a01 h LEU 218 N 0.77 1.13 0.07 0.00 5.85 -0.46 -2.11 115.31 120.56 3a01 h LEU 218 Ca 0.17 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3a01 h LEU 218 Cb 0.32 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.07 3a01 h LEU 218 CO -0.00 0.89 -0.04 0.00 -0.34 0.00 0.00 178.44 178.95 3a01 h ALA 219 N 1.29 -0.10 -0.21 1.25 0.00 -0.68 -2.57 119.26 118.25 3a01 h ALA 219 Ca 0.32 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.10 3a01 h ALA 219 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3a01 h ALA 219 CO -0.05 -0.36 0.20 -0.09 0.00 0.00 0.00 179.25 178.95 3a01 h ARG 220 N -0.49 0.00 -0.19 0.00 2.43 -0.68 0.34 114.38 115.79 3a01 h ARG 220 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3a01 h ARG 220 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3a01 h ARG 220 CO 0.02 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.89 3a01 n GLY 221 N -1.45 1.15 0.02 2.80 0.00 -0.81 -3.67 105.19 103.23 3a01 n GLY 221 Ca 0.02 -0.67 0.01 0.00 0.00 0.00 0.00 46.02 45.38 3a01 n GLY 221 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a01 n LEU 222 N 1.22 1.58 -4.16 0.99 4.77 0.89 -5.01 117.00 117.29 3a01 n LEU 222 Ca 0.17 -1.67 -0.32 0.00 -0.03 0.00 0.00 56.01 54.15 3a01 n LEU 222 Cb 0.56 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 3a01 n LEU 222 CO 0.15 0.41 -0.35 0.29 -1.33 0.00 0.00 177.39 176.57 3a01 n LYS 223 N -0.47 -1.44 -4.40 3.23 4.76 0.45 -4.97 118.16 115.31 3a01 n LYS 223 Ca 0.01 0.18 -0.25 0.00 -2.87 0.00 0.00 58.31 55.38 3a01 n LYS 223 Cb 0.35 -3.68 -0.09 0.00 -1.84 0.00 0.00 35.03 29.76 3a01 n LYS 223 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3a01 s MET 224 N -7.12 2.01 0.83 1.97 -1.94 -0.96 -5.05 119.30 109.04 3a01 s MET 224 Ca 0.10 -1.85 -0.12 0.00 -1.71 0.00 0.00 55.69 52.11 3a01 s MET 224 Cb -0.05 -1.84 0.09 0.00 2.01 0.00 0.00 34.83 35.04 3a01 s MET 224 CO 0.96 0.09 1.16 0.95 -0.01 0.00 0.00 175.02 178.17 3a01 s THR 225 N -2.57 2.18 0.06 2.05 -4.23 -1.26 -4.30 115.64 107.57 3a01 s THR 225 Ca 0.35 0.06 -0.31 0.00 -1.18 0.00 0.00 61.69 60.61 3a01 s THR 225 Cb 0.02 -2.98 -0.18 0.00 1.34 0.00 0.00 72.50 70.70 3a01 s THR 225 CO 0.19 -0.08 1.53 0.44 -0.54 0.00 0.00 174.62 176.17 3a01 h ASP 226 N -1.15 -0.70 -0.89 3.99 3.32 -1.94 -2.92 116.42 116.13 3a01 h ASP 226 Ca -0.47 -0.00 0.24 0.00 0.02 0.00 0.00 57.03 56.82 3a01 h ASP 226 Cb 1.32 0.18 -0.14 0.00 0.22 0.00 0.00 39.33 40.91 3a01 h ASP 226 CO 0.64 -0.45 0.31 0.00 -1.72 0.00 0.00 179.24 178.02 3a01 h ALA 227 N -0.54 1.38 -0.40 3.45 0.00 -1.98 -0.52 119.26 120.65 3a01 h ALA 227 Ca -0.08 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3a01 h ALA 227 Cb 0.66 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3a01 h ALA 227 CO 0.14 -0.44 0.17 1.96 0.00 0.00 0.00 179.25 181.08 3a01 h GLN 228 N 0.27 0.59 -0.11 0.00 4.20 -1.92 0.76 115.11 118.90 3a01 h GLN 228 Ca 0.57 -0.10 -0.06 0.00 0.06 0.00 0.00 58.65 59.13 3a01 h GLN 228 Cb 1.15 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.83 3a01 h GLN 228 CO -0.61 0.54 -0.15 0.28 -0.67 0.00 0.00 178.83 178.22 3a01 h VAL 229 N 0.50 1.37 -0.95 -0.54 2.07 -1.13 0.26 116.25 117.83 3a01 h VAL 229 Ca 0.13 -1.36 0.18 0.00 0.82 0.00 0.00 66.70 66.48 3a01 h VAL 229 Cb 0.16 2.00 -0.10 0.00 -1.52 0.00 0.00 31.29 31.83 3a01 h VAL 229 CO -0.01 0.39 0.54 0.50 0.02 0.00 0.00 177.57 179.01 3a01 h LYS 230 N -0.12 0.68 0.03 1.57 3.64 -1.04 0.13 116.57 121.46 3a01 h LYS 230 Ca 0.01 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.08 3a01 h LYS 230 Cb 0.69 -0.15 0.02 0.00 -0.41 0.00 0.00 32.23 32.38 3a01 h LYS 230 CO 0.03 0.45 -1.08 1.15 -2.27 0.00 0.00 179.45 177.73 3a01 h THR 231 N 0.70 1.29 -0.71 1.00 2.02 -0.54 -1.52 112.91 115.14 3a01 h THR 231 Ca 0.54 -2.32 0.03 0.00 0.77 0.00 0.00 66.41 65.44 3a01 h THR 231 Cb 0.82 2.45 -0.05 0.00 -1.74 0.00 0.00 68.15 69.63 3a01 h THR 231 CO -0.38 0.71 0.44 -0.25 0.37 0.00 0.00 175.52 176.41 3a01 h TRP 232 N 0.36 0.82 -0.03 3.16 7.01 -0.36 0.22 115.95 127.13 3a01 h TRP 232 Ca -0.14 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 60.88 3a01 h TRP 232 Cb 1.74 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 28.53 3a01 h TRP 232 CO 0.10 0.46 0.00 0.74 -2.79 0.00 0.00 178.44 176.96 3a01 h PHE 233 N 0.85 0.06 -0.87 2.65 -1.00 -0.66 0.13 116.94 118.10 3a01 h PHE 233 Ca 0.29 -0.01 0.11 0.00 2.81 0.00 0.00 57.97 61.17 3a01 h PHE 233 Cb 0.04 -0.02 -0.08 0.00 3.61 0.00 0.00 35.95 39.51 3a01 h PHE 233 CO -0.04 0.31 0.50 0.37 -1.61 0.00 0.00 178.31 177.84 3a01 h GLN 234 N -0.22 0.79 -0.07 1.51 5.75 -0.76 -1.46 115.11 120.65 3a01 h GLN 234 Ca 0.01 -0.05 -0.17 0.00 -0.15 0.00 0.00 58.65 58.30 3a01 h GLN 234 Cb 0.29 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 3a01 h GLN 234 CO 0.00 0.52 -0.68 -0.91 -2.65 0.00 0.00 178.83 175.11 3a01 h ASN 235 N 0.81 0.35 -0.08 -0.69 2.35 -0.18 -2.62 115.58 115.53 3a01 h ASN 235 Ca 0.43 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3a01 h ASN 235 Cb 0.43 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 3a01 h ASN 235 CO -0.27 0.92 0.05 -0.09 -1.65 0.00 0.00 177.43 176.39 3a01 h ARG 236 N 0.21 0.11 -0.83 0.81 9.65 -0.04 -2.16 114.38 122.13 3a01 h ARG 236 Ca -0.02 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.90 3a01 h ARG 236 Cb 1.22 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.73 3a01 h ARG 236 CO 0.11 0.12 0.54 0.00 2.80 0.00 0.00 179.97 183.55 3a01 h ARG 237 N 0.06 0.94 -0.12 0.20 3.08 -1.18 0.28 114.38 117.64 3a01 h ARG 237 Ca 0.03 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3a01 h ARG 237 Cb 0.05 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 3a01 h ARG 237 CO -0.00 0.62 0.07 1.15 -1.07 0.00 0.00 179.97 180.73 3a01 h THR 238 N 0.97 1.08 -0.93 2.04 2.02 -1.25 -0.50 112.91 116.35 3a01 h THR 238 Ca 0.34 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 67.31 3a01 h THR 238 Cb 0.13 1.02 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 3a01 h THR 238 CO -0.11 0.07 0.62 0.50 0.37 0.00 0.00 175.52 176.96 3a01 h LYS 239 N 0.10 1.22 0.34 6.66 3.64 -0.64 -0.79 116.57 127.10 3a01 h LYS 239 Ca 0.04 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 3a01 h LYS 239 Cb 0.06 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 3a01 h LYS 239 CO -0.01 0.80 -0.16 2.35 -2.27 0.00 0.00 179.45 180.17 3a01 h TRP 240 N 1.25 -0.42 0.12 1.91 7.01 0.13 -0.41 115.95 125.55 3a01 h TRP 240 Ca 0.34 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.33 3a01 h TRP 240 Cb -0.14 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.06 3a01 h TRP 240 CO -0.01 -0.17 -0.06 0.00 -2.79 0.00 0.00 178.44 175.42 3a01 h ARG 241 N -0.60 -0.16 -0.09 2.65 3.08 -1.03 0.47 114.38 118.70 3a01 h ARG 241 Ca -0.05 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.04 3a01 h ARG 241 Cb 0.44 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 3a01 h ARG 241 CO 0.08 -0.05 0.29 -0.09 -1.07 0.00 0.00 179.97 179.12 3a01 h ARG 242 N -0.23 0.00 0.00 0.04 2.43 -1.05 -0.83 114.38 114.74 3a01 h ARG 242 Ca -0.02 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 3a01 h ARG 242 Cb 0.18 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 3a01 h ARG 242 CO 0.03 0.00 -0.79 1.96 -1.51 0.00 0.00 179.97 179.66 3a01 h GLN 243 N 0.00 0.00 0.00 0.20 4.20 -0.09 -3.26 115.11 116.16 3a01 h GLN 243 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3a01 h GLN 243 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3a01 h GLN 243 CO -0.00 0.58 0.00 2.41 -0.67 0.00 0.00 178.83 181.15 3a01 n THR 244 N -4.54 0.00 0.66 -0.54 -1.04 0.16 -0.46 114.28 108.51 3a01 n THR 244 Ca -0.19 0.91 0.00 0.00 -2.04 0.00 0.00 64.05 62.73 3a01 n THR 244 Cb 0.47 -1.40 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 3a01 n THR 244 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3a01 n ALA 245 N -1.23 1.86 -2.61 2.41 0.00 -0.45 -4.00 120.51 116.50 3a01 n ALA 245 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 3a01 n ALA 245 Cb 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.47 3a01 n ALA 245 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3a01 n GLU 246 N 0.07 5.30 0.00 0.00 2.13 0.39 -5.02 120.64 123.51 3a01 n GLU 246 Ca 0.00 -4.55 0.05 0.00 0.66 0.00 0.00 57.16 53.32 3a01 n GLU 246 Cb 0.10 -2.49 0.05 0.00 0.27 0.00 0.00 31.44 29.37 3a01 n GLU 246 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87